diff --git "a/data/67.csv" "b/data/67.csv"
--- "a/data/67.csv"
+++ "b/data/67.csv"
@@ -1,64939 +1,64292 @@
 product_name,product_smiles,heavy_atoms,r1_hashisy
-"""F3425039E82E1479_65D4BFD093857443_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(NCC(OC)=O)=O""",21,"""F6BB86EDAC317F0C"""
-"""01EA440D65417453_306A3F9B5089EB35_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)N2CCNC2=O""",21,"""F6BB86EDAC317F0C"""
-"""C9709256778E7D2D_4D32D39CD624EF94_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC=C(SC)C=C2""",21,"""F6BB86EDAC317F0C"""
-"""0EA0D85861C8056F_097837D042798318_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(NC(NCC)=O)=O""",21,"""F6BB86EDAC317F0C"""
-"""FD6AACF9916C5BF3_0996BB4BC7EE4F2A_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(NC(C(C)C)=O)=O""",21,"""F6BB86EDAC317F0C"""
-"""C1D28743370685AC_9D672FD5C2D17F6F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC=NNC(C(C)C)=O""",21,"""F6BB86EDAC317F0C"""
-"""358B162EB108FB48_78C539C621F08FD7_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC(=CC=C2)C#N""",21,"""F6BB86EDAC317F0C"""
-"""D739A56A8BB1C26B_1700F409D9EA6F9B_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(NC(C)C2CC2)=O""",21,"""F6BB86EDAC317F0C"""
-"""3213E9C5BDDE03C1_66D4962A2AE6CF40_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)N2CCOC2=O""",21,"""F6BB86EDAC317F0C"""
-"""36EBE9A690B69044_A7368DF07FD71D38_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC(=CC(=C2)C)C""",21,"""F6BB86EDAC317F0C"""
-"""AF735478BA8E602B_70CA330799A9B2D2_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)NC2=NN=CS2""",21,"""F6BB86EDAC317F0C"""
-"""C56E3D530442C01B_3FE302FA431CC1DE_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(C=CC=C2)C#N""",21,"""F6BB86EDAC317F0C"""
-"""BA03310301663199_2760CB61E0352FFE_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CSC(=N2)CCC""",21,"""F6BB86EDAC317F0C"""
-"""388DF94249EB5A21_26DC7A9BB45E301D_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC(=NO2)C3CC3""",21,"""F6BB86EDAC317F0C"""
-"""8F0FD692C0A236AE_408D5FBB367979F9_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NN=N[N]2C3CC3""",21,"""F6BB86EDAC317F0C"""
-"""8B65B1E1424BDB6E_1F52C5402D66FCDC_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC(=NO2)C(C)C""",21,"""F6BB86EDAC317F0C"""
-"""D3D77302C6D52B97_96303C0AB4AB7E3D_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)NC2=NOC=C2""",21,"""F6BB86EDAC317F0C"""
-"""E5C5C62A9C780906_141FAD3419DD1A54_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NOC(=N2)CCC""",21,"""F6BB86EDAC317F0C"""
-"""F3F8C3A7CAB2CA5C_70528252D2A80E1F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC(=NO2)CCC""",21,"""F6BB86EDAC317F0C"""
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-"""705ABCCC989F29C2_7501A3914F912738_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2C(SC=C2C)=O""",21,"""F6BB86EDAC317F0C"""
-"""68DA70F8E59A6976_44F15664104E073E_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2C(=O)CNC2=O""",21,"""F6BB86EDAC317F0C"""
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-"""17385285A803A867_A75324C8487BFDEC_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCOC2CCCCC2""",21,"""F6BB86EDAC317F0C"""
-"""A57CA6F0DB6CD7BB_3DB8731C983D9C4B_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(C=C(F)C=C2)F""",21,"""F6BB86EDAC317F0C"""
-"""6FAB4F3C4E583229_558DDA902CD827C2_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NN=N[N]2CCC""",21,"""F6BB86EDAC317F0C"""
-"""3CACF764F67C32CD_D481C78A05FBFF3C_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(N(CC)C2CC2)=O""",21,"""F6BB86EDAC317F0C"""
-"""AD16AF28B4C5FF09_2790B982B1EC4744_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CSC(=C2)[N](=O)=O""",21,"""F6BB86EDAC317F0C"""
-"""2A3954581B074B92_84058F27997F34A1_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCC2=C[N](C)N=C2""",21,"""F6BB86EDAC317F0C"""
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-"""1B26208FDA07257E_6CCA44135EEBEEA1_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCN2CCCC2=O""",21,"""F6BB86EDAC317F0C"""
-"""33C1874B618A4865_6453AE8A42D029A1_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NN=C(OCC)S2""",21,"""F6BB86EDAC317F0C"""
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-"""43497841285633D5_C7266972530FDC52_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCN2CCOC2=O""",21,"""F6BB86EDAC317F0C"""
-"""F45A6D25CCD229F4_A25A06E508F121D1_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCOCC(F)(F)F""",21,"""F6BB86EDAC317F0C"""
-"""F74496AC4DF79613_E7F4B98E3A222C3F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(NCCN(C)C)=O""",21,"""F6BB86EDAC317F0C"""
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-"""1F41EAAB70CB3E65_ED6BAD52B3734C33_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(OC)N=CC=C2""",21,"""F6BB86EDAC317F0C"""
-"""45931C3E92293D30_EEE291075E445D04_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCOCC2CCCO2""",21,"""F6BB86EDAC317F0C"""
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-"""111C513D1963AAC4_3F155CB29B3438CF_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NN=C(CCC)S2""",21,"""F6BB86EDAC317F0C"""
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-"""518E037930CC8583_3018757876DF96A8_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)C2=CN=CC=C2""",21,"""F6BB86EDAC317F0C"""
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-"""B585FC633CC48B0A_9F0045FCFC63B190_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NOC(=N2)C3CC3""",21,"""F6BB86EDAC317F0C"""
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-"""8E7C91DB0BDA7DAE_ED09903F90F7DD95_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(N=N[N]2CC)C""",21,"""F6BB86EDAC317F0C"""
-"""DCC96CC352C5AA6C_A4115AAB326BEFB2_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC=CC(=C2F)F""",21,"""F6BB86EDAC317F0C"""
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-"""01A9178AFD439B4B_73504FC6A3DF1A40_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC(=NO2)C(F)F""",21,"""F6BB86EDAC317F0C"""
-"""22CCC941B111570E_065B02D3B6B6DB6F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2=NC=C[N]2C)=O""",21,"""F6BB86EDAC317F0C"""
-"""404088C39DD02995_1821F4419AB16D82_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC(=C(N=C2)Cl)F""",21,"""F6BB86EDAC317F0C"""
-"""E3D4D2D301D54872_9E31459AB9027F8F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2=NON=C2C)=O""",21,"""F6BB86EDAC317F0C"""
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-"""DC7894B16569CAD0_DE4AF809C9685E11_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC=C(C=C2)C#N""",21,"""F6BB86EDAC317F0C"""
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-"""1979CADC6A6330A1_EDAF8E4036EBE100_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2COCC(C)(C)O2""",21,"""F6BB86EDAC317F0C"""
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-"""2882851E2FFEBD71_613AD5FDFA5EE273_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)C[C@@H]3C[C@H]2COC[C@H]2O3""",21,"""F6BB86EDAC317F0C"""
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-"""29D97882DA38A120_0181684F3A94FC14_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC(C)(C)C(F)(F)F""",21,"""F6BB86EDAC317F0C"""
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-"""708F9FEB5E030A2B_4CE90D4428BC3A79_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CSC3=CN=C[N]23""",21,"""F6BB86EDAC317F0C"""
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-"""24FA03126B62F276_3B34A30DF38639ED_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2C[C@H]([C@@H](C)C2)C""",21,"""F6BB86EDAC317F0C"""
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-"""00AA76FD253D7A62_4713CEA17449E194_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2CCCNC2)=O""",21,"""F6BB86EDAC317F0C"""
-"""F12D7CB8F5FE7E75_D4641487011C6497_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC(=NO2)COC""",21,"""F6BB86EDAC317F0C"""
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-"""834A4CB71567E6B3_B5127617BA6E3D27_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(CCN)OC=N2""",21,"""F6BB86EDAC317F0C"""
-"""2DEEC60DF2529532_D00C85E1324616C4_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2=CN=C(C)C=C2""",21,"""F6BB86EDAC317F0C"""
-"""C293B93ED4D20C65_26A341A9C1607F9C_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(C)C=C(N=C2)F""",21,"""F6BB86EDAC317F0C"""
-"""0B2BF10194B94DBB_FE53DC556607927B_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2CNC(CO2)(C)C""",21,"""F6BB86EDAC317F0C"""
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-"""BD7652D3CFA811A2_DA12CB6185DA48E7_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCOC(C#N)C2CC2""",21,"""F6BB86EDAC317F0C"""
-"""E78020CCEFB1B337_69539D462B0C66BB_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2CC(=NO2)C3CC3""",21,"""F6BB86EDAC317F0C"""
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-"""598FCE80C4083A30_5444C6AD72A4D6DF_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC(=CC=C2)C#N""",21,"""F6BB86EDAC317F0C"""
-"""48066704B50FD873_3A62B3522C1ED42B_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NNC(=O)NC2=O""",21,"""F6BB86EDAC317F0C"""
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-"""54ECCED66E9ED218_AF2F5B7465617531_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2CCN(C)CC2""",21,"""F6BB86EDAC317F0C"""
-"""CFCBDC7026A979D2_A24FF330D64FC2C4_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NOC(=C2C)CC""",21,"""F6BB86EDAC317F0C"""
-"""3400810F373812AB_52D16CD092AA26D7_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)C[C@H]2CNCC(O2)(C)C""",21,"""F6BB86EDAC317F0C"""
-"""F777E8829D01FD80_345C23D156BAFE93_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NOC(=C2)C(F)F""",21,"""F6BB86EDAC317F0C"""
-"""BA3B2A3478B4450A_4E7C0C0386DB7ECB_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(F)C2CCOCC2""",21,"""F6BB86EDAC317F0C"""
-"""FEC25323F477A32D_58C42ED7BB9989B3_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)C[C@@H]2CNCC(O2)(C)C""",21,"""F6BB86EDAC317F0C"""
-"""82104CC1E76101F5_DBFE484028E49CB8_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2=C(C)OC=N2)=O""",21,"""F6BB86EDAC317F0C"""
-"""BFC0F1C2963C393E_E26F2CF50EAB36D6_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=N[N](CCF)C=C2""",21,"""F6BB86EDAC317F0C"""
-"""B31612555E401307_B515F422ABE7CDA4_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CN=C(O2)C3CC3""",21,"""F6BB86EDAC317F0C"""
-"""B4B0451ACD7842A9_DA9DECC7CA00DBED_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(N(CC)C(C)C)=O""",21,"""F6BB86EDAC317F0C"""
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-"""F376D79ACC247B31_C4342025434C750A_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NOC(=N3)CCCC""",21,"""DC6EF671815BAD1F"""
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-"""6C77D840DF9B8808_C16D1C977365CC00_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC4=C(C=C3)OCC4""",21,"""DC6EF671815BAD1F"""
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-"""F617FDE7F73725E1_1B261D11ECF1106C_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(C(OC)=O)NC(=O)C""",21,"""DC6EF671815BAD1F"""
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-"""F772D60F1CFF15A9_BAF926C6D4625924_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCCOC(NC(N)=O)=O""",21,"""DC6EF671815BAD1F"""
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-"""8961509373B8AE67_C9B07ABC1D3117A2_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=N3)N(C)C""",21,"""DC6EF671815BAD1F"""
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-"""351CA3EACB410BBA_CC8A0405E6C12B56_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CSC(=N3)C(F)(F)F""",21,"""DC6EF671815BAD1F"""
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-"""CDCA9120100392B6_DE2A1AB883A902CE_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=C3F)C#N""",21,"""DC6EF671815BAD1F"""
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-"""192E7389A85EEDE9_0A7164E4494D92D5_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4=NC3=C(N=CC=C3)S4""",21,"""DC6EF671815BAD1F"""
-"""E996EF2BE40AB674_8CDAEE3DEC1C10AF_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=C(CCC)C=C3""",21,"""DC6EF671815BAD1F"""
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-"""F15E32E6FEF0C202_26AFAF634D614FD9_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NC3=CC=CC=C3""",21,"""DC6EF671815BAD1F"""
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-"""D10DA19C9944FD73_F6C047B67F9D2326_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=N[N]3CC4CC4""",21,"""DC6EF671815BAD1F"""
-"""77FBB60CD89A2D04_ED42ECAE21DDC990_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=C3)[N](=O)=O""",21,"""DC6EF671815BAD1F"""
-"""8E5E81D4A23B20BE_F837E99CCF885300_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=C([N](=O)=O)C=C3""",21,"""DC6EF671815BAD1F"""
-"""4EE9B53921749FC4_21AE4589DC71006B_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C[N](C)N=C3C(F)F""",21,"""DC6EF671815BAD1F"""
-"""1CD0ECB288460897_E70A37912BA37CB0_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCCCC3=CC=CC=C3""",21,"""DC6EF671815BAD1F"""
-"""0F02AD51D3E867E4_84FFEBC64FA3AC3C_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(N(CC)CC(=C)C)=O""",21,"""DC6EF671815BAD1F"""
-"""A5C131782BDC6842_E44875188041D9C7_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C)C=C(C=C3)C#N""",21,"""DC6EF671815BAD1F"""
-"""3DFF42E7E1CAC7E8_5CC216CE5C67AC39_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=C3C#N)F""",21,"""DC6EF671815BAD1F"""
-"""7CA0AD18D2E6BDB4_22984C23A4832AEC_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C(F)(F)F)[NH]N=C3""",21,"""DC6EF671815BAD1F"""
-"""A3C6C13725574783_D7A930F2DBDC8B29_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCN3CC[S](CC3)(=O)=O""",21,"""DC6EF671815BAD1F"""
-"""888161FF5E2FC841_DCC3F38EA489991D_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=C([S](C)(=O)=O)S3""",21,"""DC6EF671815BAD1F"""
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-"""C9EBA14091FC47C8_692DCE6BC95EC013_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4CCC3(CC3)C(=O)O4""",21,"""DC6EF671815BAD1F"""
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-"""A241BC19BC36B148_4BA669C51DD29718_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=C4[N]3CCCC4""",21,"""DC6EF671815BAD1F"""
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-"""33F406D0A1757741_0DFFFE42D5309109_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCCC3=CC(=NO3)CC""",21,"""DC6EF671815BAD1F"""
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-"""F3D829BD1B8A5C2C_AB666B1A95E98E46_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=C(C(OC)=O)O3""",21,"""DC6EF671815BAD1F"""
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-"""1551F0E39FB39EC7_7F91962DF6F89A3F_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCC3(CCCCC3)C#N""",21,"""DC6EF671815BAD1F"""
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-"""28F407DC36B1800F_E20750EF667E0304_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCC3=C(F)C=CC=C3F""",21,"""DC6EF671815BAD1F"""
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-"""25813CB40A50D6FD_6EA8EE0364B83DD6_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCN3NC(=O)C=CC3=O""",21,"""DC6EF671815BAD1F"""
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-"""D7DA3A5986055D44_FB428CCEDB0AD305_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4=N[N]3CCCCC3=C4""",21,"""DC6EF671815BAD1F"""
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-"""99C8F4D7592412F9_F28545958D1B6FE6_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C[N](C(C)(C)C)N=C3""",21,"""DC6EF671815BAD1F"""
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-"""BBC8D951486BA727_28276B91EC42D29F_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCOCC3=CC=CC=C3""",21,"""DC6EF671815BAD1F"""
-"""911116D96CA713F0_C8D1289502995D52_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC[P](N(C)C)(=O)N(C)C""",21,"""DC6EF671815BAD1F"""
-"""D64878E698718D96_EA0DD4D8DAF160A9_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(N=[S](N(C)C)(=O)C)=O""",21,"""DC6EF671815BAD1F"""
-"""97A8D06A763D4647_6AC266A210205D01_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCSC3=CC=CC(=C3)C""",21,"""DC6EF671815BAD1F"""
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-"""413909219075663C_9DE867347D294608_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=COC(=C3)[S](N)(=O)=O""",21,"""DC6EF671815BAD1F"""
-"""C341E6CC77170745_F5C257E7EEB171B0_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(OC)C3CCCCC3""",21,"""DC6EF671815BAD1F"""
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-"""2B79524C50B85EBD_AD596FC1868394D2_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=C3)C(C)C""",21,"""DC6EF671815BAD1F"""
-"""399B8A1D369C2318_AAB2652B14ADC14A_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=COC(=C3)[S](C)(=O)=O""",21,"""DC6EF671815BAD1F"""
-"""7A67852B5E2E69A7_249EA2353F171EF9_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCC#CC3=NC=CC=C3""",21,"""DC6EF671815BAD1F"""
-"""C5535709B46BA32C_64B244E486889880_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC(=CC=C3)N=[N]#N""",21,"""DC6EF671815BAD1F"""
-"""ABF22E8F3D55B67D_6AC9C643F4F2705F_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NC(=NO3)C4CCC4""",21,"""DC6EF671815BAD1F"""
-"""98C8A2241E48EF6E_6422AB578370FB85_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC(=C(C)C=C3)C#N""",21,"""DC6EF671815BAD1F"""
-"""0B23024BF70158B7_96E04219E524EAA5_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(N=C(C)C=C3C)C""",21,"""DC6EF671815BAD1F"""
-"""B0FE7E37A0413A2F_F2467E6DD0CA5EDA_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=C3C)OC""",21,"""DC6EF671815BAD1F"""
-"""F3D6D2B32BC6653C_E491E893F8D5F541_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NC(=NO3)CC4CC4""",21,"""DC6EF671815BAD1F"""
-"""A5CC4E0981431366_4AC397DB1127069C_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=C(C(C)(C)C)O3""",21,"""DC6EF671815BAD1F"""
-"""3F897D9BD12033B9_917F63F8F3F9910F_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C=CC=C3)N=[N]#N""",21,"""DC6EF671815BAD1F"""
-"""C71A19E59FABF104_A2B37DE02541090B_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C(OC)=O)C=CS3""",21,"""DC6EF671815BAD1F"""
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-"""0C7C5D68D9074E08_B67BC44725252FC0_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(C3=C(F)C=CC=C3)=O""",21,"""DC6EF671815BAD1F"""
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-"""71FC62283850FD4B_50268358B38FD006_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C([N](=O)=O)N=CC=C3""",21,"""DC6EF671815BAD1F"""
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-"""AD7F4FE34CBF99F8_192BF76DF3319F02_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4CCC3(CCC3)CO4""",21,"""DC6EF671815BAD1F"""
-"""9CC4083134467D4F_2911783ECCD0E43A_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CN=C(N=C3)C4CC4""",21,"""DC6EF671815BAD1F"""
-"""D08E704A63CFE8DA_D4135E82D144077B_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=COC(=N3)C(C)(C)C""",21,"""DC6EF671815BAD1F"""
-"""1AFC3C42CDA97EBF_9911FB9FC76D9F18_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NC3=NC=CC=N3""",21,"""DC6EF671815BAD1F"""
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-"""734730148F48FC9B_5AD125BD53881391_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=COC(=N3)C(F)(F)F""",21,"""DC6EF671815BAD1F"""
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-"""3856910C63AB1AD4_6E964AEF65BA14B6_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3CCC(C(F)(F)F)O3""",21,"""DC6EF671815BAD1F"""
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-"""7EE749B0ACCD3A6A_62FEA051BE2B9F63_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NC3CCCCC3""",21,"""DC6EF671815BAD1F"""
-"""26BC3B519ACB52CF_B71DBB8F9C39592C_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCOC3=C(F)C=CC=C3""",21,"""DC6EF671815BAD1F"""
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-"""57809CC8BF7CA900_CEB6FE04FA58AB72_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(SCC)C=CC=C3""",21,"""DC6EF671815BAD1F"""
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-"""0CDA74D674FB0584_4CEF1CA4302018A2_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C[N](C(C)C)N=C3C""",21,"""DC6EF671815BAD1F"""
-"""8635C11B5C570959_69B0C513553D1E3D_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4CCCC3(CCC3)O4""",21,"""DC6EF671815BAD1F"""
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-"""3B7C2826C0377E88_CE7710A99ECCD773_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C(C)C)C=CC=C3""",21,"""DC6EF671815BAD1F"""
-"""D79D23127D45E610_1E3EEC24EF00519D_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)C3=CC=CNC3=O""",21,"""DC6EF671815BAD1F"""
-"""C338BB4B54D5D53F_9B22D369C9E5562F_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(C3=C(N=C(C)S3)C)=O""",21,"""DC6EF671815BAD1F"""
-"""1DF1FD045878FA81_10AF41EB484646DC_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCCCC3(CCC3)C#N""",21,"""DC6EF671815BAD1F"""
-"""92B51CF1776D9B6C_AA9DF75E9657FAFB_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(ON=C3C)C4CC4""",21,"""DC6EF671815BAD1F"""
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-"""F5D654158B1676B6_B480CE13726FC7AA_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3OC(=O)CC34CCC4""",21,"""DC6EF671815BAD1F"""
-"""B5FF7ED7BB622436_7BEDC21D8125BEA5_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CCC3(C(O)=O)CCOC3""",21,"""DC6EF671815BAD1F"""
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-"""0B2C6ED379759855_0E8BC6AFC1A0137B_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=N[NH]C4=C3COCC4""",21,"""DC6EF671815BAD1F"""
-"""5B27129888214AC8_0332297CC94646F8_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C(F)F)C=CC=C3""",21,"""DC6EF671815BAD1F"""
-"""F3CD59A44E7E96D4_4746C03B78E6D818_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CSC(=N3)COCC""",21,"""DC6EF671815BAD1F"""
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-"""83B81F0ED5AA6B5E_C4EA7B36A2F816BE_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC34OCC(C)(CO3)CO4""",21,"""DC6EF671815BAD1F"""
-"""E8DF2E9ED3201885_F75605670D49EA37_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C([N](C)N=N3)C(F)F""",21,"""DC6EF671815BAD1F"""
-"""7C6CE83B0CC324EA_9A824245E576A9E2_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC(=NC=C3)OCC""",21,"""DC6EF671815BAD1F"""
-"""1D342E41DF21E57F_4D1C2FE10A896B2E_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NC(=NO3)C4CNC4""",21,"""DC6EF671815BAD1F"""
-"""975FD8F0D425839C_9A822801AF41E069_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC[S](CCC(O)=O)(=O)=O""",21,"""DC6EF671815BAD1F"""
-"""33D989C268AC3789_443859220279618B_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CC3=N[NH]C4=C3C=CC=C4""",21,"""DC6EF671815BAD1F"""
-"""0EFB762D2AD1C5CF_D5EC8817BF56F58E_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCO[S](C(F)(F)F)(=O)=O""",21,"""DC6EF671815BAD1F"""
-"""A280A3E67E93A27A_908B5CD9316F751A_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4=C3SC=CC3=CC=C4""",21,"""DC6EF671815BAD1F"""
-"""C3A17676B3303EF1_6576AB9C53508E50_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC4=NC=N[N]34""",21,"""DC6EF671815BAD1F"""
-"""308FC70AFA6F05C4_7753B02817E96328_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3CCC(F)(F)C(N3)=O""",21,"""DC6EF671815BAD1F"""
-"""E37423212839511A_6A66F3082E696B49_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=C[N]4C3=NC=C4""",21,"""DC6EF671815BAD1F"""
-"""DC5EE53CBEACD86B_C866930765CE7294_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4CC3COCCC3O4""",21,"""DC6EF671815BAD1F"""
-"""05A68043CC8E7A34_B1EEF00AE916F925_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)CCC3CCCC3""",21,"""DC6EF671815BAD1F"""
-"""03D24129EB50D345_193381180F7FEFAE_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(C3=C(C)SC(=C3)C)=O""",21,"""DC6EF671815BAD1F"""
-"""0967F00EFB0C2F5B_A94CABBAE175B520_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCC[S](CCOC)(=O)=O""",21,"""DC6EF671815BAD1F"""
-"""25517A37954DF076_D2D5BA5320A56927_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CSC(=N3)NC(C)=O""",21,"""DC6EF671815BAD1F"""
-"""3E4698EAAA2D1959_276589061FCDD8D5_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=N[N]3C4CCC4""",21,"""DC6EF671815BAD1F"""
-"""E6AADE69C7C09649_19B3853B84C4FB15_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NOC(=N3)CC(C)C""",21,"""DC6EF671815BAD1F"""
-"""1FE2786BFC9D9936_AE07E0E9D952C528_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCOC3=C(C)C=CC=C3""",21,"""DC6EF671815BAD1F"""
-"""10F960A160D6D6CD_058B84C6A9FC91D1_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=N[N]3CCCC""",21,"""DC6EF671815BAD1F"""
-"""8F621ABAE0EA4A5C_32EB8818E603E36C_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=C(C(F)(F)F)O3""",21,"""DC6EF671815BAD1F"""
-"""DD1FE0B3B0693028_CEAD51B0EEDC2AEC_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC(=C(F)C=C3)C#N""",21,"""DC6EF671815BAD1F"""
-"""24C6BF02E9B4D510_E15763DF4CC3691E_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C([S](C)(=O)=O)SC=C3""",21,"""DC6EF671815BAD1F"""
-"""0DB85428646D9B2E_9CC00BF6C50C03E5_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=C([S](C)(=O)=O)O3""",21,"""DC6EF671815BAD1F"""
-"""1FDCDD5067A85E5A_C4E04D16B0B3BC21_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NSC4=C3C=CC=C4""",21,"""DC6EF671815BAD1F"""
-"""0A3701904AF61D83_A0B4560A1B44CB82_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(OC=N3)C4CCC4""",21,"""DC6EF671815BAD1F"""
-"""F3B2D7BCE8001B57_931ECFDEDB7984EE_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCOC3(CCOC3)C#N""",21,"""DC6EF671815BAD1F"""
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-"""FC5125962BD13944_A129DB378E333F07_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4=NC3=C(CCCC3)[NH]4""",21,"""DC6EF671815BAD1F"""
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-"""5CAC45CFA20B82BC_7698A52D34282538_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4=CC3=NSN=C3C=C4""",21,"""DC6EF671815BAD1F"""
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-"""317B548E8AE3F45F_06154DE37BF251A2_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(OC)C3CCCOC3""",21,"""DC6EF671815BAD1F"""
-"""09E870F4ED29CD9B_6D25FAD3320791A2_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=N3)CCC""",21,"""DC6EF671815BAD1F"""
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-"""51823CFF44D19685_C5609AEB0EBFF7F1_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC4=NC=C[N]34""",21,"""DC6EF671815BAD1F"""
-"""05F1992D1BD17A29_1B40CCE354954BC2_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)C[C@@H]3O[C@H]3C4=CC=CC=C4""",21,"""DC6EF671815BAD1F"""
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-"""2FB820CEA91132F4_43287C45B168173B_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NSC(=C3)C(F)(F)F""",21,"""DC6EF671815BAD1F"""
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-"""0FCEF44101A46094_37DDABD9A756F83C_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC(=NO3)C4CNC4""",21,"""DC6EF671815BAD1F"""
-"""C2AE9A2B21DE5CC5_5219A5302601CBAC_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC4=C(C=C3)C=CO4""",21,"""DC6EF671815BAD1F"""
-"""099112C18D4D5E1A_95B79B2DB6C42B66_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CC(N3CCNCC3C)=O""",21,"""DC6EF671815BAD1F"""
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-"""0FB77A5A80CD163C_6BE4EB1F1D151506_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CCC3(CCNCC3)C#N""",21,"""DC6EF671815BAD1F"""
-"""010218376F659B87_D322FE676E0E38C6_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=C4C=CC=N[N]34""",21,"""DC6EF671815BAD1F"""
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-"""5A4FFAAADA10542D_320595B2153BCB7C_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CC(N3CC(C)NCC3)=O""",21,"""DC6EF671815BAD1F"""
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-"""DDDE3C881FBED0AC_6F14980DD10EA383_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC(=NC(=C3)C)OC""",21,"""DC6EF671815BAD1F"""
-"""3F8094A7BDAAF1C6_2B4C149E45A603C8_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CC3CNCC4(O3)CCC4""",21,"""DC6EF671815BAD1F"""
-"""A396921C32BB5D4E_21532EE92E77D975_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC(=NC(=N3)OC)C""",21,"""DC6EF671815BAD1F"""
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-"""73D606D698A12F93_0428438298232DE4_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C4C(=N[NH]3)CCCC4""",21,"""DC6EF671815BAD1F"""
-"""BA56238353125A55_BE9ADC4737B458E4_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCC3=C([N](N=C3C)C)C""",21,"""DC6EF671815BAD1F"""
-"""E1DC1889C11865CF_0BA39F64656197BD_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C(OC)=O)SN=C3""",21,"""DC6EF671815BAD1F"""
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-"""4E29854AD3B63BBB_18F1AA8CC1A3D107_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(C3(C(F)(F)F)CC3)=O""",21,"""DC6EF671815BAD1F"""
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-"""CE3AD41FF0476665_EA4A13F43747758D_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(SN=C3OC)OC""",21,"""DC6EF671815BAD1F"""
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-"""1ECB7B25FD0A016F_B6674CBE4833800F_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NO[C@@H]4CCCC[C@H]34""",21,"""DC6EF671815BAD1F"""
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-"""500168D30E3AC756_033423F6896FEB03_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCCC[S](C)(=O)=O""",21,"""549D54927626150A"""
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-"""78998FE422790184_9BD629D105CE3EE4_6039_UN""","""O(CCOCCN=[N]#N)CCCCCCCCCCCC""",21,"""5B32D544AE694BD0"""
-"""D66A5005E778E5B0_1C5C17932F9968CF_6039_UN""","""O(CCOCCN=[N]#N)CC(N1CCC(C(N)=O)CC1)=O""",21,"""5B32D544AE694BD0"""
-"""A10402147F670DF7_F569B19CEB258099_6039_UN""","""O(CCOCCN=[N]#N)CCCC2=NC1=C(C=CC=C1)O2""",21,"""5B32D544AE694BD0"""
-"""A48E3881BACA3098_F655D99FA2D92422_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=CC(=C(C)C=C1C)C)=O""",21,"""5B32D544AE694BD0"""
-"""745B9845DC7F453E_D82FB0E4BF051429_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=C(C=C(C)C=C1)F)=O""",21,"""5B32D544AE694BD0"""
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-"""2F70B76ED22B3347_C2630089F7DD5C83_6039_UN""","""O(CCOCCN=[N]#N)CCOC1=CC=C(OCC)C=C1""",21,"""5B32D544AE694BD0"""
-"""9D36B764EE1D2C60_F9046B6BA0F1D25B_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NC(=O)NC1CCCC1""",21,"""5B32D544AE694BD0"""
-"""17FC43E4415F02E5_9AAD8BB4DA0EB56B_6039_UN""","""O(CCOCCN=[N]#N)CC(NC(CCCC(C)C)C)=O""",21,"""5B32D544AE694BD0"""
-"""1199D32CAF9EDE70_FD38BF44733C51ED_6039_UN""","""O(CCOCCN=[N]#N)CCN[S](=O)(=O)C1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""EF90A3D64881D249_9D721A12623D82A5_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=C(C=C(C)C=C1C)C)=O""",21,"""5B32D544AE694BD0"""
-"""3DAE234DC4894F69_98B73E8AA2AB8240_6039_UN""","""O(CCOCCN=[N]#N)CC1=COC(=N1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
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-"""71B80C182CE81A6A_D595EFD23E7BF9FE_6039_UN""","""O(CCOCCN=[N]#N)CCC23CC1CC(CC(C1)C2)C3""",21,"""5B32D544AE694BD0"""
-"""AA325C7D4D944595_498F9F48CE1C5F17_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC=C(O1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
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-"""4A42E9D8BC1FE01C_CBEDE816848D1DF7_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=C(OC)C=C(C=C1)C)=O""",21,"""5B32D544AE694BD0"""
-"""52F1FFF71D7A3A12_9797B8ED5A2A4907_6039_UN""","""O(CCOCCN=[N]#N)CC1=NOC(=N1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""140B5D291DC3A533_0F0B60FC3ED629A8_6039_UN""","""O(CCOCCN=[N]#N)CC(N[C@@H](CC(C)C)C(=O)O)=O""",21,"""5B32D544AE694BD0"""
-"""028D087CCE027F3B_CF5CA6FD009FA9F5_6039_UN""","""O(CCOCCN=[N]#N)CCC(NC1=CC=C(F)C=C1)=O""",21,"""5B32D544AE694BD0"""
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-"""E312871F7DB19D89_B960D4AA4732AAC6_6039_UN""","""O(CCOCCN=[N]#N)CC1=CSC(=N1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""B16746F0D0DBA7C9_6A8E0724B5B36F98_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=CC=C(CC(N)=O)S1)=O""",21,"""5B32D544AE694BD0"""
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-"""FDFD9CC636E33104_293ADA647D35ECA3_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NCC(=O)N1CCCC1""",21,"""5B32D544AE694BD0"""
-"""816D2A489AC49A66_588B0F57E9C3E54B_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=CC(=C(C=C1[NH]2)F)F""",21,"""5B32D544AE694BD0"""
-"""70539BD50265E331_F0D620AC8E672281_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=C(OC)C=CC(=C1)F)=O""",21,"""5B32D544AE694BD0"""
-"""EF091553A6388465_1630DEB4744E84FA_6039_UN""","""O(CCOCCN=[N]#N)CCCOC1=CC=C(OC)C=C1""",21,"""5B32D544AE694BD0"""
-"""3C5326D32AFB84E1_3F66D274BEA0FAC7_6039_UN""","""O(CCOCCN=[N]#N)CC(N(CCCC)CCCC)=O""",21,"""5B32D544AE694BD0"""
-"""3E3CD78FE940D33B_6FE804E9ECA2E5A5_6039_UN""","""O(CCOCCN=[N]#N)CC(N(C1CCC(C)CC1)C)=O""",21,"""5B32D544AE694BD0"""
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-"""74C112BA4B59FF02_A4478DB277533920_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=CC=N[N]1C(C)C)=O""",21,"""5B32D544AE694BD0"""
-"""40F815B1B197001B_18D3BC5A38FCE173_6039_UN""","""O(CCOCCN=[N]#N)CC1=NOC(=C1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""66F5D71C4E9058AA_B1B3716F32292C57_6039_UN""","""O(CCOCCN=[N]#N)CC(N(C)CC1=CC=C(C)O1)=O""",21,"""5B32D544AE694BD0"""
-"""6AC04E2173705460_F537754937734C53_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC(=NO1)C2=CN=CC=C2""",21,"""5B32D544AE694BD0"""
-"""47E40876ED255B3F_528F66FF46120425_6039_UN""","""O(CCOCCN=[N]#N)CCCN1C(NC(C)(C)C1=O)=O""",21,"""5B32D544AE694BD0"""
-"""AF9C3A510C22B3B0_9ADD6DCED1E39EA4_6039_UN""","""O(CCOCCN=[N]#N)CCOC1=CC=CC(=C1)[N](=O)=O""",21,"""5B32D544AE694BD0"""
-"""12053EC94B82C209_39D44C734D376B90_6039_UN""","""O(CCOCCN=[N]#N)CCOC1=C(OCC)C=CC=C1""",21,"""5B32D544AE694BD0"""
-"""AEEE8CAB3FC08409_B7F5349585D5C4DE_6039_UN""","""O(CCOCCN=[N]#N)CCOCCOC1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""2C2526A5A213913B_B58EF38A53B37885_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=CC2=C1N=CC=C2)F""",21,"""5B32D544AE694BD0"""
-"""F19DF9B81249DAB8_01D9AA0B2C26AA74_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NOCC1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""A4F2EE496E8A8D34_4B3B6674FC5515CA_6039_UN""","""O(CCOCCN=[N]#N)CC1=C[N](N=C1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""EC0E2B6D206FD56F_CB4D36A4FD2324DE_6039_UN""","""O(CCOCCN=[N]#N)CC(NC(NCC(F)(F)F)=O)=O""",21,"""5B32D544AE694BD0"""
-"""E263BF47F653DD25_2F8EE95FCF1CA0DA_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=C([N](CC)C(=C1)C)C)=O""",21,"""5B32D544AE694BD0"""
-"""DA86941B9BC94A5D_22429CB58981B4EC_6039_UN""","""O(CCOCCN=[N]#N)CC(NCC1=C(F)C=CC=C1)=O""",21,"""5B32D544AE694BD0"""
-"""78758F012F4B92B4_F6F9BE3EF836B8D6_6039_UN""","""O(CCOCCN=[N]#N)CC2=C(C)N=C1C=CC=CC1=N2""",21,"""5B32D544AE694BD0"""
-"""035759C46DA7B602_85014D3A4365381A_6039_UN""","""O(CCOCCN=[N]#N)CC1=CN=C(S1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""2579FE19DF5C0227_E51356A1C54B4877_6039_UN""","""O(CCOCCN=[N]#N)CC(N(C)C1CC[S](=O)(=O)C1)=O""",21,"""5B32D544AE694BD0"""
-"""DFDF83BA4F86184F_652D9036559A6D9D_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=CC=C(C(C)C)C=C1)=O""",21,"""5B32D544AE694BD0"""
-"""5525BA25B20D6254_D05E81DD2373D7B9_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C(C#N)C1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""0613CC102C9191F9_E0FDD04DF173D366_6039_UN""","""O(CCOCCN=[N]#N)CCOC1=CC=C([N](=O)=O)C=C1""",21,"""5B32D544AE694BD0"""
-"""6A90B53C3305E457_C9889AD4D26D8775_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=CC(=CC(=C1)F)F)=O""",21,"""5B32D544AE694BD0"""
-"""98E2086A428C4227_30409FF63C49B5C6_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C1=CC2=C(C=C1)OCC2""",21,"""5B32D544AE694BD0"""
-"""52457605C8C4AD18_BA365D37D0D6FE06_6039_UN""","""O(CCOCCN=[N]#N)CCCOCCC1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""CCEF1912E6BEAF27_72BAD7CB188EA26E_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=C[N](C)C(=C1)C(=O)N)=O""",21,"""5B32D544AE694BD0"""
-"""57F3565E26372BDD_FEC795FBD7C2442B_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NC1=NN=C(O1)C2CC2""",21,"""5B32D544AE694BD0"""
-"""B52086077D6B5BD9_51340ECB6E657EE0_6039_UN""","""O(CCOCCN=[N]#N)CC1=CSC(=N1)C2CCCCC2""",21,"""5B32D544AE694BD0"""
-"""5F87EED1194C44FB_ED099B6E90C6208D_6039_UN""","""O(CCOCCN=[N]#N)CC1=CSC(=N1)C2=CC=C(C)O2""",21,"""5B32D544AE694BD0"""
-"""3EA8CE3924BDF1DE_D9D96C6E5D242F96_6039_UN""","""O(CCOCCN=[N]#N)CC1=CSC(=N1)CC(N(C)C)=O""",21,"""5B32D544AE694BD0"""
-"""96BC7646FA4CEE2A_846B4D386D369D65_6039_UN""","""O(CCOCCN=[N]#N)CC(NCC1=CC=CC(=C1)F)=O""",21,"""5B32D544AE694BD0"""
-"""2F13C60F7D66AB43_1925C366DB72CB62_6039_UN""","""O(CCOCCN=[N]#N)CC(N(C)CC1CCCCC1)=O""",21,"""5B32D544AE694BD0"""
-"""27693006579D7E38_324712BA98AE7FFF_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NCCC1CCCCC1""",21,"""5B32D544AE694BD0"""
-"""21E8B36F162180C2_95B3B8C1C5988C71_6039_UN""","""O(CCOCCN=[N]#N)CC(NCC1=CC=C(CC)S1)=O""",21,"""5B32D544AE694BD0"""
-"""6C1F3CB538BA311B_CA36F7FF6F531DE1_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NC2=NC1=C(CCC1)S2""",21,"""5B32D544AE694BD0"""
-"""C2D8BD67097A63C7_B444B8C15ECE0012_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)N(C1CC1)C2CCCC2""",21,"""5B32D544AE694BD0"""
-"""CDB791DDAC7490F0_F40805108C856528_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=CC=N[N]1CCC)=O""",21,"""5B32D544AE694BD0"""
-"""5E31F1B2FDE75A04_40F807D7E4B1DB73_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NCC1CC[S](=O)(=O)C1""",21,"""5B32D544AE694BD0"""
-"""CBA8F4A2CAFE0709_E833BF50AC3CE099_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=CC(=C1)C(N(C)C)=O""",21,"""5B32D544AE694BD0"""
-"""5FBAD2E45C1A38EA_5E67F3BF5F376A6E_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=C(C=N[N]1C)C(N2)=O""",21,"""5B32D544AE694BD0"""
-"""032DD66D02B78131_CC4E2B5F3C742291_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=NC(=C(S1)C)CC)=O""",21,"""5B32D544AE694BD0"""
-"""D831D6C035A3B92A_EC0A4657F47D9C85_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C([S](N(C)C)(=O)=O)O1""",21,"""5B32D544AE694BD0"""
-"""555CC0B4F97C2D21_80DEE978539566EC_6039_UN""","""O(CCOCCN=[N]#N)CC1=N[N](C=C1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""39F12E0D3D65DEE0_82C420A059749DA2_6039_UN""","""O(CCOCCN=[N]#N)CCC1=CC=C([S](N)(=O)=O)C=C1""",21,"""5B32D544AE694BD0"""
-"""1AAF79F41FF6B56A_964F123399E9C5BE_6039_UN""","""O(CCOCCN=[N]#N)CC(NCCOCCC(C)C)=O""",21,"""5B32D544AE694BD0"""
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-"""19B141F019A8EE43_B9EBDD29D7DEE606_6039_UN""","""O(CCOCCN=[N]#N)CC2=C[N]1C=CC=CC1=C2C#N""",21,"""5B32D544AE694BD0"""
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-"""B0E4BFBA14D80309_4C8748896E30922C_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C=CC=C1)N2CCCC2""",21,"""5B32D544AE694BD0"""
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-"""43A43D7B2BA719B2_78729394F35A9D3F_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=C(N=C(OC)C=C1)[NH]2""",21,"""5B32D544AE694BD0"""
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-"""7381415EE82531B8_14C64FBB47104276_6039_UN""","""O(CCOCCN=[N]#N)CC(NCC1=CC=C(F)C=C1)=O""",21,"""5B32D544AE694BD0"""
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-"""979BF1223AC4F1B7_06C41E4C86C8F9CA_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NCCC1=CCCCC1""",21,"""5B32D544AE694BD0"""
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-"""C2FA50FD37F1263A_AA6EAC6F1AA0B95F_6039_UN""","""O(CCOCCN=[N]#N)CCCC(C1=CC=C(F)C=C1)=O""",21,"""5B32D544AE694BD0"""
-"""D497627482C1BA03_A1CB8E4F0E31F812_6039_UN""","""O(CCOCCN=[N]#N)CCOC(=O)NC1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""5851C1B3A300DF96_AF253ABE0A134640_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C=CC(=C1)C(OC)=O)F""",21,"""5B32D544AE694BD0"""
-"""97F34D9FCB956E1F_5ACFF5EB34FE1B48_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=C(CC)C=CC=C1)=O""",21,"""5B32D544AE694BD0"""
-"""20273FF5EFE458BF_8C8C9972100AA3CA_6039_DP""","""O(CCOCCN=[N]#N)CCOC1=C(C(O)=O)C=CC=C1""",21,"""5B32D544AE694BD0"""
-"""74816E2B2113C868_39774854991048E9_6039_UN""","""O(CCOCCN=[N]#N)CC2=NN=C(C1CC1)[N]2C3CC3""",21,"""5B32D544AE694BD0"""
-"""0C661B98C7855D52_3C10EDB2E443DD33_6039_UN""","""O(CCOCCN=[N]#N)CC1=NN=C(S1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""234DFB750F425CD2_83374056747EC323_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=NC=C1)OCCOC""",21,"""5B32D544AE694BD0"""
-"""45DBFC833C526203_FA33425ED9529D54_6039_UN""","""O(CCOCCN=[N]#N)CCC1=C(C(OC)=O)C=CC=C1""",21,"""5B32D544AE694BD0"""
-"""2E14D0060F24D5C2_83043229AFB40B1F_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)N1CCC2=C1C=CC=C2""",21,"""5B32D544AE694BD0"""
-"""E16D268D18E0D63D_2EDB87CB6956FBAC_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1CCCC(C)C1C)=O""",21,"""5B32D544AE694BD0"""
-"""EE17EC9B3A197D0F_55A56B71C774F9C0_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(C(C)(C)C#N)C=C1""",21,"""5B32D544AE694BD0"""
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-"""94E7770970E60057_63912609466A1369_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)CC1=CC=C(C=C1)C#N""",21,"""5B32D544AE694BD0"""
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-"""4FA0854890DD7E75_F500628961CF714A_6039_UN""","""O(CCOCCN=[N]#N)CC2=CC1=C(C=CC(=C1)C)N=C2""",21,"""5B32D544AE694BD0"""
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-"""C1311AB77A9EF2B0_27B536FC4637BAF6_6039_UN""","""O(CCOCCN=[N]#N)CCC=CC1=CN=CC(=C1)OC""",21,"""5B32D544AE694BD0"""
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-"""5837659CD492C4DA_DAE46E45F31593EC_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(OC)C=CC(=C1)C(C)C""",21,"""5B32D544AE694BD0"""
-"""330D62798E8A51FC_C206B660FD959C10_6039_UN""","""O(CCOCCN=[N]#N)CC1=CN=C([N]1C)SC(F)(F)F""",21,"""5B32D544AE694BD0"""
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-"""850DF86E9584D9DF_B243CDC24B0B1506_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=CC2=C1OC(F)(F)O2""",21,"""5B32D544AE694BD0"""
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-"""1B8E9927FF57C8FE_620D109F50D588E2_6039_UN""","""O(CCOCCN=[N]#N)CC(COC1=CC=C(F)C=C1)=O""",21,"""5B32D544AE694BD0"""
-"""C55A3225138C33CF_EF787D2B79A903DC_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=C(C=CC=C1)C(=O)N2""",21,"""5B32D544AE694BD0"""
-"""FF40C58164557950_03EA18A602ACDB4D_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC(=NO1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""02229EEC2E2560CD_9B1DFED02A0F07A7_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C([S](NC)(=O)=O)C=C1""",21,"""5B32D544AE694BD0"""
-"""97C52F2506C7D621_0BB7824FB5B6FF2C_6039_UN""","""O(CCOCCN=[N]#N)CC1=NN=C(O1)C2CCCOC2""",21,"""5B32D544AE694BD0"""
-"""AB8A753226AF4BD7_1EDF1292562F0D25_6039_UN""","""O(CCOCCN=[N]#N)CC(N[C@H](C)C1=CC=CC=C1)=O""",21,"""5B32D544AE694BD0"""
-"""C7CE1AF6B54C2466_8487524CE3698AD4_6039_UN""","""O(CCOCCN=[N]#N)CC1=CN=C(O1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""3ACA423F90746B1C_968FF31A50FE5C00_6039_UN""","""O(CCOCCN=[N]#N)CC(CCNC(C(F)(F)F)=O)=O""",21,"""5B32D544AE694BD0"""
-"""4A84F8E387B751C7_8387DB0659707731_6039_UN""","""O(CCOCCN=[N]#N)CC(N(CCC)CC(F)(F)F)=O""",21,"""5B32D544AE694BD0"""
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-"""78CF965D97BCA234_6812950CC915B794_6039_UN""","""O(CCOCCN=[N]#N)CC1=COC(=N1)C2=CC=NC=C2""",21,"""5B32D544AE694BD0"""
-"""72D2FEF86DA6FCD7_EC776E88D9DB92D2_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC(=NO1)C2=CN=C[N]2C""",21,"""5B32D544AE694BD0"""
-"""BCD809FF01EEED6B_3EE7EB49ABCBFEAE_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=C(COCC1)C(=O)N2""",21,"""5B32D544AE694BD0"""
-"""6E1356C61A5E2E6C_36B2730D48646ED4_6039_UN""","""O(CCOCCN=[N]#N)CC1=CNC(=O)C2=C1C=CC=C2""",21,"""5B32D544AE694BD0"""
-"""3BDAC192B104FA4D_78810DF6D96F3C20_6039_UN""","""O(CCOCCN=[N]#N)CC1=NOC2=C1CC(C)(C)CC2""",21,"""5B32D544AE694BD0"""
-"""76F1D5312099A3FB_EE349BF3B78FACD3_6039_UN""","""O(CCOCCN=[N]#N)CC1=CSC(=N1)C2=N[N](C)C=C2""",21,"""5B32D544AE694BD0"""
-"""4F8489B338F95F61_181B788FEABA79F9_6039_UN""","""O(CCOCCN=[N]#N)CC1=NN=C2[N]1C=CN(C)C2=O""",21,"""5B32D544AE694BD0"""
-"""AEB00DD9626C17F8_A48345C9E6A27AF9_6039_UN""","""O(CCOCCN=[N]#N)CC2CCC1(CCOCC1)CO2""",21,"""5B32D544AE694BD0"""
-"""E4CDE8E1843AFFB4_A628358EDF186598_6039_UN""","""O(CCOCCN=[N]#N)CC2OC1=C(C=C(OC)C=C1)C2""",21,"""5B32D544AE694BD0"""
-"""334079D427F0C12C_F47A6728AB221F5E_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=CC=CC(=C1)CC)=O""",21,"""5B32D544AE694BD0"""
-"""8F55B128F8E7299C_1D639B4ACE809291_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=CC=CC(=C1)SC)=O""",21,"""5B32D544AE694BD0"""
-"""9C15FBA5F0C948AD_8DD6964042761D93_6039_UN""","""O(CCOCCN=[N]#N)CCCC[S](NC(C)(C)C)(=O)=O""",21,"""5B32D544AE694BD0"""
-"""46BFC57B17423BF5_CC8AA2373EAAFB83_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(C(N(C)C)=O)C=C1""",21,"""5B32D544AE694BD0"""
-"""4A39D283F26C047C_20105031B9662452_6039_UN""","""O(CCOCCN=[N]#N)CC(N1CC(C)OC(C1)(C)C)=O""",21,"""5B32D544AE694BD0"""
-"""4D1AE0496DCA759A_90F62CEDEAB4906E_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=CC=CC(=C1)[N](=O)=O)=O""",21,"""5B32D544AE694BD0"""
-"""2A41177AC4EE40F8_5858C390E2BA34C4_6039_UN""","""O(CCOCCN=[N]#N)CC1CCC(O1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""F612D068A16E0BFA_384E3138E4655403_6039_UN""","""O(CCOCCN=[N]#N)CC1=C[N]2C(=N1)N=C(C)C=C2C""",21,"""5B32D544AE694BD0"""
-"""149B48BFA5175AB8_DF4A96A88418DE88_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=C(C)C=CC=C1C)=O""",21,"""5B32D544AE694BD0"""
-"""30FBBA4EF0D7E5A7_C2C297D328CB0284_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C(=C(C)C(=C1C)C)C)C""",21,"""5B32D544AE694BD0"""
-"""16383130313D73E0_6E1B7F61A1F0792E_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(OC)C=CC(=C1)C(=O)C""",21,"""5B32D544AE694BD0"""
-"""639323CAA0817306_80056D5B131E790F_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NC1=C(C=CC=C1)C#N""",21,"""5B32D544AE694BD0"""
-"""A1DB7CE6DD169ECF_0BA219B7580DCD06_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=CC=C(CC)C=C1)=O""",21,"""5B32D544AE694BD0"""
-"""5E9DCBD620B80A59_CE295F1436315BE7_6039_UN""","""O(CCOCCN=[N]#N)CC(N(CC)C1CCCCC1)=O""",21,"""5B32D544AE694BD0"""
-"""B7813F59795C214F_7AA21DC2714B22ED_6039_UN""","""O(CCOCCN=[N]#N)CC(N(CC)C1=CC=CC=C1)=O""",21,"""5B32D544AE694BD0"""
-"""936DD5EF0C8577F4_831FCBCC8099D78D_6039_UN""","""O(CCOCCN=[N]#N)CC(N1CCC(C(O)=O)CC1)=O""",21,"""5B32D544AE694BD0"""
-"""CFA37DFE879C5217_B4D7A467250B3A56_6039_UN""","""O(CCOCCN=[N]#N)CCC2C1CC3CC(C1)CC2C3""",21,"""5B32D544AE694BD0"""
-"""4738C80F5BE055F4_07BBC61A96D4365D_6039_UN""","""O(CCOCCN=[N]#N)CCOC1=CC2=C(C=C1)OCO2""",21,"""5B32D544AE694BD0"""
-"""798C06476364F900_BC1496E834090FAD_6039_UN""","""O(CCOCCN=[N]#N)CCC1=CC=CC(=C1)C(F)(F)F""",21,"""5B32D544AE694BD0"""
-"""800EEA6123E0383C_28B86756D81F34B8_6039_UN""","""O(CCOCCN=[N]#N)CCC1=CC=C(C(F)(F)F)C=C1""",21,"""5B32D544AE694BD0"""
-"""4F30C45D2F4427CF_27109A660B7ED8B1_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=C(C=CC(=C1)OC)[NH]2""",21,"""5B32D544AE694BD0"""
-"""A3CB823896EC017B_E5FED272A412AD27_6039_DP""","""O(CCOCCN=[N]#N)CC1OC(CC12CCNCC2)=O""",21,"""5B32D544AE694BD0"""
-"""13F9CA7A42CE8736_C659B1CFE82CEA14_6039_UN""","""O(CCOCCN=[N]#N)CC1OC(=O)CC12CCOCC2""",21,"""5B32D544AE694BD0"""
-"""977784CF73EBEE37_4EC2F65C750C575F_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NC1=CC=C(C=C1)C#C""",21,"""5B32D544AE694BD0"""
-"""BA96AE1619C77C05_327FA9EFCA4E7B61_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C)C=CC(=C1)[S](=O)(=O)F""",21,"""5B32D544AE694BD0"""
-"""225C59F9ED59C97C_906DC1172B921301_6039_UN""","""O(CCOCCN=[N]#N)CCCCCCCCCC1CC1""",21,"""5B32D544AE694BD0"""
-"""D91F66F5E1402204_1FCB87C1166F87CF_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C)C=CC(=C1)[S](=O)(=O)Cl""",21,"""5B32D544AE694BD0"""
-"""12B01F220D4EF3F0_06C529A08F25124E_6039_UN""","""O(CCOCCN=[N]#N)CC2CCC1(CCCCCC1)O2""",21,"""5B32D544AE694BD0"""
-"""A20E534093C073B9_310D8CF151AE4A7F_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)CCCC1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""1335098361EA438A_A4F6CCDADA96512F_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=C(OC)C=C1)C(=O)C""",21,"""5B32D544AE694BD0"""
-"""85021E871365983E_21E0E18D36B94867_6039_UN""","""O(CCOCCN=[N]#N)C[C@@H]1CCC[C@@H](C(OCC)=O)O1""",21,"""5B32D544AE694BD0"""
-"""26F3A4EA2E21F33B_00B2BFB9193B9D80_6039_DP""","""O(CCOCCN=[N]#N)CC2CCC1(CCNCC1)CO2""",21,"""5B32D544AE694BD0"""
-"""6BA3D06D6D05F0FB_C4DC0E0DEF5ACC27_6039_UN""","""O(CCOCCN=[N]#N)CC1=N[N](C=C1)C2CCCCC2""",21,"""5B32D544AE694BD0"""
-"""D3A786AA99ACC2B9_80F00AA5D61762EE_6039_UN""","""O(CCOCCN=[N]#N)CC1=CSC(=N1)COCC(F)F""",21,"""5B32D544AE694BD0"""
-"""EF6E19BE7F462D36_6C5499FCB580E448_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=CSC(=N1)C(C)(C)C)=O""",21,"""5B32D544AE694BD0"""
-"""AED7E6D12C4041C2_2C46C8E067B87E26_6039_UN""","""O(CCOCCN=[N]#N)CC2CC1(CCOCC1)C(=O)N2""",21,"""5B32D544AE694BD0"""
-"""443650D680594B3D_892D4FC4261280AF_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NC(=O)C1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""945ECD017172BAF8_E2B65C7731E30535_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NCCC[N]1C=CC=N1""",21,"""5B32D544AE694BD0"""
-"""DCD1F174B889634E_29F41C3B8A1C14BC_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=C(C=C1)[N](=O)=O)OC""",21,"""5B32D544AE694BD0"""
-"""4DF53EA4C6478633_BD8FBE92DD68C6F0_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(N[S](C)(=O)=O)C=C1""",21,"""5B32D544AE694BD0"""
-"""E2DCCA6B7F2D142D_3674BD2FEE437307_6039_UN""","""O(CCOCCN=[N]#N)CC1=NN=N[N]1C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""94D573DEDD1BCF0B_9FACA0613D94510E_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC=C(S1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""5C241E261A3C9B08_EBA0364E990CB633_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=C(OC)C=CC(=C1)C)=O""",21,"""5B32D544AE694BD0"""
-"""F4386C2ED2149BDC_01EA4DF3807B0CE1_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)N1CCOCC1C2CC2""",21,"""5B32D544AE694BD0"""
-"""8EEAD054A93FAAFD_5FF78B2C0ABFB716_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C2=CC1=C(C=CC=C1)O2""",21,"""5B32D544AE694BD0"""
-"""5EF25D49F9EC9665_B938153C51C3CBEC_6039_UN""","""O(CCOCCN=[N]#N)CCOC1=C(C(C)=O)C=CC=C1""",21,"""5B32D544AE694BD0"""
-"""204FAD0E4815508C_D241ACE24EDB2EE1_6039_UN""","""O(CCOCCN=[N]#N)CC=NNC(=O)C1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""8B321F58862B6A8B_7A4ADFF8CA8FC5C7_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=CC=CC(=C1)OC)=O""",21,"""5B32D544AE694BD0"""
-"""6322384587C58774_37EA8F63CBFF2FE8_6039_UN""","""O(CCOCCN=[N]#N)CCC(=O)NC1=C(C=CS1)C#N""",21,"""5B32D544AE694BD0"""
-"""53691956DE17CC66_6554B8552328724D_6039_UN""","""O(CCOCCN=[N]#N)CC(N(CCCC)C(C)CC)=O""",21,"""5B32D544AE694BD0"""
-"""FF4C4F8ED98FC59A_A6CE83B51BB96096_6039_UN""","""O(CCOCCN=[N]#N)CC(NCCCC(OCC)=O)=O""",21,"""5B32D544AE694BD0"""
-"""43EDDDE2909CDF41_A3DF32E37C490528_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(C=C1)[N]2C=NC=C2""",21,"""5B32D544AE694BD0"""
-"""07027D0FABB7463A_D3EA22D69A0E686E_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(OC(F)(F)F)C=C1""",21,"""5B32D544AE694BD0"""
-"""7B430BD032F9E567_1030BA073B6DA63F_6039_UN""","""O(CCOCCN=[N]#N)CCCOC1=C(C=CC(=C1)C)C""",21,"""5B32D544AE694BD0"""
-"""6CC35193F8A8EE14_9D0ACCC71FE218F4_6039_UN""","""O(CCOCCN=[N]#N)CC(NCC1=C(C)C=CC=C1)=O""",21,"""5B32D544AE694BD0"""
-"""DA020EAA65364879_1877179689F54885_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=C(C(OC)=O)C=C1)C""",21,"""5B32D544AE694BD0"""
-"""CA36EAB7CF0E64CA_C1544433C8890B22_6039_UN""","""O(CCOCCN=[N]#N)CC1=N[N](C(=C1[S](=O)(=O)N)C)C""",21,"""5B32D544AE694BD0"""
-"""AC906F70082A0620_18A9B08E878E64DD_6039_DP""","""O(CCOCCN=[N]#N)C[C@@H]1C[C@](OC)(CN1)C(F)(F)F""",21,"""5B32D544AE694BD0"""
-"""9C13BB25A08EE5E6_E4B2C1E5C47B3EBD_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=C([N](N=C1C)C)C)=O""",21,"""5B32D544AE694BD0"""
-"""7853E37A770F231A_CAC43592758C8D77_6039_UN""","""O(CCOCCN=[N]#N)CC1=NN=C(O1)C2CCOCC2""",21,"""5B32D544AE694BD0"""
-"""A8E74EEEA7787E59_02D971247E52ABD3_6039_UN""","""O(CCOCCN=[N]#N)CCC(C(F)F)N1CCOCC1""",21,"""5B32D544AE694BD0"""
-"""7C092A99CCB508D4_7110430703F3775A_6039_UN""","""O(CCOCCN=[N]#N)CC(N(CCOC)CCOC)=O""",21,"""5B32D544AE694BD0"""
-"""9DA7EF631AF286CD_2C1206ED06CDAFD5_6039_UN""","""O(CCOCCN=[N]#N)CC1=NOC(=N1)N2CCOCC2""",21,"""5B32D544AE694BD0"""
-"""D5609978C0244D01_3964060FAFA5A9F6_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(C=C1)C2CCCC2""",21,"""5B32D544AE694BD0"""
-"""3D815852C134D133_4D966C1B2F1CBA23_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC(=NS1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""29C590E1267F8564_90D043A35A753210_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=CC(=C1)OC(C)=O)C""",21,"""5B32D544AE694BD0"""
-"""8DCA2341FA400826_27589386A68D1A5A_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=CC=C1)OCC2CC2""",21,"""5B32D544AE694BD0"""
-"""100B1E14AD57412C_B987D1B77E48B0CC_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=C(CCCC1)C(=O)N2""",21,"""5B32D544AE694BD0"""
-"""C8857B1396EE4950_3B269DFE6E3D78E6_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C2=CC1=C(C=CC=C1)[NH]2""",21,"""5B32D544AE694BD0"""
-"""A633202F5C512632_6536698F650EBC07_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=C(CC(C)(CC1)C)S2""",21,"""5B32D544AE694BD0"""
-"""4D8AF23CC5FFDFD9_54A4522D3CB93A86_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C1=CN=C2N=CC=C[N]12""",21,"""5B32D544AE694BD0"""
-"""901CCF4CA8DEB4E7_5D0535471B95791E_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=C[N](C)N=C1C(F)F)=O""",21,"""5B32D544AE694BD0"""
-"""6376C28F201E2B43_F6F1978011B5B702_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C2=CC1=C(C=CC=C1)S2""",21,"""5B32D544AE694BD0"""
-"""E5B3A164FED6CDEA_E215878273D5CB5E_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C1=CN=C2[N]1C=CC=C2""",21,"""5B32D544AE694BD0"""
-"""79123A7916C5C6C7_9A061B2CEEBFE45B_6039_UN""","""O(CCOCCN=[N]#N)CC1=NN=C([N]1C)C2=CC=CS2""",21,"""5B32D544AE694BD0"""
-"""449BB67CFA5C94B8_AB73BAE6620FCA36_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C1=CC2=C(C=C1)OCO2""",21,"""5B32D544AE694BD0"""
-"""E53B265381BEC247_0E12D3B0727BF563_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=C(C(OC)=O)N=C1)F""",21,"""5B32D544AE694BD0"""
-"""A5DFB6E653E838BE_B0A1C4EA6C10ACAE_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=CSC(=C1)C(OC)=O)=O""",21,"""5B32D544AE694BD0"""
-"""3D8C50090E1B478E_BAF3DFDA9D0CDED0_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=CC2=C1OC(C)(C)C2""",21,"""5B32D544AE694BD0"""
-"""2FA8606BF4B80ACC_759ED2A922BBF42C_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=C(C=C1)C)C(OC)=O""",21,"""5B32D544AE694BD0"""
-"""F0D604AD47748CFF_4574CC19F69D0B8B_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC=N[N]1C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""47861791ACDAC967_56AB6C47717AA66F_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=C(C=C(OC)C=C1)S2""",21,"""5B32D544AE694BD0"""
-"""3ACDDFFB0FDF29C9_C3BCE1682AAAA9A4_6039_UN""","""O(CCOCCN=[N]#N)CCC(C)OCC1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""8627E56B4B339960_2F56AB97915337C2_6039_UN""","""O(CCOCCN=[N]#N)CC1=NN=C[N]1C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""BEF64134DD2A805C_60A5AD40C2833443_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(OC(F)(F)F)C=CC=C1""",21,"""5B32D544AE694BD0"""
-"""961E3F8F367473D8_D3587E1B626F2B3F_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=CC(=C(C=C1)C#N)F)=O""",21,"""5B32D544AE694BD0"""
-"""E245E3F1F25E6B60_A7865605A3B90584_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=CC(=C1F)C(F)(F)F""",21,"""5B32D544AE694BD0"""
-"""EF519B975B52419E_94A5418FE0129EC3_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=CC(=C1)C(F)(F)F)F""",21,"""5B32D544AE694BD0"""
-"""C5779EE7E479BA5E_320D3856F4D77E66_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C=CC(=C1)F)C(F)(F)F""",21,"""5B32D544AE694BD0"""
-"""408EE77EABF10D9A_717BB6D87D0CBEC7_6039_UN""","""O(CCOCCN=[N]#N)CCC1=CC=C(NC(C)=O)C=C1""",21,"""5B32D544AE694BD0"""
-"""F048FECD964B6196_EAC6AC48D6303A93_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=C(F)C=C1)C(F)(F)F""",21,"""5B32D544AE694BD0"""
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-"""4A32500D2A1093A2_EAE911E1889B68CE_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(O[S](F)(=O)=O)C=C1""",21,"""5B32D544AE694BD0"""
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-"""298EDB2FC05343AA_CE646001658755E7_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C)C=C(C=C1)C(F)(F)F""",21,"""5B32D544AE694BD0"""
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-"""AF74B491B8E81EB2_CA787C70589FECC7_6039_UN""","""O(CCOCCN=[N]#N)CCC1=C[N](C)C2=C1C=CC=C2""",21,"""5B32D544AE694BD0"""
-"""CE602A71BAA3B745_8872E6DB72C232F3_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NCCCCCN=[N]#N""",21,"""5B32D544AE694BD0"""
-"""3CC60F654E2F4053_EAB4BCC2089C052C_6039_UN""","""O(CCOCCN=[N]#N)CCC1CCCC(C(F)(F)F)C1""",21,"""5B32D544AE694BD0"""
-"""CEAF846C50C2EAF4_155E56E299127F00_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(C=C1)C2CC(=O)C2""",21,"""5B32D544AE694BD0"""
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-"""16EF612C5CCB6F9D_CDC214C628CA7ED9_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C2=C1C=CC=C[N]1C=N2""",21,"""5B32D544AE694BD0"""
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-"""C8B1DE46063B8DAB_C074A876498512F0_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=C(C)OC(=C1)C(=O)N)=O""",21,"""5B32D544AE694BD0"""
-"""C2F39F2034FE4003_B0CA3C0F776F8E1E_6039_UN""","""O(CCOCCN=[N]#N)CC1=NN=C(O1)N2CCCCC2""",21,"""5B32D544AE694BD0"""
-"""8B358948B923EF96_8AE7563784303FDA_6039_UN""","""O(CCOCCN=[N]#N)CC1COC(O1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""A3CCEDD700A66A30_5BAEA43E913162AB_6039_UN""","""O(CCOCCN=[N]#N)CC1=NN=C(O1)N2CCOCC2""",21,"""5B32D544AE694BD0"""
-"""6059DFAF4E25D1BF_E0F8CE228CB10E77_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(C=C1)C2=NC=CO2""",21,"""5B32D544AE694BD0"""
-"""FECEE67C3D4D5EA4_3CB7AFD1EB9A822C_6039_UN""","""O(CCOCCN=[N]#N)CC1=N[N](CCC(F)(F)F)C=C1""",21,"""5B32D544AE694BD0"""
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-"""5C87F792098102B0_FBF5A4D723D90936_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=N[NH]1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""34D24677FB46AC2E_B540DAF0C8519FD9_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=CC(=C1)SCCCC""",21,"""5B32D544AE694BD0"""
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-"""A63C09F3E0C72C36_C0582CE022C2EA80_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=CC(=C1)CCCOC""",21,"""5B32D544AE694BD0"""
-"""740C8FD2E9B339F9_950ED0979FA6E9E6_6039_DP""","""O(CCOCCN=[N]#N)CC1=CC(=NO1)C2CCNCC2""",21,"""5B32D544AE694BD0"""
-"""97E8A4D0533C2002_BA889804B14A7B95_6039_UN""","""O(CCOCCN=[N]#N)CCC(C(F)F)C1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""356BD5A538E39863_2A6060F5A2DDEA16_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(CNC(C)=O)C=C1""",21,"""5B32D544AE694BD0"""
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-"""0978CC9F35B31FDD_E712F5DC231D2DE3_6039_UN""","""O(CCOCCN=[N]#N)CCCCO[S](C(F)(F)F)(=O)=O""",21,"""5B32D544AE694BD0"""
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-"""DDD885898D305835_A0EF8CD546E03452_6039_UN""","""O(CCOCCN=[N]#N)CC2=CC1=C([N](CC)N=N1)C=C2""",21,"""5B32D544AE694BD0"""
-"""E12F993DF288FE9E_B8199AAD819B3401_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(NC(OC)=O)C=C1""",21,"""5B32D544AE694BD0"""
-"""A71BDFE73F34BC6C_9B26E6CC9ECBBF02_6039_UN""","""O(CCOCCN=[N]#N)CC1=CN=C(C(OC)=O)C=C1C""",21,"""5B32D544AE694BD0"""
-"""39157183E425BF3C_D5E2337DDBDB044F_6039_UN""","""O(CCOCCN=[N]#N)CC1=N[N](C=C1C(OCC)=O)C""",21,"""5B32D544AE694BD0"""
-"""F8D48C1C8BF14884_E8FC04630AA3C486_6039_UN""","""O(CCOCCN=[N]#N)CCC1=NOC2=C1C=CC(=C2)F""",21,"""5B32D544AE694BD0"""
-"""5034C05BD15F61CA_B36842709C8D659A_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)N2CC1=C(C=CC=C1)C2""",21,"""5B32D544AE694BD0"""
-"""DBAC6E4B08211A60_27BF5738879E7AAA_6039_UN""","""O(CCOCCN=[N]#N)CC2=CC1=C(N(C)C(=O)O1)C=C2""",21,"""5B32D544AE694BD0"""
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-"""24E5DE8736B0B348_8377FDB27FC8EC46_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=NC(=N1)C2CCC2)C""",21,"""5B32D544AE694BD0"""
-"""FED74228126F0957_CEC0A950A3BBA6DA_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=NC(=N1)C(F)(F)F)C""",21,"""5B32D544AE694BD0"""
-"""ED5C416FC433AB17_E1AA712C8CF9C444_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=N[N]1C2CCCCC2""",21,"""5B32D544AE694BD0"""
-"""4C99D2F6401AA201_A9B768CB29061A9B_6039_UN""","""O(CCOCCN=[N]#N)CC(C1CCN(C(C)=O)CC1)=O""",21,"""5B32D544AE694BD0"""
-"""5C8141206FE7E211_BE924571F74911F9_6039_UN""","""O(CCOCCN=[N]#N)CC2CC1(CCOCC1)C(=O)O2""",21,"""5B32D544AE694BD0"""
-"""286C8B9EA88946BA_4E9EF6A75F8C0237_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C(=N[N]1C)C)[S](=O)(=O)N""",21,"""5B32D544AE694BD0"""
-"""DE6F9943788D7F92_FE0AD543CE34A6B3_6039_UN""","""O(CCOCCN=[N]#N)CC(C(CC(OCC)=O)(C)C)=O""",21,"""5B32D544AE694BD0"""
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-"""FB65CA110A2CF42F_EB13BB27081057DF_6039_UN""","""O(CCOCCN=[N]#N)CC[N]1N=C(C(OC)=O)C=C1C""",21,"""5B32D544AE694BD0"""
-"""E696DFF163061C53_1710A4F6F6920282_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C1CCCC2=C1C=CS2""",21,"""5B32D544AE694BD0"""
-"""ED3DA5325657A116_9AF0CA0346BB0ACA_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC=C(O1)C2CCCCC2""",21,"""5B32D544AE694BD0"""
-"""6E48143FF14237ED_E8C008A7573CF91D_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC2=C([N]1CC)C=CC=C2""",21,"""5B32D544AE694BD0"""
-"""EBF4B5C2ADBBDA3C_6D30E19030A0FED7_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C)C=C(C=C1)CC(=O)O""",21,"""5B32D544AE694BD0"""
-"""6ACC83B1C223D94F_285A808A6554B587_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=NC(=N1)C2CC2C)C""",21,"""5B32D544AE694BD0"""
-"""415C586D224F25C7_7EDBA97F5F46B1C3_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(CC)C=CC(=C1)[N](=O)=O""",21,"""5B32D544AE694BD0"""
-"""CC92B0F0450A9F9C_01B00E75600BE307_6039_UN""","""O(CCOCCN=[N]#N)CC(C1CCCN(C(C)=O)C1)=O""",21,"""5B32D544AE694BD0"""
-"""850BBECC352CC2DD_29F56B54761C86B3_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(F)C=CC2=C1N=CC=C2""",21,"""5B32D544AE694BD0"""
-"""88FB22C5AEEA0D44_66A1B346461B7E9C_6039_UN""","""O(CCOCCN=[N]#N)CC1=CSC(=N1)COC2CCC2""",21,"""5B32D544AE694BD0"""
-"""A5EFEBDEFCB4CB54_3812F30A07334B20_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=C(C(=CC(=C1)F)F)[NH]2""",21,"""5B32D544AE694BD0"""
-"""E5B3A164FED6CDEA_5CEDD7B7506A163C_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C1=CN=C2C=CC=C[N]12""",21,"""5B32D544AE694BD0"""
-"""39C58AB64C6B2088_3F86D9026CC5E3AE_6039_UN""","""O(CCOCCN=[N]#N)CC(F)(F)C(=O)C1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
-"""C9433D5D34663566_5AD4D4BDA6B3DB04_6039_UN""","""O(CCOCCN=[N]#N)CC(CC1=C(OC)C=CC=C1)=O""",21,"""5B32D544AE694BD0"""
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-"""C9E5633183CCD603_9FCF375C424172D7_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1(C)CC[S](=O)(=O)C1)=O""",21,"""5B32D544AE694BD0"""
-"""8AD2C95FE57E9292_767D53DA628079B9_6039_UN""","""O(CCOCCN=[N]#N)CCC(C1=CC=C(CC)C=C1)=O""",21,"""5B32D544AE694BD0"""
-"""667CFD8598B0FC51_7F7198B30670B685_6039_UN""","""O(CCOCCN=[N]#N)CC1=N[S](=O)(=O)C2=C1C=CC=C2""",21,"""5B32D544AE694BD0"""
-"""F7B00D855A1DD341_C75B5C670E350913_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NC1CCCCNC1=O""",21,"""5B32D544AE694BD0"""
-"""420981E1B5F09D84_FB12F66934E2054F_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=CC(=C(C)C=C1)F)=O""",21,"""5B32D544AE694BD0"""
-"""F2E6AD452ABA52DC_F6FABD4F98B44EB9_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=NC=C([N](=O)=O)S1)=O""",21,"""5B32D544AE694BD0"""
-"""0C777D205872D6B6_5BE36895105779B3_6039_UN""","""O(CCOCCN=[N]#N)CC1=N[N](N=C1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""E1691D707325FD8F_2BCCD63BA6BC90DD_6039_UN""","""O(CCOCCN=[N]#N)CC[N]1N=C(C)C(=C1C)C(=O)O""",21,"""5B32D544AE694BD0"""
-"""C1FA664F1AE3F95B_237607374DAD7D24_6039_UN""","""O(CCOCCN=[N]#N)CC1CC(=NO1)C2CCCCC2""",21,"""5B32D544AE694BD0"""
-"""1B0FF06795E96FC7_E6145B072CDD6886_6039_UN""","""O(CCOCCN=[N]#N)CCN1C(=O)OC2=C1C=CC=C2""",21,"""5B32D544AE694BD0"""
-"""FE2E029F0D933C29_D6CF202E9B8FE813_6039_UN""","""O(CCOCCN=[N]#N)CCCCC[N]1N=C(C)N=C1C""",21,"""5B32D544AE694BD0"""
-"""D27E2B0B923BED95_84CB3F19A064CA56_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C=C([N](=O)=O)C=C1F)F""",21,"""5B32D544AE694BD0"""
-"""72C4D4EA2C935782_5204D993465DC735_6039_UN""","""O(CCOCCN=[N]#N)CC1=CN=C([NH]1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""5DEC3A0DB8F3CBA9_04025990DF8BAF4B_6039_UN""","""O(CCOCCN=[N]#N)CC1=CSC(=N1)C2=C[N](C)N=C2""",21,"""5B32D544AE694BD0"""
-"""F3D63FBB3A2A75A4_01EFB9B1A243D8A3_6039_UN""","""O(CCOCCN=[N]#N)CC1=CSC(=N1)C2=NC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""81BD09A4F94B2D12_41FBE45915995BCA_6039_UN""","""O(CCOCCN=[N]#N)CC1=N[N](C(=C1[S](=O)(=O)Cl)C)C""",21,"""5B32D544AE694BD0"""
-"""8D75CFFEA6B778C2_306ADDA4BC88975E_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(C=C1)C2=CSC=C2""",21,"""5B32D544AE694BD0"""
-"""1AC9FF75FF996058_B179546851052C20_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)C1=CC2=C(N=C1)OCO2""",21,"""5B32D544AE694BD0"""
-"""705B0B27A7A97EAC_04F50989B9FE0946_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=CC(=C1)SC(F)(F)F""",21,"""5B32D544AE694BD0"""
-"""CFC98454F9A9754B_B906245E986FE217_6039_UN""","""O(CCOCCN=[N]#N)CC(OC)CC1=CC=C(C=C1)F""",21,"""5B32D544AE694BD0"""
-"""E95BCC098ECA4485_6AE0BC8C83B7379F_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C(C)(C)C#N)C=CC=C1""",21,"""5B32D544AE694BD0"""
-"""54EEC700F2B00E31_55C503ED703F7E4B_6039_UN""","""O(CCOCCN=[N]#N)CC(N(C)C1=CC=C(C=C1)C)=O""",21,"""5B32D544AE694BD0"""
-"""9A7AA7DBFA60F33D_E592BDC9AAC1CCC8_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
-"""AB7F43DF8BF51F0D_5CF2BEC7EA7F4100_6039_UN""","""O(CCOCCN=[N]#N)CCCCCCCCCN=[N]#N""",21,"""5B32D544AE694BD0"""
-"""A879C66A69FD3903_F95C76193DA149C6_6039_UN""","""CC(OCC(NC1=C(SC(F)F)C=CC=C1)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""5D82B9597EB93C79_E29397634B396C01_6039_UN""","""CC(OCC(=O)N(C1CC1)C2CC[S](=O)(=O)C2)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""05278C8F56B4B783_E44F38E25508705E_6039_UN""","""CC(OCC(N1C(CC)C2=C(CC1)SC=C2)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""83F821984ECB1204_559C0F861EC23598_6039_UN""","""CC(OCC(N(C)C1=CC=C(C=C1)[N](=O)=O)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""FE1698C2AFD15A6C_830432A1275A7DBB_6039_UN""","""CC(OCC(N(CC)CC(=O)NC(C)(C)C)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""374467AF35D816B5_8A77A579D8D293A1_6039_UN""","""CC(OCC(N(CC1=C(OC)C=CC=C1)C)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""5CF2D85F46121AA0_8B0FF04C9AA39472_6039_UN""","""CC(OCC(NC1=C(C(=C(C#N)S1)C)C#N)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""70B832D33BE0B45B_D4FD6820D1D36450_6039_UN""","""CC(OCC(NC1=CC=CC(=C1)C(F)(F)F)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""F9E3D8F6E06135B5_11250500177A6772_6039_UN""","""CC(OCC(OCCCCCCCCCC)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""94A1253AA9A24432_3EEB2DEE3688DA27_6039_UN""","""CC(OCC(=O)NC23CC1CC(CC(C1)C2)C3)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""9C50E4FCF2608D88_5FD531EBAF79EF29_6039_UN""","""CC(OCC(NC1=C(C)C=C(C=C1)[N](=O)=O)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""2FB414DF08408F91_1C8DD0FA61C33B05_6039_UN""","""CC(OCC(NC1=CC=CC(=C1)NC(C)=O)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""2F8AC2DB54BCD358_3EF76F61CDB67243_6039_UN""","""CC(OCC(NC2=NC1=C(C=C(C)C=C1)S2)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""FA718569C72AF2D2_A146E76C03392E85_6039_UN""","""CC(OCC(C1=CC=C(NC(CC)=O)C=C1)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
-"""0C70507260B89039_5202B4BDA5BB68D0_6039_UN""","""CC(OCC(NC1=NN=C(CCCCC)S1)=O)CN=[N]#N""",21,"""6A28B22E1136046C"""
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-"""B3104C50DE0D5099_1F9E43C95E7441C9_6039_UN""","""CN2CCC(COCC(NC1=NC=C([N](=O)=O)S1)=O)C2=O""",21,"""B2562BC268A944A0"""
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-"""F89EA08960CC37F5_C2A828BD607C9FAD_6039_UN""","""CN2CCC(COCC[N]1N=C(C)C(=C1C)C(=O)O)C2=O""",21,"""B2562BC268A944A0"""
-"""AB2D17DB2D57DD36_CA12F9B18B6D7254_6039_UN""","""CN3CCC(COCC1CC(=NO1)C2CCCCC2)C3=O""",21,"""B2562BC268A944A0"""
-"""C0F899E73D9588FC_0F70A581EA1D67F6_6039_UN""","""CN3CCC(COCCN1C(=O)OC2=C1C=CC=C2)C3=O""",21,"""B2562BC268A944A0"""
-"""C216ED6E12140238_3FABDEA85D4FE763_6039_UN""","""CN2CCC(COCCCCC[N]1N=C(C)N=C1C)C2=O""",21,"""B2562BC268A944A0"""
-"""B157BFB995C408C0_6DAFC19F66A4C526_6039_UN""","""CN2CCC(COCC1=C(C=C([N](=O)=O)C=C1F)F)C2=O""",21,"""B2562BC268A944A0"""
-"""BD861E41B1DBBE22_BB602715809DC845_6039_UN""","""CN3CCC(COCC1=CN=C([NH]1)C2=CC=CC=C2)C3=O""",21,"""B2562BC268A944A0"""
-"""93A44077DABDF806_ED66A716194BA03B_6039_UN""","""CN3CCC(COCC1=CSC(=N1)C2=C[N](C)N=C2)C3=O""",21,"""B2562BC268A944A0"""
-"""706B3072EDE7F92B_E88B47376483D7D3_6039_UN""","""CN3CCC(COCC1=CSC(=N1)C2=NC=CC=C2)C3=O""",21,"""B2562BC268A944A0"""
-"""8ED8DC54471480CE_A89F1ADFD35954BA_6039_UN""","""CN2CCC(COCC1=N[N](C(=C1[S](=O)(=O)Cl)C)C)C2=O""",21,"""B2562BC268A944A0"""
-"""A32B99E31F062C66_D90E23227A48982E_6039_UN""","""CN3CCC(COCC1=CC=C(C=C1)C2=CSC=C2)C3=O""",21,"""B2562BC268A944A0"""
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-"""B830E9452B5184CA_ED91F70F7F3E0636_6039_UN""","""CN2CCC(COCC1=CC=CC(=C1)SC(F)(F)F)C2=O""",21,"""B2562BC268A944A0"""
-"""2DDBF149AC6D4D6A_5062DAD85EAFED67_6039_UN""","""CN2CCC(COCC(OC)CC1=CC=C(C=C1)F)C2=O""",21,"""B2562BC268A944A0"""
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-"""F72D74E2BD917E24_26AFB68D874A1602_6039_UN""","""CC(C)(OCC(C1=CC=C(CCN[S](C)(=O)=O)S1)=O)C#N""",21,"""41575F74219DC187"""
-"""C28AA37742C5C697_EAF26AA39F3D99E2_6039_UN""","""CC(C)(OCC(=O)NC1=CC2=C(C=C1)OCCCO2)C#N""",21,"""41575F74219DC187"""
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-"""A3C2051871E9737A_4D7DC31564A1DAF8_6039_UN""","""CC(C)(OCC(=O)NCC1(CCC1)C2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
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-"""59669C0C728401CC_3C10D7B5E229648F_6039_UN""","""CC(C)(OCCC(=O)NC1=C(C2=C(S1)CCC2)C#N)C#N""",21,"""41575F74219DC187"""
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-"""C56E3D7C86E1D363_995FD333DD5EBDCD_6039_UN""","""CC(C)(OCC1=NC(=NO1)COC2=CC=C(F)C=C2)C#N""",21,"""41575F74219DC187"""
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-"""28EDF8060576C10E_9DFFA542E5799258_6039_UN""","""CC(C)(OCC(=O)C1=CC(=CC=C1)N2CCCC2=O)C#N""",21,"""41575F74219DC187"""
-"""5219E384D26D47D2_339F9C7B0D321863_6039_UN""","""CC(C)(OCC(NCC1=CC=C(C(OC)=O)C=C1)=O)C#N""",21,"""41575F74219DC187"""
-"""57E4BF630FA25EF0_70FB63126FA6A2C4_6039_UN""","""CC(C)(OCCC(=O)NC1CCCC2=C1C=CC=C2)C#N""",21,"""41575F74219DC187"""
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-"""EDEADD7D89877B1C_555426F6B08CFDA1_6039_UN""","""CC(C)(OCCC(NC1=C(C)C=C(C=C1)[N](=O)=O)=O)C#N""",21,"""41575F74219DC187"""
-"""80193B4F85701F50_119BCB3B82081CF6_6039_UN""","""CC(C)(OCCC(NC1=C(C=CC(=C1)[N](=O)=O)F)=O)C#N""",21,"""41575F74219DC187"""
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-"""38EF786AAB708F30_B579899705DCEAF2_6039_UN""","""CC(C)(OCC(NC1=CC(=C(C)C=C1)[S](=O)(=O)N)=O)C#N""",21,"""41575F74219DC187"""
-"""B6017590DACD0192_5C5CB7FEE88624ED_6039_UN""","""CC(C)(OCC(NC1CCC(C(CC)(C)C)CC1)=O)C#N""",21,"""41575F74219DC187"""
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-"""B9FF514818E6509F_59097F6076965378_6039_UN""","""CC(C)(OCC(C1=C([N](CCC(C)C)C(=C1)C)C)=O)C#N""",21,"""41575F74219DC187"""
-"""FC9A32EB1D023357_F717D4B8146EFC3D_6039_UN""","""CC(C)(OCC(NC2=CC1=C(OC(F)(F)O1)C=C2)=O)C#N""",21,"""41575F74219DC187"""
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-"""C596007AE07E33A2_DE0AF4AE24BF2DE4_6039_UN""","""CC(C)(OCC2=CN=C(C1=CC=C(C(C)C)C=C1)S2)C#N""",21,"""41575F74219DC187"""
-"""22228C6BFE4B304E_02AD2D2D53AF9D0C_6039_UN""","""CC(C)(OCC(C1=C(C=C(C(C)C)C=C1)C(C)C)=O)C#N""",21,"""41575F74219DC187"""
-"""7C07B8E9C169E455_BA71AFFFABAE375F_6039_UN""","""CC(C)(OCC(NC(NC1=CC=CC(=C1C)C)=O)=O)C#N""",21,"""41575F74219DC187"""
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-"""F97D57D4537C7CC8_41DA06A3FCB361D7_6039_UN""","""CC(C)(OCC(NNC(C1=CC=C(OC)C=C1)=O)=O)C#N""",21,"""41575F74219DC187"""
-"""09AC6726E4358B7D_E37D088F1A029056_6039_UN""","""CC(C)(OCC(N(CC)CC1=CC=C(C=C1)OC)=O)C#N""",21,"""41575F74219DC187"""
-"""A64F5C754599E211_52148B715BF15A5F_6039_UN""","""CC(C)(OCC(=O)NCCCN1CCCCCC1=O)C#N""",21,"""41575F74219DC187"""
-"""BB3ADD0873DA5CFE_7F10ED85730C27B3_6039_UN""","""CC(C)(OCC(NCC1=CC=C(COCC)C=C1)=O)C#N""",21,"""41575F74219DC187"""
-"""0EA3CAD7FF67845A_37573A0D70DCB727_6039_UN""","""CC(C)(OCC(NCC1=CC=CC(=C1)OCCC)=O)C#N""",21,"""41575F74219DC187"""
-"""F14CB3B285F20479_3C7B684CA73626B0_6039_UN""","""CC(C)(OCC(N(C(C)C1=CC(=C(C=C1)F)F)C)=O)C#N""",21,"""41575F74219DC187"""
-"""0932A1F8D932A5D6_C90635ABA6E455DE_6039_UN""","""CC(C)(OCC(NCC1=C(COCC)C=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
-"""B267A09CCD0742C9_C260FBC400577F26_6039_UN""","""CC(C)(OCC(NCC1=CC=C([S](C)(=O)=O)C=C1)=O)C#N""",21,"""41575F74219DC187"""
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-"""C0FB951F6AB69443_FACB3CCCC44F9666_6039_UN""","""CC(C)(OCC(=O)NC1=CC=N[N]1CC2=CC=CS2)C#N""",21,"""41575F74219DC187"""
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-"""FE7DCC160E175012_618DEA7897BB6986_6039_UN""","""CC(C)(OCC(NC1=C(SCC(N)=O)C=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
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-"""C1AA88D96185EF72_D3A6E2744030959E_6039_UN""","""O(CC1(CC#N)COC1)CC(=O)NCC2CC[S](=O)(=O)C2""",21,"""C86C30E70AE8053D"""
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-"""77EE7C9E6ECCE3A9_7F54A3F450FCD268_6039_UN""","""O(CC1(CC#N)COC1)CC2=CC=C([S](N(C)C)(=O)=O)O2""",21,"""C86C30E70AE8053D"""
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-"""CBCE9930588D1FE3_37420309A3832D2F_6039_UN""","""O(CC1(CC#N)COC1)CC(NC2=CC(=CC(=C2)C)C)=O""",21,"""C86C30E70AE8053D"""
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-"""28BFE33E7754498C_29AD3A79398D903D_6039_UN""","""O(CC1(CC#N)COC1)CC2=CC=CC3=C2OC(C)(C)C3""",21,"""C86C30E70AE8053D"""
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-"""57DC160C68AF2CBA_F976396FCC805321_6039_UN""","""O(CCOCC1CCCO1)CC(=O)NCC2=CC=CC=C2""",21,"""8F5BBBE7CFE6F605"""
-"""0EB4E34F9BA1A85E_5D7403E0066127E5_6039_UN""","""O(CCOCC1CCCO1)CCCCCN2CCCCC2""",21,"""8F5BBBE7CFE6F605"""
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-"""ECF1ABF299A64DF1_02C715FCDE437CEF_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC(=N1)C2=CSC=C2""",21,"""B88421D1496BF4E9"""
-"""B39EC0FFC5211A3A_C3E83D009D685E6D_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)C2=CC=CO2""",21,"""B88421D1496BF4E9"""
-"""D42D2B17581C514A_367D6F7ACC88D203_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)C2=CC=CS2""",21,"""B88421D1496BF4E9"""
-"""36BB0121268FFC4D_796E13D530FC7FD5_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=CC=CC(=C1)CC""",21,"""B88421D1496BF4E9"""
-"""62C30E6E26C22912_9193E8D67A2C352D_6039_UN""","""C[Si](C)(C)C#CCCCOCCC(C1=CC=C(F)C=C1)=O""",21,"""B88421D1496BF4E9"""
-"""5BBF643B99668C84_B341622B7131234E_6039_UN""","""C[Si](C)(C)C#CCCCOCCCOC1=C(C)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""0A8D0DA8DE6E82CF_FDCFEEABA3FF8BF5_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=CC(=CC=C1)C#N""",21,"""B88421D1496BF4E9"""
-"""323E852A8B47ACDA_D7570DAA78EFD454_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=C(C)C=C1)C)=O""",21,"""B88421D1496BF4E9"""
-"""D3EBE3FEA798C328_0592E41A40E42E6A_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=C(F)C=C1)F)=O""",21,"""B88421D1496BF4E9"""
-"""CB78E1EB664AF33A_18443293CE9EEDC9_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=CC(=CC(=C1)C)C""",21,"""B88421D1496BF4E9"""
-"""E4FC765F8BA89A27_BA1CA194A6D6BEF7_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(NC(C)(C)C)=O)=O""",21,"""B88421D1496BF4E9"""
-"""D7971A55FEBBE9F6_2815D3035E56BC0F_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NC1CC[S](=O)(=O)C1""",21,"""B88421D1496BF4E9"""
-"""A3B87E39F0026198_25344EC8D188CE50_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1=NN=C(CC)S1)=O""",21,"""B88421D1496BF4E9"""
-"""1CCBF2C84B83BEC8_9EA2028EE58002CD_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(OCC)=O)C=CO1""",21,"""B88421D1496BF4E9"""
-"""14D36DFE93E1B782_51B984F3637A7178_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=CC=C(OC)C=C1""",21,"""B88421D1496BF4E9"""
-"""3E36109ED5217F7A_8AC9BC7A482B3387_6039_UN""","""C[Si](C)(C)C#CCCCOCC(CC1=C(F)C=CC=C1)=O""",21,"""B88421D1496BF4E9"""
-"""9E8406A8230FFC71_863BE77A210E1513_6039_UN""","""C[Si](C)(C)C#CCCCOCC(CC1=CC=C(F)C=C1)=O""",21,"""B88421D1496BF4E9"""
-"""EE5A69852241E8C4_582D6BB89267CD49_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1=C([NH]N=C1C)C)=O""",21,"""B88421D1496BF4E9"""
-"""4520BFC5C9D8D61A_05A8CC255726C6A8_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(C(F)(F)F)C=C1""",21,"""B88421D1496BF4E9"""
-"""97466BC637838530_55CDC31E53CA1E0E_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C=CC(=C1)OC)OC""",21,"""B88421D1496BF4E9"""
-"""C30EC62117E8541E_B8AA0197412A07E1_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(C)C1=CC=CO1)=O""",21,"""B88421D1496BF4E9"""
-"""B170161FE965EF88_555E660D2142428D_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=COC(=N1)C2=CC=CS2""",21,"""B88421D1496BF4E9"""
-"""A95519BC5BBF5A81_8BDD58EB6DBDC60D_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C2=CSC=C2""",21,"""B88421D1496BF4E9"""
-"""831C8D1DAB2C3A10_6F5BC2B72E6D71EB_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC(=N1)C2=CC=CS2""",21,"""B88421D1496BF4E9"""
-"""76308E70F837E0EE_E1EEF99BE6724B31_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(CCC(C)C)C)=O""",21,"""B88421D1496BF4E9"""
-"""730EB9694AAA3D7C_CA04B6F0F652E4BA_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=CC=C(C=C1)C#N""",21,"""B88421D1496BF4E9"""
-"""A39A6325092D691A_78B981FEE00DA882_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NCC1=NC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""FE214E02F2D482C9_AB93B44E3F154518_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""AC8DD08B9C77B57B_99F066AB8F2694A1_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=C[N]1C=C(C)C=CC1=N2""",21,"""B88421D1496BF4E9"""
-"""3CD571A175680918_8ECDF2C77D7985C4_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=C[N]1C=CC=C(C)C1=N2""",21,"""B88421D1496BF4E9"""
-"""D00FB0A1575714F1_2765ED395497F8BF_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC2=C(C=C1)C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""2313F6DC77915E32_3AA311D57F232470_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)C(OC)=O""",21,"""B88421D1496BF4E9"""
-"""1452E327AE518F28_5A22DF0D41FC5317_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=C[NH]1)[N](=O)=O)=O""",21,"""B88421D1496BF4E9"""
-"""0F817D6E3DE155CC_652E898B62D61FE5_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NN=C(O1)C2=CC=CS2""",21,"""B88421D1496BF4E9"""
-"""68C9F3A08EF51A50_9E0A35301E6B155C_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=C(C=C(F)C=C1)F)=O""",21,"""B88421D1496BF4E9"""
-"""8B24001125C6B52F_06BF91BF38B96128_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=C(C=CC(=C1)C)C)=O""",21,"""B88421D1496BF4E9"""
-"""A994529E0C807234_AE114BF768EFF67A_6039_UN""","""C[Si](C)(C)C#CCCCOCCCCOC1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""46AB5BC7B3A878F4_5D34BA0545FE7132_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)C1=CC=C(C=C1)C#N""",21,"""B88421D1496BF4E9"""
-"""1A7287235376331F_85F27931FA5CDBAE_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=C1N=CC=CC1=CC=C2""",21,"""B88421D1496BF4E9"""
-"""1EB63569284C64A0_3BA2E066779709C0_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=N)NC(=N1)N(C)C""",21,"""B88421D1496BF4E9"""
-"""72E26C9112EF974C_EC9F7AE9A1EAA1C4_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(C)C1=CC=CS1)=O""",21,"""B88421D1496BF4E9"""
-"""5A0D64DFC1636DC0_169625933D59A631_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC=C(CC)C=C1)=O""",21,"""B88421D1496BF4E9"""
-"""41F23E7F919360EA_A626B9A06877B9ED_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NC(=O)C1=CC=CS1""",21,"""B88421D1496BF4E9"""
-"""6CC37C5E2746F3F1_68DF5BC39F69F125_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC(=N1)C2=CC=CO2""",21,"""B88421D1496BF4E9"""
-"""EA83A5859E464082_D79CA98B086D1360_6039_UN""","""C[Si](C)(C)C#CCCCOCCC(=O)NC1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""B87BDCDFBE26D0F5_EBE7F23799B676F4_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)OCC1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""2D2E19A97F3F12E1_BC8CE1D2027FB884_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NCCCC(OC)=O)=O""",21,"""B88421D1496BF4E9"""
-"""871476074E6D53E7_E528660807002B0D_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(C(C)(C)C)C=C1""",21,"""B88421D1496BF4E9"""
-"""64474790983B39EB_3154008E7BAAF620_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=C(F)C=CC=C1F)=O""",21,"""B88421D1496BF4E9"""
-"""877BC8131C6C5D6B_20B15DE7A9E58FF2_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(C(C)C)C(=O)C)=O""",21,"""B88421D1496BF4E9"""
-"""F8FCBA25F8D4DD44_2CEF6F7629C63873_6039_UN""","""C[Si](C)(C)C#CCCCOCC1OCCN(CC(C)C)C1""",21,"""B88421D1496BF4E9"""
-"""2422719361B07F85_35C8F8A71E883300_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC(=C1)C2=CC=CO2""",21,"""B88421D1496BF4E9"""
-"""30020B51478E47C7_FCE5979860425AC1_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)OC(F)F""",21,"""B88421D1496BF4E9"""
-"""CE234ED8FAF2EA84_4D7D5E829AD2C457_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(C(OCC)=O)O1""",21,"""B88421D1496BF4E9"""
-"""D0571C6647101B0A_434EE3ABC3A14A94_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=C(OC)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""8DE2A0AD61F6B24A_4E780AE184CA4439_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NNC1=NC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""9DE29DD1EB1B2DD2_B7B45CF4C67A9210_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N=C1N=C(SC)NS1)=O""",21,"""B88421D1496BF4E9"""
-"""FE128E75B74150D2_5FED2E1B5679E33F_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1C)[N](=O)=O""",21,"""B88421D1496BF4E9"""
-"""B888DA7D6B671275_FDBEA8681C3CB8F6_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NC1(CCCC1)C#N""",21,"""B88421D1496BF4E9"""
-"""76D4B9B9F1D07D09_8109BA0B83D0338B_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC=C(C(=C1C)OC)C""",21,"""B88421D1496BF4E9"""
-"""A180D35153212271_B5F8023313CE995E_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C(C(OC)=O)O1)C""",21,"""B88421D1496BF4E9"""
-"""8D14933BD918F3E8_CF2ACC52BB0526BB_6039_UN""","""C[Si](C)(C)C#CCCCOCCSC1=CC(=C(C)C=C1)C""",21,"""B88421D1496BF4E9"""
-"""A076FF75ED63C3B4_BD152BEA382C57DE_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NC(=O)C1=CC=CO1""",21,"""B88421D1496BF4E9"""
-"""6EE8AB29BB51D378_44BA0FEDD17E450E_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)OC(C)C""",21,"""B88421D1496BF4E9"""
-"""08838E0405200FF9_9E9268066064B771_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NCC1=C(C)C=CS1)=O""",21,"""B88421D1496BF4E9"""
-"""79139FF7C7891452_641C95D92108E5F9_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NCC1=CC=C(C)S1)=O""",21,"""B88421D1496BF4E9"""
-"""C7DFC851D8E79360_FD8ED24EB5E37CF8_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(CC(C)C)C1CC1)=O""",21,"""B88421D1496BF4E9"""
-"""997AE1E7BE10A21A_CACFE0526D0418E1_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(CC)CC(C)C#N)=O""",21,"""B88421D1496BF4E9"""
-"""114AA82EF6D6767F_90FEE7FCF19D4FA2_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NCCC1=CSC=C1""",21,"""B88421D1496BF4E9"""
-"""C75D4A189BF357A7_E5F06E1AFB77F0D2_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(C)C(=O)N(C)C)=O""",21,"""B88421D1496BF4E9"""
-"""FA31C21E14A29DF8_0CEEA7183C0F871D_6039_UN""","""C[Si](C)(C)C#CCCCOCCNC(OCC(F)(F)F)=O""",21,"""B88421D1496BF4E9"""
-"""DFFF882CF05E96E0_6D511932A1A06C4B_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(OC)=O)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""01A4BCB552A3194B_39998AEC1B95DDDE_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)CCC(C)C""",21,"""B88421D1496BF4E9"""
-"""38B756E0EFF37415_A61749E2A0500CB3_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)N(C)C(=O)C""",21,"""B88421D1496BF4E9"""
-"""DCEB3D80073051F4_6A34FCD3EB53BB13_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)OCCO2""",21,"""B88421D1496BF4E9"""
-"""AC423D530176E474_8435CCD8602E623B_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(OC(C)C)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""029372C8E29FCD4C_FFB1FA59598A7BC3_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC2=C([N]1C)C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""28B976929DF639D5_180B8D20F8386502_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(CC(C)C)C=C1""",21,"""B88421D1496BF4E9"""
-"""0222ABBBFC97FAB0_18720F2C47465242_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)C2=CSC=C2""",21,"""B88421D1496BF4E9"""
-"""37976852F16BA6F3_60F9A0C04261F97B_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=NC1=C(F)C=CC=C1[NH]2""",21,"""B88421D1496BF4E9"""
-"""6CB0A4F2809E85E2_299722CC0DF977C6_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=CO1)C(O)=O)=O""",21,"""B88421D1496BF4E9"""
-"""623D02A04C4993D1_2928E07118ECA709_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=CO1)C(N)=O)=O""",21,"""B88421D1496BF4E9"""
-"""B354DA75940D4803_7359E3A047BF7EEC_6039_UN""","""C[Si](C)(C)C#CCCCOCCCCC[N]1C=C(C)C=N1""",21,"""B88421D1496BF4E9"""
-"""C55C813C78A2B4F4_E4FA01BA7A33026B_6039_UN""","""C[Si](C)(C)C#CCCCOCCC(N(CC(OC)=O)C)=O""",21,"""B88421D1496BF4E9"""
-"""8DA261A8305107DD_0581AB08F717B992_6039_UN""","""C[Si](C)(C)C#CCCCOCCC[N]1N=C([N](=O)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""B49B9062B280968E_5287F46B030C70DB_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C2=COC=C2""",21,"""B88421D1496BF4E9"""
-"""0CDB8D0EB45FA9FA_F5D3D3012B11EC76_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)C2=COC=C2""",21,"""B88421D1496BF4E9"""
-"""CF15C8124642FAB3_3ACD107CDD3097C5_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=C[N]1C(=CC=CC1=N2)C""",21,"""B88421D1496BF4E9"""
-"""3F64E84743D6CB8B_E5BBD5E0957A060E_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=CS1)C(C)=O)=O""",21,"""B88421D1496BF4E9"""
-"""4505AB429AB4A476_598D6AF446B9D4E6_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC=C[N]1CC(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""CEBEDF454D55DEE9_D847DB38501C4592_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1=NC=C(C(C)(C)C)O1""",21,"""B88421D1496BF4E9"""
-"""468D5E6F726F9A43_DDD383C28AABD82B_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(CC(OCC)=O)C)=O""",21,"""B88421D1496BF4E9"""
-"""947308D9C0ECC496_41316A66D65997DB_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C(C=C1)SC)OC""",21,"""B88421D1496BF4E9"""
-"""CEC050C4CEDD480D_AD4CFFC6D9575550_6039_UN""","""C[Si](C)(C)C#CCCCOCC1OCCC2=C1C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""D3434D8AF33EDA1B_17EAD9A369D01C22_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)C(OCC)C""",21,"""B88421D1496BF4E9"""
-"""97589EFB37B5414F_CEBE8B15A860E3BD_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=N[N](C(CC)CC)C=C1""",21,"""B88421D1496BF4E9"""
-"""060227FD9195C5E1_2DAD9819A6110671_6039_UN""","""C[Si](C)(C)C#CCCCOCCCC1=CC=CC(=C1)OC""",21,"""B88421D1496BF4E9"""
-"""323E8288B532CB2B_848A09EE81FC5F16_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1=CC2=C(C=C1)OCC2""",21,"""B88421D1496BF4E9"""
-"""F0ACE021BB159458_F86F3EB4940250D1_6039_UN""","""C[Si](C)(C)C#CCCCOCCN1CCN(C(C)C)CC1""",21,"""B88421D1496BF4E9"""
-"""5C055DE3F1AE2F88_F7C9584177D822FD_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=C1C=CC=CC1=CC=C2""",21,"""B88421D1496BF4E9"""
-"""7942E8A3BAC8E547_D5342ECAEF160FC7_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=C1OCCOC1=CC=C2""",21,"""B88421D1496BF4E9"""
-"""CA13881F958E7C12_D1F3BF838DAED26B_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=CC=C(SC)C=C1""",21,"""B88421D1496BF4E9"""
-"""C56F108034142150_68863310D6EF76B0_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(C=C1)OCC#N""",21,"""B88421D1496BF4E9"""
-"""7CA50473D8A807D8_A21E1874823B80DF_6039_UN""","""C[Si](C)(C)C#CCCCOCCN(CCCC)CCCC""",21,"""B88421D1496BF4E9"""
-"""75474CA54BB2A1A4_BD041F265F1B3543_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1=CC=C(C(O)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""9681CCC5555BDE28_6F0FB4AFB89AD191_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C[S](C)(=O)=O""",21,"""B88421D1496BF4E9"""
-"""EC9B54E7FFE49EFE_D606002EBBE279A4_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C2=N[NH]C=N2""",21,"""B88421D1496BF4E9"""
-"""1E52209C21796616_CF552E4ADC2C1D1A_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=C(C=C1)F)C)=O""",21,"""B88421D1496BF4E9"""
-"""D78E27F15670CC8C_83E1ACCDF639F8EB_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=NC1=C(C=CS1)C(=O)N2""",21,"""B88421D1496BF4E9"""
-"""CE699F3B9125EA04_DA6FA7F5B0D780E1_6039_UN""","""C[Si](C)(C)C#CCCCOCCCNC(=O)C1CCCC1""",21,"""B88421D1496BF4E9"""
-"""FD1CB0AD74AAA26C_1B29D9B8B161CABA_6039_UN""","""C[Si](C)(C)C#CCCCOCCN[S](CCCOC)(=O)=O""",21,"""B88421D1496BF4E9"""
-"""BB270A8FECBB9D89_2E1F8C3F5300E577_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(OC(C)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""32DB79FE14E5C5E0_D7F18FFD96093462_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=CS1)C(O)=O)=O""",21,"""B88421D1496BF4E9"""
-"""FEA5590F18BB368E_F023684621BAAD34_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC(=N1)C2=COC=C2""",21,"""B88421D1496BF4E9"""
-"""B5F79F9DD680EC3F_B6976A9463A3362B_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=CS1)C(N)=O)=O""",21,"""B88421D1496BF4E9"""
-"""39016E6B74DF0E6C_24721F5605CA78B9_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC=C(O1)C2=CC=CS2""",21,"""B88421D1496BF4E9"""
-"""9AD87C716D7084D6_614FD838A42271E4_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NCC1=CN=CC=C1""",21,"""B88421D1496BF4E9"""
-"""677E40914A8E40C1_FC3E922D21EDCCC1_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=CC1=C([N](C)N=N1)C=C2""",21,"""B88421D1496BF4E9"""
-"""06B071081E51AA77_74D56D2B5B5A88F7_6039_UN""","""C[Si](C)(C)C#CCCCOCCNC(=O)C1=NC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""A775E7CA298A6568_19E04DCC6467AD28_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C([N](C)N=C1)C(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""A1A9C315C52F17BB_18873DB2314195C7_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)CCC(C)C""",21,"""B88421D1496BF4E9"""
-"""37D10E250F40B225_2A7BC0771EBA8D98_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C(SCC)C""",21,"""B88421D1496BF4E9"""
-"""DF3B352E5E5278D0_FE31041C659D7C78_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C[NH]C(=N1)C2=CC=CS2""",21,"""B88421D1496BF4E9"""
-"""AAC7ABE71D0147B8_6E776AB01E313ED6_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(OC)C=CC(=C1)C#N""",21,"""B88421D1496BF4E9"""
-"""BA4B9E281AED135E_EF039BB940124AF8_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)NC(=O)O2""",21,"""B88421D1496BF4E9"""
-"""A1FAB1C64AB7D5DB_C5D93B7F231D39E8_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=CC=CC(=C1)OC""",21,"""B88421D1496BF4E9"""
-"""3D5F7620CB5F893B_99776882C4AA4ED5_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(C(OC)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""E62C151B72D95C87_2D585023DF9C5218_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(NCC(C)C)=O)=O""",21,"""B88421D1496BF4E9"""
-"""73B1FCE8ED29C546_8FDEA57DF4495BA6_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1CCC(C)CC1)=O""",21,"""B88421D1496BF4E9"""
-"""977C476839014E43_6DC10CB78BC0144C_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C2=CC=CO2""",21,"""B88421D1496BF4E9"""
-"""7A8CF63454FD2359_0F3A57242DD9C191_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=C(C)C=CC=C1C""",21,"""B88421D1496BF4E9"""
-"""B7AF5B7A8DB9926A_1CB5F63CB7A8196F_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)C2CCCC2""",21,"""B88421D1496BF4E9"""
-"""AB6C300ACC760525_9BE84678887CC81D_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C2CCCC2""",21,"""B88421D1496BF4E9"""
-"""FCD8C611CFBD2B92_0AFC99773C24FA9F_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(CC(C)C)C(C)C)=O""",21,"""B88421D1496BF4E9"""
-"""52EAD7AD08A56EF6_32D8AB67A8692F70_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(CC(O)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""BAEE6F39A52CEBE4_A9AFF378F813ABF9_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NCCOCCCC)=O""",21,"""B88421D1496BF4E9"""
-"""0E3046A385D73542_5149635AA8F4AFE7_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)C(OCC)=O""",21,"""B88421D1496BF4E9"""
-"""92EAB835E808FC8C_27D3F584C46261C1_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C2=CC=CS2""",21,"""B88421D1496BF4E9"""
-"""3701D2DA88DAFCCF_865100E0363B97EA_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NC(C1CC1)C2CC2""",21,"""B88421D1496BF4E9"""
-"""C90FAFF59F6134B3_4396A773119264F5_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=NC1=C(SC=C1)C(=O)N2""",21,"""B88421D1496BF4E9"""
-"""6CC8F9D17E11BACF_72AA3BB49A4EB6B4_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NCCC1=CC=CS1""",21,"""B88421D1496BF4E9"""
-"""B2E7432992E40724_AE7537D4E637E0A2_6039_UN""","""C[Si](C)(C)C#CCCCOCCN1C(NC(C)(C)C1=O)=O""",21,"""B88421D1496BF4E9"""
-"""7CC91F53456C0638_355BED0E7F32CD76_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(C)(C#N)C1CC1)=O""",21,"""B88421D1496BF4E9"""
-"""0A8A82266AD23FA0_90766E507354809C_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=NC1=C(C=CC(=C1)F)O2""",21,"""B88421D1496BF4E9"""
-"""EB31B57A75DDE45F_F3D04BCF4FAEE69B_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(C(C)C)(C)C#N)=O""",21,"""B88421D1496BF4E9"""
-"""6CD412782C5C32D9_8E65A6CB11526284_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C([N](=O)=O)C=CC(=C1)F""",21,"""B88421D1496BF4E9"""
-"""6C925042B9996078_0F15B1843CB1DF54_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)CC(NC)=O""",21,"""B88421D1496BF4E9"""
-"""6989053388AAF743_D7DC2B200109A471_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(N(CC)C)C=C1""",21,"""B88421D1496BF4E9"""
-"""0660EC85323F354B_6CC56E7880968ADB_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)N(C)C2CC2""",21,"""B88421D1496BF4E9"""
-"""3204D53514A5B2F6_253B06457BFC3235_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=N[NH]1)C2=CC=CS2""",21,"""B88421D1496BF4E9"""
-"""64493133E1DABDD9_8FEED2040027C6B2_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C)SC(=C1)C(OC)=O""",21,"""B88421D1496BF4E9"""
-"""F1FB2FC81CF81694_365BF2832EC24738_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NNC(=O)C1CCC1""",21,"""B88421D1496BF4E9"""
-"""11F5EAD69D745818_106072827537862E_6039_UN""","""C[Si](C)(C)C#CCCCOCCCOCC1CCCCO1""",21,"""B88421D1496BF4E9"""
-"""6AB9AAD6270580C9_0E98E5E4C8C3B593_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C=C([N](=O)=O)C=C1)F""",21,"""B88421D1496BF4E9"""
-"""F7E0095511365FEF_19B4E29DE20144D1_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(OC)C=C(C=C1)C#N""",21,"""B88421D1496BF4E9"""
-"""583731FED896AE84_93497BAD10A97C48_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)C2CCCO2""",21,"""B88421D1496BF4E9"""
-"""6DE29F805E460580_CEA9A3594A0D51CD_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NCC1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""3798A5867D33BCD1_6AAB99D680EC2509_6039_UN""","""C[Si](C)(C)C#CCCCOCCCCCN1CCCCC1""",21,"""B88421D1496BF4E9"""
-"""1CE87464843E97F1_D79B4BF323BB3F6E_6039_UN""","""C[Si](C)(C)C#CCCCOCC1OC(=C(C(OC)=O)C1)C""",21,"""B88421D1496BF4E9"""
-"""785A4260EFB06FE1_11707157EE5E93C3_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(ON=C1)C2=CC=CO2""",21,"""B88421D1496BF4E9"""
-"""93E664C30BA315E3_426FBB33094DF222_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C2C(=CN=C1)C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""4E7FFE4050D68B85_37D46332C9E12C71_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(C)C1=CC=CC=C1)=O""",21,"""B88421D1496BF4E9"""
-"""849C4F8D253201F9_E4FC84E3A80215F1_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1=CC=C(C)C=C1)=O""",21,"""B88421D1496BF4E9"""
-"""16D1AC8B60AD5460_1449C414D4349AD1_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1=C(F)C=CC=C1)=O""",21,"""B88421D1496BF4E9"""
-"""9417CBBC2836356A_C81B7BA52E8CDD31_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1=CC=C(F)C=C1)=O""",21,"""B88421D1496BF4E9"""
-"""552FE4BEB82E9D76_E119FAF164F99FF7_6039_UN""","""C[Si](C)(C)C#CCCCOCCC(C1=CC=C(C)C=C1)=O""",21,"""B88421D1496BF4E9"""
-"""DFBC17A0F192593F_F13FF9B8625497C4_6039_UN""","""C[Si](C)(C)C#CCCCOCCCOCC1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""30DAC52B1F6ACD07_7D1D9CEE1E139E23_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N1CC(C)OC(C1)C)=O""",21,"""B88421D1496BF4E9"""
-"""72773B9234781F0B_893157AFB54286E0_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1=CC=CC(=C1)C)=O""",21,"""B88421D1496BF4E9"""
-"""D71BB8F51EF1EFB2_1FB6ABE88E96044C_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(SC(C)C)C=C1""",21,"""B88421D1496BF4E9"""
-"""04A4F7598B3A7653_F2A7EEA2AA3DF601_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=C(C=CC(=C1)F)F)=O""",21,"""B88421D1496BF4E9"""
-"""BB33AB46FF7902B7_D1C4DB9CDC36360D_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NN=C([N]1C)C2CCC2""",21,"""B88421D1496BF4E9"""
-"""1B5656F10FAFF0DA_6EE1FF1896D7CF6F_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1=C(C)C=CC=C1)=O""",21,"""B88421D1496BF4E9"""
-"""ED02E683C801CBB2_9E275CB5C5ADDC49_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(C(C)C)C(=O)O)=O""",21,"""B88421D1496BF4E9"""
-"""69D500972D04D8B4_7CFEB74BA7C921B1_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=NC1=C(C)C=CN=C1[NH]2""",21,"""B88421D1496BF4E9"""
-"""471F111EDCBD294F_67A6A5AF6F1B5C93_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(N=C(C)S1)C(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""7093E3B7DAB2CF15_59A3C2DBA623A65C_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)[NH]C(=N2)C""",21,"""B88421D1496BF4E9"""
-"""AE52E7487766C837_8E323A960B3D6A2B_6039_UN""","""C[Si](C)(C)C#CCCCOCC[N]1C=C(C(OC)=O)N=N1""",21,"""B88421D1496BF4E9"""
-"""769916754256E1AD_368DD693FB8A409B_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1=CC=CC(=C1)F)=O""",21,"""B88421D1496BF4E9"""
-"""652EE5F6CEAB6D8E_541D017AB001936A_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC=CC(=C1)OC)=O""",21,"""B88421D1496BF4E9"""
-"""B8F85A9E5BBC4545_8ADCCC16B61634B7_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1CCCCC1C)=O""",21,"""B88421D1496BF4E9"""
-"""1CC833C2923A4936_E4C0518FF3A71315_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)N=CC=C2""",21,"""B88421D1496BF4E9"""
-"""98C21909AA49D603_FC7E082C3ED61F2A_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N1C(CCCC1C)C)=O""",21,"""B88421D1496BF4E9"""
-"""DCE78432D59A0B31_271E02712654589D_6039_UN""","""C[Si](C)(C)C#CCCCOCCC2COC1(CCCC1)O2""",21,"""B88421D1496BF4E9"""
-"""4EB626EF39C4947B_1D21EDB099AEF694_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C([N](=O)=O)C=C1)F""",21,"""B88421D1496BF4E9"""
-"""02A42A150DBD314F_D71C43F0FEA798F1_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(C(NC)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""AEAB371FF75E01CB_A5D858045ADB72A7_6039_UN""","""C[Si](C)(C)C#CCCCOCC[N]1C(=CN=C1C)[N](=O)=O""",21,"""B88421D1496BF4E9"""
-"""011C1836FD149CC8_29536A4EC1F84CB0_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC=CC(=C1OC)OC""",21,"""B88421D1496BF4E9"""
-"""D21E6F41826F0AE6_0038381B857099AC_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C(OC)C(=C1)F)F""",21,"""B88421D1496BF4E9"""
-"""041967970C4F2FCC_99E6F72D28EF735C_6039_UN""","""C[Si](C)(C)C#CCCCOCC2CCC1(CCCCC1)O2""",21,"""B88421D1496BF4E9"""
-"""DA104BCF248C2D80_8B8AA8A920B52811_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1CCC(F)(F)CC1)=O""",21,"""B88421D1496BF4E9"""
-"""C9B1CA7E3C832957_388333A444984B61_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC=C(C(F)(F)F)C=C1""",21,"""B88421D1496BF4E9"""
-"""7196391BCD9DBF6C_E1DA458D925CE3C0_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C([Si](C)(C)C)C=C1""",21,"""B88421D1496BF4E9"""
-"""21C7188CE21CD58F_E64BED71ACB34B63_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NN=N[N]1CC(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""3AAA910FA4A2C367_ADC4A8050C257253_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=N[N](CC(F)(F)F)N=N1""",21,"""B88421D1496BF4E9"""
-"""5272CC2A8A835B6E_1F5F904551651E8F_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(C=C1)C2CCC2""",21,"""B88421D1496BF4E9"""
-"""B1AD80478BE40759_972667145F8E4800_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NN=C2[N]1CCCCC2""",21,"""B88421D1496BF4E9"""
-"""65B3B0BDE7E0C4EE_BA56332A736E1AAC_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=N1)C(OC)=O""",21,"""B88421D1496BF4E9"""
-"""6681470F3DC7B087_4921C1CB15655AB7_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C([S](N)(=O)=O)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""33C90EB60860C9DE_832E7430EDFB39E4_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C(C(OCC)=O)(C)C)=O""",21,"""B88421D1496BF4E9"""
-"""537D8F0AD17D8511_F4E5637C0622CCDE_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C([S](Cl)(=O)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""FF69EA1AD6E8E619_08AE1832DD942DB0_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(N=C1)C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""50EB3EDE39A67245_9C894C3B5092707C_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C([S](C)(=O)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""A0C8552A1C3F7455_24476ECE55E9D38B_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C=CC=C1)[S](=O)(=O)Cl""",21,"""B88421D1496BF4E9"""
-"""714723F025CF7B41_144C499C9304AFE1_6039_UN""","""C[Si](C)(C)C#CCCCOCCCC1(CCOCC1)C#N""",21,"""B88421D1496BF4E9"""
-"""CD2B56B3B74662FA_5D298D3E9A0ED8C5_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(OC)N=C(C=C1C)C""",21,"""B88421D1496BF4E9"""
-"""C752655518128080_4F3AE8359F06E4FE_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=CC=C1)[S](=O)(=O)Cl""",21,"""B88421D1496BF4E9"""
-"""0147646252CFB7C1_C0A93402D2B2D871_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(F)(F)F)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""5FBEE6A04B970BAF_086C302AB61AB2E7_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)COC1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""6D4943E4052761B6_1C7A225C3EF8453F_6039_UN""","""C[Si](C)(C)C#CCCCOCCC(CC(OCC)=O)(C)C""",21,"""B88421D1496BF4E9"""
-"""46BBD59EEBB0C82B_2C718BB00F22CEE8_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(NC(C)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""06DADD22751A4B7C_5490696692F95818_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=NC=C1)OC)=O""",21,"""B88421D1496BF4E9"""
-"""C752655518128080_66C575909A908097_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)[S](Cl)(=O)=O""",21,"""B88421D1496BF4E9"""
-"""0BB524AFE117865E_1C41E261BA2755E7_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C([S](F)(=O)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""2C6E88A618AD5F25_9D1E347495EFEE29_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC=CC(=N1)OC)=O""",21,"""B88421D1496BF4E9"""
-"""2A7C83996BB4AF2A_999C78DCADFEE0EC_6039_UN""","""C[Si](C)(C)C#CCCCOCCN1C2=C(CC1)C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""235F55AD1D1BEE51_4A408AE7B5AA7457_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(N=C(C(C)C)C=C1)C""",21,"""B88421D1496BF4E9"""
-"""2E2BA862251282D5_4FDF2A7963E4A4BF_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=CS1)C(OCC)=O""",21,"""B88421D1496BF4E9"""
-"""EB20C6BBF4BCEB8B_D136120C10F2565C_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=N[N](CC(F)(F)F)C=C1""",21,"""B88421D1496BF4E9"""
-"""951C07F7C93B23DF_EB24FB10E66D9F0A_6039_UN""","""C[Si](C)(C)C#CCCCOCCN(C)CC1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""568A34C4AD9F2DE5_5616029C64EAEA44_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)[S](C)(=O)=O""",21,"""B88421D1496BF4E9"""
-"""E809DED57618C5B8_1247ED0509851756_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C[N](CC(OC)=O)N=N1""",21,"""B88421D1496BF4E9"""
-"""FB14E6ED81AC3EA4_1E06FD28EBE7377D_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N1CC(CC(C)C1)C)=O""",21,"""B88421D1496BF4E9"""
-"""E41AE2F65DC08EA7_3AEA1F394EFBEF9F_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N1CCCCC1CC)=O""",21,"""B88421D1496BF4E9"""
-"""A91D783323E7299F_0114AAC094E7000F_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=N[N]1C2CCCC2""",21,"""B88421D1496BF4E9"""
-"""D60A1DC35A0C9C6A_44E8371F5DCD0B03_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=N[N]1CC(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""00059261DCE8FEC9_B32EAC83B053FDA0_6039_UN""","""C[Si](C)(C)C#CCCCOCC2COC1=C(C=CC=C1)O2""",21,"""B88421D1496BF4E9"""
-"""D78CE6614C9AEE9A_DB5B9EF309189762_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(C)CC1=CC=CO1)=O""",21,"""B88421D1496BF4E9"""
-"""8AFFD88D16B0A382_EDA52A03A81D7B4C_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)CCC1CCCCO1""",21,"""B88421D1496BF4E9"""
-"""A1D9812DCDBB56F0_2305DD580858C29B_6039_UN""","""C[Si](C)(C)C#CCCCOCCC(NC1=NOC(=C1)C)=O""",21,"""B88421D1496BF4E9"""
-"""B36C032A1C2C27A3_30F87870FDC77C71_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NC1=C(C=CS1)C#N""",21,"""B88421D1496BF4E9"""
-"""FA25C7C08DFBE858_AFE108F482D18FD3_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC(=C1)C2=CC=CS2""",21,"""B88421D1496BF4E9"""
-"""A05E7BDCC266A7B8_5AF9FDA13D4272A7_6039_UN""","""C[Si](C)(C)C#CCCCOCC(OC)CC1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""4B0EBC0A90AB1565_2E60BFFE63D6036E_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=C(C=CC=C1)C#N""",21,"""B88421D1496BF4E9"""
-"""D6A8AE8EDDAA27D1_D64052EB2710EB8A_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(NCCCC)=O)=O""",21,"""B88421D1496BF4E9"""
-"""539E1AF4E6A05063_FB55444A45D41090_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=NC1=C(C=C(F)C=C1)O2""",21,"""B88421D1496BF4E9"""
-"""C394DEB94C6DE839_8864FAF4BD1EE050_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(ON=C1)C2=CC=CS2""",21,"""B88421D1496BF4E9"""
-"""AB952C29D70D7ACD_B8B99A97CF2FA125_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CSC(=N1)C[S](C)(=O)=O""",21,"""B88421D1496BF4E9"""
-"""D6C01CD9D05617D8_A74495087958465D_6039_UN""","""C[Si](C)(C)C#CCCCOCCC(CC)(CC)C(=O)OC""",21,"""B88421D1496BF4E9"""
-"""CF17D11884CA5306_3733D63998A16AB0_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=C(OC)N=CC=C1)=O""",21,"""B88421D1496BF4E9"""
-"""86C5D3FC05158382_072BC19CEE3AC3C4_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=C(C=C(C)C=C1)C)=O""",21,"""B88421D1496BF4E9"""
-"""5D02AC9E98ABA738_D8066EC8D0DC70A7_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C(N(C)C)C=C1)C""",21,"""B88421D1496BF4E9"""
-"""FA8062A9D3747D48_607CEF96124AE909_6039_DP""","""C[Si](C)(C)C#CCCCOCC(NCC1CCCNC1)=O""",21,"""B88421D1496BF4E9"""
-"""25004FC1BED8CFEC_EE7CDC191938F1AC_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=N[N]1C)C(OC)=O""",21,"""B88421D1496BF4E9"""
-"""58AE069648171471_D37603FAC4725998_6039_UN""","""C[Si](C)(C)C#CCCCOCCOCC(C(F)(F)F)(F)F""",21,"""B88421D1496BF4E9"""
-"""C704745F9CEE0701_C53D7B013333C167_6039_UN""","""C[Si](C)(C)C#CCCCOCCCC1=C(OC)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""89F10FB2FA6A9B1B_B1AB7E13BA2BBF32_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(OC)=O)C=CC=N1""",21,"""B88421D1496BF4E9"""
-"""F3F69234F007FC7B_2CAFAE016A8E00D0_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=CC(=N1)N(C)C)C""",21,"""B88421D1496BF4E9"""
-"""E50FB8DF11FA88B9_F2D85A65E704CC49_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(C)CC1=CC=CS1)=O""",21,"""B88421D1496BF4E9"""
-"""C4EED796AD4ABD08_C9A121D1F9DD8883_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C(OCC)C""",21,"""B88421D1496BF4E9"""
-"""1846CA843DE0CDE7_57C934E743EAB430_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)CC(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""6475716EDAD0A797_F640A7F5933F942D_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)C1=CC(=CC=C1)C#N""",21,"""B88421D1496BF4E9"""
-"""3583D5127FA0C61B_C01062721EC7B628_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=N[N](C=C1)C2CCCC2""",21,"""B88421D1496BF4E9"""
-"""530DD4E1C6B831E4_9C50EABB316008DA_6039_UN""","""C[Si](C)(C)C#CCCCOCCCSCC1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""9C3B0937E7CE7C10_6DD6B55A832224CE_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(OC(F)F)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""3A2F7EDA327FDE66_58E9A5815E7409C2_6039_UN""","""C[Si](C)(C)C#CCCCOCCCCOC1CCCCC1""",21,"""B88421D1496BF4E9"""
-"""DDC8D2EC4C54B77D_D4F5C5C6A229F285_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C(OC)C=C1)C#N""",21,"""B88421D1496BF4E9"""
-"""A310A57D22108537_E9CB558349F1EACA_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)NC(C)=O""",21,"""B88421D1496BF4E9"""
-"""4C578897B00311EB_C1A75CE3A0A8E53F_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(OC(F)F)C=C1""",21,"""B88421D1496BF4E9"""
-"""ECB31BE76CF87083_F454DFED7E0CFE38_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=NC=C[N]1C(C)C)=O""",21,"""B88421D1496BF4E9"""
-"""3CC44FE52811686F_41922D04A334713F_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=N[N](C)C(=C1)C(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""08371B6B702D14EE_354A7C91935D700A_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=N[N]1C)C(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""57B6AB9BBEE63DB5_B83380860E892628_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(CCCCC)C)=O""",21,"""B88421D1496BF4E9"""
-"""F9319A6060C59CB8_89A77DEC68A135BC_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C=CC=C1)OC2CC2""",21,"""B88421D1496BF4E9"""
-"""186CD8BC50653108_A248609DA4DACBA4_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1=CC(=N[N]1C)C)=O""",21,"""B88421D1496BF4E9"""
-"""0C33B9E7533ACE5E_CDEEC5FE1A872EC4_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)CCC1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""E0E3E52043CD3F4E_3E7B2A9E1F014ED4_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=N[N](CC)N=C1C)=O""",21,"""B88421D1496BF4E9"""
-"""E6085B05D6F3D2F4_6A2FF7614C874F40_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)CC(NC)=O""",21,"""B88421D1496BF4E9"""
-"""6F94B71CB4AAF76E_12EB7CFE38C87D43_6039_UN""","""C[Si](C)(C)C#CCCCOCC1CN1CC2=CC=CC=C2""",21,"""B88421D1496BF4E9"""
-"""B44DEEDA20659E39_D8249A0F8769C1F5_6039_UN""","""C[Si](C)(C)C#CCCCOCCO[S](C[S](C)(=O)=O)(=O)=O""",21,"""B88421D1496BF4E9"""
-"""645BFC5E8F32CA53_045272B5DA44154D_6039_DP""","""C[Si](C)(C)C#CCCCOCC2=CC1=C(CCNC1)C=C2""",21,"""B88421D1496BF4E9"""
-"""8D24EC49F4039872_E6C80FC3CBBA3279_6039_DP""","""C[Si](C)(C)C#CCCCOCC(N[C@@H](C(C)C)C(=O)O)=O""",21,"""B88421D1496BF4E9"""
-"""EB376042937A0AA9_68143847AF30D848_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C(OCC)=O""",21,"""B88421D1496BF4E9"""
-"""EA43462D28A1076B_CAA9E13492CDA3E0_6039_DP""","""C[Si](C)(C)C#CCCCOCC(N[C@H](C(C)C)C(=O)O)=O""",21,"""B88421D1496BF4E9"""
-"""18F7C062941AA4E9_E5FCDB71BD6460A4_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CN=C(C(F)(F)F)N=C1""",21,"""B88421D1496BF4E9"""
-"""AABA1517F3E76C96_E2AD28EBC1DFC7B8_6039_UN""","""C[Si](C)(C)C#CCCCOCCC2=NC1=C(C=CC=C1)[NH]2""",21,"""B88421D1496BF4E9"""
-"""604EE4A1CC9C2079_27F563AB1F441819_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)C(C)(C)C""",21,"""B88421D1496BF4E9"""
-"""ECCA3BAA3C67FD95_C43844EF091D6987_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC=CC(=C1)OC(C)C""",21,"""B88421D1496BF4E9"""
-"""E6A455DA74471DB8_617D47244B03C49F_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C=C(C(O)=O)C=C1)F""",21,"""B88421D1496BF4E9"""
-"""D3C369E3A5540ABB_7AFE9EFA931549EF_6039_UN""","""C[Si](C)(C)C#CCCCOCCCN(C)C1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""CB17169FE4A63B7F_E0B19A04203D2905_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(F)C=C(C(=C1)F)C#N""",21,"""B88421D1496BF4E9"""
-"""B10938584A49D7FA_AC9F7367D18A9739_6039_UN""","""C[Si](C)(C)C#CCCCOCCSC1=CC=CC(=C1)OC""",21,"""B88421D1496BF4E9"""
-"""46701B9043105503_7FA35BFF7E0AB003_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1=NSC2=C1C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""1F7EBD81BF04ADEF_421A73ADA4AB41FE_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1=NOC2=C1C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""D85CA7C5131C0980_F1F46DD1FD508518_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC2=C(N=C1)C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""37378A96972FC331_B1AFBA9E4636F485_6039_UN""","""C[Si](C)(C)C#CCCCOCCO[P](OCC)(=O)OCC""",21,"""B88421D1496BF4E9"""
-"""1F12835294B7C097_C2553B8588045D9F_6039_UN""","""C[Si](C)(C)C#CCCCOCCSC1=C(C=C(F)C=C1)F""",21,"""B88421D1496BF4E9"""
-"""B8BD738EFF2EE524_1DB936D95E595869_6039_UN""","""C[Si](C)(C)C#CCCCOCCCOCCOCCOC""",21,"""B88421D1496BF4E9"""
-"""FD10CCD7C99F88CF_98F131073681790B_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C([N](=O)=O)C=C(C=C1)F""",21,"""B88421D1496BF4E9"""
-"""6D098C80A2A59958_46454AEC92B7316E_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1=N[N](C(C)(C)C)N=N1""",21,"""B88421D1496BF4E9"""
-"""56C1AD27A819B79F_4D0C8D2318F02849_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1CCC2=C1C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""D2F012A027A07F88_010679A5F8257AC0_6039_UN""","""C[Si](C)(C)C#CCCCOCCCC(CC(OCC)=O)=O""",21,"""B88421D1496BF4E9"""
-"""DA35634F94A8E66E_7549FA4C33818940_6039_DP""","""C[Si](C)(C)C#CCCCOCC1=CC=CC2=C1CCNC2""",21,"""B88421D1496BF4E9"""
-"""D579F54699B1190E_D5E86C6EB4958F47_6039_UN""","""C[Si](C)(C)C#CCCCOCC(OC)C1=CC=C(C=C1)F""",21,"""B88421D1496BF4E9"""
-"""B57B67006844573C_C55BF7AC8A941BDE_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=NC1=C(C=CC(=C1)C)S2""",21,"""B88421D1496BF4E9"""
-"""70F6A5037549D41D_9BAB4DDFDC511892_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(F)(F)F)N=CC=C1""",21,"""B88421D1496BF4E9"""
-"""B97D0408A68A8FCE_D72563BC9ABCE429_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(CC)CC(F)(F)F)=O""",21,"""B88421D1496BF4E9"""
-"""815C5AED5F542550_C2E3DAEC6FE05506_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1=C(C)C=CC=N1)=O""",21,"""B88421D1496BF4E9"""
-"""E9951C01E30BD13B_61BDB444C214A3AB_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1F)[N](=O)=O""",21,"""B88421D1496BF4E9"""
-"""C0B1CFE77217F984_AC2A6F34933B1C90_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=NO1)C(OCC)=O""",21,"""B88421D1496BF4E9"""
-"""59E4C4EC26F9703A_6A0C1FC086DA54DA_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)C=CN=C2""",21,"""B88421D1496BF4E9"""
-"""A62A101FAB12FD72_B0B92878C2D4B6D8_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=C1CCOCC1=CC=C2""",21,"""B88421D1496BF4E9"""
-"""7C51FC689E552225_117206908FA6F4C2_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC1CCN(C)CC1)=O""",21,"""B88421D1496BF4E9"""
-"""92CA5A3A6D746BDD_5E605B93B844F2B9_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C(C)C=C1)[N](=O)=O""",21,"""B88421D1496BF4E9"""
-"""E1686E7117EF2F2C_D2DDAA881DCFE667_6039_UN""","""C[Si](C)(C)C#CCCCOCC1CC2(CO1)CCCCC2""",21,"""B88421D1496BF4E9"""
-"""8068B652E773D5DC_59B077CCF3F64890_6039_UN""","""C[Si](C)(C)C#CCCCOCC1CC2(CO1)CCOCC2""",21,"""B88421D1496BF4E9"""
-"""FC9A793CF25359DA_D9FBC4D88A4D7C96_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)N=CC=N2""",21,"""B88421D1496BF4E9"""
-"""CA996C940FDD3740_6DA5B6B59463A2C1_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CN=C(C(OCC)=O)S1""",21,"""B88421D1496BF4E9"""
-"""91565A0043C18401_F9A3E820183DF17A_6039_UN""","""C[Si](C)(C)C#CCCCOCC2CCC1(CCOCC1)O2""",21,"""B88421D1496BF4E9"""
-"""06016865DF0ECA4E_B4A419CC5738C486_6039_DP""","""C[Si](C)(C)C#CCCCOCC2OCC1(CCNCC1)C2""",21,"""B88421D1496BF4E9"""
-"""FA11CF4F85AB7545_578D260270218A4B_6039_UN""","""C[Si](C)(C)C#CCCCOCC2COC1(CCCCC1)O2""",21,"""B88421D1496BF4E9"""
-"""045FB075CA29E04D_192C6C3159361A1A_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N1CC(C)(C)OCC1)=O""",21,"""B88421D1496BF4E9"""
-"""74F32D9069B16847_A39FEFCF64AB5D2C_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC=C(OC)C=C1)=O""",21,"""B88421D1496BF4E9"""
-"""D505C0B09C55AC46_92AC95FFCB13BC4B_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)N1CC2CCC(C1)O2""",21,"""B88421D1496BF4E9"""
-"""1EF70DD7A7D75DC4_893FAB54B086305F_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC=C(F)C=C1)(F)F""",21,"""B88421D1496BF4E9"""
-"""E4AB2EFF9D5C7B30_A709B403B915C6CA_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NC1CCCCCC1""",21,"""B88421D1496BF4E9"""
-"""7506A90FC4516807_FCA0BB366340EDC4_6039_UN""","""C[Si](C)(C)C#CCCCOCCCOC1=CC=C(F)C=C1""",21,"""B88421D1496BF4E9"""
-"""9FB62A0D50EA10E6_0DFF675352E40E67_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC(=O)C1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""27636B08B02D604B_405E666E5EE2791B_6039_UN""","""C[Si](C)(C)C#CCCCOCCC[S](NC(C)(C)C)(=O)=O""",21,"""B88421D1496BF4E9"""
-"""FB3D3A1D3CEB1617_E6148E5C8F0599D5_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=C(OC)C=CC=C1)=O""",21,"""B88421D1496BF4E9"""
-"""F488F49C0F3E88B4_8A71A0BC6771955A_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)C(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""4BBD6E9281C21B15_2A17720AC1BF71EB_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(F)C=C(C(=C1)C#N)F""",21,"""B88421D1496BF4E9"""
-"""D4007F48101D9610_6C35FA16FBBD8F18_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(CC(C)C)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""7E6CF27C2F48E823_9064D3FB77EE187D_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NCC1CCCCC1""",21,"""B88421D1496BF4E9"""
-"""016DA511ADF634DA_C07D2D3E6B8D7472_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(C)C1CCCCC1)=O""",21,"""B88421D1496BF4E9"""
-"""132C2B73C6C893AA_A5A01B8A32711DD1_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)COC(C)C""",21,"""B88421D1496BF4E9"""
-"""14F38831E98A7752_F9EA35DB16B32AB4_6039_UN""","""C[Si](C)(C)C#CCCCOCC2COC1(CCOCC1)O2""",21,"""B88421D1496BF4E9"""
-"""B5B7556682048816_9D4DCDF29A098F35_6039_UN""","""C[Si](C)(C)C#CCCCOCC1CCCC(C(F)(F)F)O1""",21,"""B88421D1496BF4E9"""
-"""D44663973B7E46F9_695AD58E71BC2BCE_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NSC(=N1)C(OCC)=O""",21,"""B88421D1496BF4E9"""
-"""D5BD9E63EB191BD4_0D32EBFF7ECFDFBD_6039_UN""","""C[Si](C)(C)C#CCCCOCCCCCCCCCCC""",21,"""B88421D1496BF4E9"""
-"""982B4690944AD527_376748CF548D7D5C_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NN=C2C(=O)NC=C[N]12""",21,"""B88421D1496BF4E9"""
-"""4C21BA48DE91512D_BAE35C60D9CCA82D_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=C(S1)C(C)(C)C)C""",21,"""B88421D1496BF4E9"""
-"""154342862AB1A138_48DA86632B111FDC_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)C=NC=C2""",21,"""B88421D1496BF4E9"""
-"""B48A0CB9BF3FD72D_F5D1D87324CBFEBF_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C)C=C(C=C1C)C#N""",21,"""B88421D1496BF4E9"""
-"""304EDAEB60882E30_558C4814A2F7D31B_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CN=CC(=C1)C(OC)=O""",21,"""B88421D1496BF4E9"""
-"""A85C026212C01861_2C8D7D4FE17BE44F_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)[S](F)(=O)=O""",21,"""B88421D1496BF4E9"""
-"""636A0462876A3B34_D1D75E88C6DC3E7F_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(CC(C)=O)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""2E0EADC781BFBE09_B7E39AE5A4380DC2_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=NN=C1C2CC2)C""",21,"""B88421D1496BF4E9"""
-"""9F776859258F8F37_A87C777879647D00_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=N1)C(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""1E54B5D5397BE607_9E95CE589C743207_6039_UN""","""C[Si](C)(C)C#CCCCOCCCN1CCC(F)(CC1)F""",21,"""B88421D1496BF4E9"""
-"""FEF02DFFE355E199_96640A484A10AC41_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C)C=CC(=C1)[N](=O)=O""",21,"""B88421D1496BF4E9"""
-"""798CB20F2781F5E7_69DA4159AE495714_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C=CC(=C1)C(O)=O)F""",21,"""B88421D1496BF4E9"""
-"""1A81109484761E07_C02DB2BDF17C32F5_6039_UN""","""C[Si](C)(C)C#CCCCOCCNC(=O)C1CCOCC1""",21,"""B88421D1496BF4E9"""
-"""82D73C8823177A4A_6F0E1DC4563B0C53_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC=CC(=C1)C(OC)=O""",21,"""B88421D1496BF4E9"""
-"""B7D0450663C448D9_A92CD69A281CE5B8_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)COCC2""",21,"""B88421D1496BF4E9"""
-"""9A4A06226EADA507_32D9B9BC3E9AF06A_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1CC[S](=O)(=O)CC1""",21,"""B88421D1496BF4E9"""
-"""9AE4F1A7134EA517_68368B1351BFFA41_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NSC2=C1C=CC(=C2)F""",21,"""B88421D1496BF4E9"""
-"""C91B1BA32F228BC9_C4F62FD38EA364BE_6039_UN""","""C[Si](C)(C)C#CCCCOCCCNC(C(CC)CC)=O""",21,"""B88421D1496BF4E9"""
-"""666DFBBF60C95D88_F54AAD18E6D7ADBD_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(F)C=C(C=C1F)C#N""",21,"""B88421D1496BF4E9"""
-"""1BE44E69DA77C442_143710193E1D0F80_6039_UN""","""C[Si](C)(C)C#CCCCOCC1(F)OC(=O)CC12CCC2""",21,"""B88421D1496BF4E9"""
-"""531A114A516A5350_3DA05F5EEE9BB246_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C([N](C)N=N1)C(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""586F0E3D65A3FEDF_83A6A62F35C1CF89_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C[N](C)N=C1C(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""77E22D080211D265_D5F45AA8FCA0CF2A_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C(OCC)C=C1)F""",21,"""B88421D1496BF4E9"""
-"""7F35586616000446_33ABA4C7A1A1FEFB_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=NC1=C(F)C=CC=C1O2""",21,"""B88421D1496BF4E9"""
-"""1F893F3B7110A3E0_C222F8C72F885347_6039_DP""","""C[Si](C)(C)C#CCCCOCC1OCCC12CCNCC2""",21,"""B88421D1496BF4E9"""
-"""CC6D5606AFBBCDFA_2A32CE02C34C1AE7_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C([S](N)(=O)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""B485E8462288389C_52AF83A052038C4C_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC=C([N](=O)=O)O1)=O""",21,"""B88421D1496BF4E9"""
-"""CEB4CC6F4F63CB89_C95E128C65CD0265_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C([S](C)(=O)=O)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""338DC3F70A1113C8_D072EF7D1549975E_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=NO1)C(OC)(C)C""",21,"""B88421D1496BF4E9"""
-"""A3BFFA0F81F08A5D_7646D3440C2D609A_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NCCCOC(C)C)=O""",21,"""B88421D1496BF4E9"""
-"""6F6108690750A99D_CC5F658DBC24F3EB_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NCCC2=C1C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""7EE26C91FF674C4C_3801C490590FDDD6_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(SC(F)F)C=C1""",21,"""B88421D1496BF4E9"""
-"""4E46F2A1872229E3_80D8F6F4BBE298D9_6039_UN""","""C[Si](C)(C)C#CCCCOCCC(=O)NC1=NC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""FDAF295102831205_8ADE2009A456C304_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C)OC(=C1)C(OC)=O""",21,"""B88421D1496BF4E9"""
-"""537D8F0AD17D8511_30624A1D22B23F4E_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(C=C1)[S](=O)(=O)Cl""",21,"""B88421D1496BF4E9"""
-"""0B6A2617252C5060_CB16F3303FFF9442_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1[N](=O)=O)C""",21,"""B88421D1496BF4E9"""
-"""FB918F4469B16D37_3FEEFCCAB4BF081C_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)C=CC=N2""",21,"""B88421D1496BF4E9"""
-"""F8E2EFBEC4338282_1F90544716460DAA_6039_UN""","""C[Si](C)(C)C#CCCCOCCCOC1=C(F)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""7ABD72322ECC88CC_41CF631E3825E5F9_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C=CC(=C1)[N](=O)=O)F""",21,"""B88421D1496BF4E9"""
-"""F19DC65F7D1626F4_24B140246A0CD003_6039_UN""","""C[Si](C)(C)C#CCCCOCCCNC(CC(C)(C)C)=O""",21,"""B88421D1496BF4E9"""
-"""013FE281A1772E9A_D3CA4E5CABBD90D7_6039_UN""","""C[Si](C)(C)C#CCCCOCCC(=O)N1CCCCCC1""",21,"""B88421D1496BF4E9"""
-"""6545E6251D57F353_35111609C72AE15F_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=NC1=C(CCCCC1)S2""",21,"""B88421D1496BF4E9"""
-"""172D1341F2845D52_613BABC7F58A12D3_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CN=CC(=C1)C(C)(C)C""",21,"""B88421D1496BF4E9"""
-"""A24D20643A5722C5_A3CA58BF9318E3C1_6039_UN""","""C[Si](C)(C)C#CCCCOCC2CCCC1(CCOC1)O2""",21,"""B88421D1496BF4E9"""
-"""9D462CF3646E4BEF_302D1B71D13E5887_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(C)CC1=CSC=C1)=O""",21,"""B88421D1496BF4E9"""
-"""9FDE482DE1DF5626_CEAB96495F1209E9_6039_UN""","""C[Si](C)(C)C#CCCCOCC1CCCC(F)(F)C(N1)=O""",21,"""B88421D1496BF4E9"""
-"""DC922B0EA204E10A_6565945EC014A441_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC(=N1)N2CCCC2""",21,"""B88421D1496BF4E9"""
-"""FA5D9981E790BEC4_DE88C54B9A89BC07_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C)OC=C1C(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""B51ED745A790C600_53C5EB5D9B5F8475_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=CC1=C(CN(C)C1)C=C2""",21,"""B88421D1496BF4E9"""
-"""5E1724934B30F2D9_919FEFBA4E291026_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(OCC)=O)[NH]N=C1""",21,"""B88421D1496BF4E9"""
-"""F237738071F8CECF_0E5F7A5A16B32457_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C(C)O1)[S](=O)(=O)C""",21,"""B88421D1496BF4E9"""
-"""7330045D02A48543_EAD41D449813AEA2_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC2=C1N=C(C)O2""",21,"""B88421D1496BF4E9"""
-"""B77D23B1CA9C03F6_7775EAA455AAFC46_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC=CC(=C1)OC)F""",21,"""B88421D1496BF4E9"""
-"""91F9BA4EBCCF18FB_E3F14AD584230DBF_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NN=C2[N]1CCOCC2""",21,"""B88421D1496BF4E9"""
-"""CEC12903BF073F42_6CFAA4BD61C2654D_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC2=C(C=C1)CCOC2""",21,"""B88421D1496BF4E9"""
-"""F58ACDB51761E14E_386E6C5EC80C1BC4_6039_DP""","""C[Si](C)(C)C#CCCCOCC1(OC(CC12CNC2)=O)F""",21,"""B88421D1496BF4E9"""
-"""362045A3D56B5274_C09AA7F98176D039_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=NC1=C(CC(C)CC1)S2""",21,"""B88421D1496BF4E9"""
-"""3A2C212C5EB269E5_3DB2C87DCB9E5707_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC=C(SC)C=C1)=O""",21,"""B88421D1496BF4E9"""
-"""8B54F65B257744B9_E83D4521FC381615_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CN=C(C(OC)=O)C=N1""",21,"""B88421D1496BF4E9"""
-"""9CDBD59C8F361D60_514C9C6327217479_6039_UN""","""C[Si](C)(C)C#CCCCOCCC(N1CCN(C)CC1)=O""",21,"""B88421D1496BF4E9"""
-"""4F0AABFD25D888CD_8FACF1E4C82A6864_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(F)(F)F)C=CC=N1""",21,"""B88421D1496BF4E9"""
-"""E17DBD6A6B31B5AB_D5D3DCBC9EEB2819_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(OCC)=O)SN=N1""",21,"""B88421D1496BF4E9"""
-"""8AA5B85735E35DF4_CB06EA81904A3276_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CN=C2[N]1C=C(F)C=C2""",21,"""B88421D1496BF4E9"""
-"""FBF83644214CD16E_ACF9B5DF6244E562_6039_UN""","""C[Si](C)(C)C#CCCCOCCCC(=O)N1CCCCC1""",21,"""B88421D1496BF4E9"""
-"""571400B3B09C6E88_E2D04CF0CF9D6C77_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(C)(C)C)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""AE93DCBC289BDBC3_602A4D474A724D3C_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1=CC(=C(C(=C1)F)F)F""",21,"""B88421D1496BF4E9"""
-"""65A79E92D844F2A7_D156CC25170F8204_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC=CC(=C1)[S](F)(=O)=O""",21,"""B88421D1496BF4E9"""
-"""64E4E5BC0F297E13_865C405F1C3CAF83_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CN=C(C(F)(F)F)C=C1""",21,"""B88421D1496BF4E9"""
-"""98DD71EFB20A4EA1_744F95BFB3EF652C_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=NC=C1)C(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""F118F1F484157AE0_CA591874357ADBB1_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)C1=CC=C(C=C1)C#C""",21,"""B88421D1496BF4E9"""
-"""0673EEC3CAB33373_FA3C321BFCD76785_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(OC(C)C)C=C1""",21,"""B88421D1496BF4E9"""
-"""3DA4C7D7A0424CD1_458A123EB0262398_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C(C(O)=O)C=C1)F""",21,"""B88421D1496BF4E9"""
-"""9981843CE71EAE57_F6B858DB086C24A7_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(NC(C)=O)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""CA0E61C9843D8177_1ED8F101AD04BE8F_6039_UN""","""C[Si](C)(C)C#CCCCOCC2CN1CC(CCC1=O)O2""",21,"""B88421D1496BF4E9"""
-"""169AF64B63124189_572FEBAE57658447_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NN=C(O1)N2CCCC2""",21,"""B88421D1496BF4E9"""
-"""569447BF51516056_1B6D6DF21916A7C7_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC2=C1CCCCC2""",21,"""B88421D1496BF4E9"""
-"""2B64FBB00CC8E91D_453D8FB4743ACB84_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC=C1C(OCC)=O""",21,"""B88421D1496BF4E9"""
-"""8234D574B005F094_E6E8D0705C8242F2_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC(=C1)C(OCC)=O""",21,"""B88421D1496BF4E9"""
-"""9796CB6255A30294_2A227285D2BC21BF_6039_UN""","""C[Si](C)(C)C#CCCCOC[C@@H](C(C)(C)C)N[S](=O)(=O)C""",21,"""B88421D1496BF4E9"""
-"""7D8276D88BF4CF7A_95F1C2C3AF9A6A2C_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)C1=CN=C2[N]1C=CS2""",21,"""B88421D1496BF4E9"""
-"""D0133A49B2B4E290_D4A0FA020D3597DA_6039_UN""","""C[Si](C)(C)C#CCCCOCCCOC1=CC(=O)CCC1""",21,"""B88421D1496BF4E9"""
-"""8B095053A3222BDB_65D91E36E82B41FA_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)SCCC""",21,"""B88421D1496BF4E9"""
-"""939A0D18D5DD05D0_FFACA3DA22B8E531_6039_UN""","""C[Si](C)(C)C#CCCCOCCCC1=C(F)C=CC=C1F""",21,"""B88421D1496BF4E9"""
-"""26F9BC0819DD474C_336E7C61ABBE4411_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC(=C1)C2CCCC2""",21,"""B88421D1496BF4E9"""
-"""620427A54B4F1016_A2BDAD9C214F7B08_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=N1)C(C)(F)F""",21,"""B88421D1496BF4E9"""
-"""FC4FD308ED1ABEA2_29EE558F4C88F4FA_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=CC(=CC(=C1)F)F)=O""",21,"""B88421D1496BF4E9"""
-"""AF4D3AFC8CB29CF5_94D48137FEA2D017_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=C(C(CC)C)C=C1""",21,"""B88421D1496BF4E9"""
-"""9F12CA7947596D0D_98153C612C0D1558_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC2=C1OC(=N2)C""",21,"""B88421D1496BF4E9"""
-"""794865DBCB8E7042_42ABAAA89EADFC2E_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NC(N=[S](C)(=O)C)=O)=O""",21,"""B88421D1496BF4E9"""
-"""2F7D4DB786A26E11_7C0051B437D2178C_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(F)(F)F)N=CC=N1""",21,"""B88421D1496BF4E9"""
-"""384EB3FEFB31BA6C_27F436D40E0EA331_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)[S](C)(=N)=O""",21,"""B88421D1496BF4E9"""
-"""CEE1E068D450A22C_CB9DE32B203F7B41_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NOC(=N1)C(OCC)=O""",21,"""B88421D1496BF4E9"""
-"""09EB2CB7BA38B253_DAA3E5E7FE3F21B5_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=N[N](C)C=C1[S](=O)(=O)Cl""",21,"""B88421D1496BF4E9"""
-"""36F7BFC9251A7521_E5C3E90D93E1E1EB_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=N[NH]1)C(OCC)=O""",21,"""B88421D1496BF4E9"""
-"""CED060EA3ADCD000_E42C73446EB07880_6039_UN""","""C[Si](C)(C)C#CCCCOCC2CC1(CCCC1)C(=O)O2""",21,"""B88421D1496BF4E9"""
-"""4940CFF5078C3619_80CB8B8FF72A539A_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=N[N](C)C=C1[S](=O)(=O)N""",21,"""B88421D1496BF4E9"""
-"""A40D35F78EF28161_85E6AA3D82D2FEAC_6039_DP""","""C[Si](C)(C)C#CCCCOCC2CCC1(CCNCC1)O2""",21,"""B88421D1496BF4E9"""
-"""5620DEC541471DE0_E492250DCF6BCC7F_6039_UN""","""C[Si](C)(C)C#CCCCOCC(OC1CN(C)CCC1)=O""",21,"""B88421D1496BF4E9"""
-"""F9AA92CA34431962_DB1D7146CF6F13B2_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=NC(=C1)OC)OC""",21,"""B88421D1496BF4E9"""
-"""D7CE236870E21775_162E93C28D602194_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1(C(O)=O)CCOCC1""",21,"""B88421D1496BF4E9"""
-"""E18A9FF50AEA1CB5_4C3525AD5AD670E6_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(OCC)=O)C=NO1""",21,"""B88421D1496BF4E9"""
-"""2541469EC72B5F43_7C48CB5A3EC208D3_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=NC(=N1)C2CC2)C""",21,"""B88421D1496BF4E9"""
-"""96E081294587FC36_8F45C2C9BFA4777A_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=NC(=N1)OC)OC""",21,"""B88421D1496BF4E9"""
-"""4DEF64A150952A8B_E1D1B9B90F6F598B_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(C)(C)F)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""01C6A762ED5CCA75_ED35668D459B6C48_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C(OCC)=O)C=N[NH]1""",21,"""B88421D1496BF4E9"""
-"""5130F198D16BA6C7_595D86A107DB5887_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1(CCOCC1)C#N""",21,"""B88421D1496BF4E9"""
-"""E993A8C2A3B5E220_CB684A016CFCB4AA_6039_UN""","""C[Si](C)(C)C#CCCCOCC#CC1=CC=CC(=C1)OC""",21,"""B88421D1496BF4E9"""
-"""45B6003DCB8C7BEE_A1ED1B3A66404D1D_6039_UN""","""C[Si](C)(C)C#CCCCOCCCO[S](C(F)(F)F)(=O)=O""",21,"""B88421D1496BF4E9"""
-"""B16D49979AE8AE33_30D3ECF296A879B8_6039_UN""","""C[Si](C)(C)C#CCCCOCC[S](=O)(=O)C1=CC=CC=C1""",21,"""B88421D1496BF4E9"""
-"""C7FE9501F019A3A8_3B3FF746A038B28E_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CN=C(OC)C=C1OC""",21,"""B88421D1496BF4E9"""
-"""B3BEA8073DE721B2_B0A61A6B189EE4AE_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CN=C(C(OC)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""8B7CC5A779882710_162959CFC8619190_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C([S](F)(=O)=O)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""B40185DA708CBBFC_CED9851FD5C47319_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC=C(C(C)(F)F)C=C1""",21,"""B88421D1496BF4E9"""
-"""B1C5413A294B7FAE_6B8C1F8B5A0D915A_6039_UN""","""C[Si](C)(C)C#CCCCOCC1CN1CC2=C[N](C)N=C2""",21,"""B88421D1496BF4E9"""
-"""29240F01B70CCA4A_FFCE12AFDE56F751_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC(=C(C=C1)[N](=O)=O)C""",21,"""B88421D1496BF4E9"""
-"""162D9E69D3B2DE93_81724D298A22CFEC_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=N1)OC(F)F""",21,"""B88421D1496BF4E9"""
-"""721AE506E0208EC8_C667862E7242F2D3_6039_UN""","""C[Si](C)(C)C#CCCCOCC2=C[N]1C=CC=C(F)C1=N2""",21,"""B88421D1496BF4E9"""
-"""F74B312AC6125B96_9377CAE0343CE132_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NN=C(O1)C2=CC=CO2""",21,"""B88421D1496BF4E9"""
-"""2FA4092F7E127830_FBD1C4A74BF258B5_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)C1CC2=C1C=CC=C2""",21,"""B88421D1496BF4E9"""
-"""80A4B8BDC176C674_D30311DE50C13178_6039_UN""","""C[Si](C)(C)C#CCCCOCCN1CCN(CC1)C2CC2""",21,"""B88421D1496BF4E9"""
-"""96E90E4255017117_F5CC5209BDB4197A_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)N1CCCCCCC1""",21,"""B88421D1496BF4E9"""
-"""96585CE9A0C28DBA_BEE0C7CBF5A80260_6039_UN""","""C[Si](C)(C)C#CCCCOCC(NNC(C(C)(C)C)=O)=O""",21,"""B88421D1496BF4E9"""
-"""9A529F5E863140B2_189FA499F790761B_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1=C(C)[N](C(=C1)C)C)=O""",21,"""B88421D1496BF4E9"""
-"""532C5DF5144451E4_D52AD66725EB8F77_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(SC(F)F)C=CC=C1""",21,"""B88421D1496BF4E9"""
-"""75B73C24FB8EC034_BDF8299624342133_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC(=C(O1)C)C(OC)=O""",21,"""B88421D1496BF4E9"""
-"""673FD535F9C10682_16EFD0F1E4383169_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1=CC=C([N](=O)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""38E93B628B1FD3D0_744133A4045AF821_6039_UN""","""C[Si](C)(C)C#CCCCOCCCCC(N[S](C)(=O)=O)=O""",21,"""B88421D1496BF4E9"""
-"""B1764CF94BFF4012_819992142566268C_6039_UN""","""C[Si](C)(C)C#CCCCOCC(=O)NC(=O)C1=CC=C[NH]1""",21,"""B88421D1496BF4E9"""
-"""70E2D3A2FF7609DA_9C5A2CAE44FF89D4_6039_UN""","""C[Si](C)(C)C#CCCCOCCOC1=C(C=CC(=C1)C)C""",21,"""B88421D1496BF4E9"""
-"""E1318ADB5A62A4E0_F2804EEDE1A31717_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CC=CC(=C1)OCCC""",21,"""B88421D1496BF4E9"""
-"""90DCAFC24ABEAF27_C19D6C65C7AD95C4_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C([N](=O)=O)C=CC=C1F""",21,"""B88421D1496BF4E9"""
-"""A8CF9D7688E8DC67_838D9F8C74CA032F_6039_UN""","""C[Si](C)(C)C#CCCCOCCCN(CC)CC(F)(F)F""",21,"""B88421D1496BF4E9"""
-"""C6542276CE451B3D_F3C3FAB9BAC29FBA_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=CN=C(C(C)(C)C)N=C1""",21,"""B88421D1496BF4E9"""
-"""7CD503F5FF87FE1D_FB9D63FCDD7D20F8_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=NC=C(C(OC)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""639E72CA699C7BAE_995702B471AAA259_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N(C(CC(C)C)C)C)=O""",21,"""B88421D1496BF4E9"""
-"""2D7449440AC10490_6A7BEE30E1989872_6039_UN""","""C[Si](C)(C)C#CCCCOCC(N1CC(CC)OCC1)=O""",21,"""B88421D1496BF4E9"""
-"""15208AB203BA1578_8413BC31E379E6B2_6039_UN""","""C[Si](C)(C)C#CCCCOCCC1=CC=C(C(N)=O)C=C1""",21,"""B88421D1496BF4E9"""
-"""9F063E7B5391CA10_270F0419F678D524_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C12CC(C)(C1)OCC2)=O""",21,"""B88421D1496BF4E9"""
-"""7D8174A39C169E73_E937D3A94022D959_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C2C(=CC=C1)N=CC=C2""",21,"""B88421D1496BF4E9"""
-"""CABC3A6ACF97F239_03BD0294E4DEB08A_6039_UN""","""C[Si](C)(C)C#CCCCOCC(C1CCC(C)(C)CC1)=O""",21,"""B88421D1496BF4E9"""
-"""6C642743BB93B677_CEFECA2E4E884F24_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C=C(C(N)=O)C=C1)F""",21,"""B88421D1496BF4E9"""
-"""BB70EC51ED99C1F0_ED14DCD590DA7B33_6039_UN""","""C[Si](C)(C)C#CCCCOCC1=C(C=N[N]1C)[S](=O)(=O)Cl""",21,"""B88421D1496BF4E9"""
-"""9A86C159337E4288_174C687BBE04D4FA_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=NN=C(C)O3""",21,"""AB41710177954C34"""
-"""F0767A2AA46CD693_D1E5D0868FA0F571_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCCCCCC""",21,"""AB41710177954C34"""
-"""49A191D8F0CE78D6_5BA2EAAF3C0B4E9C_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC(N(OC)C)=O""",21,"""AB41710177954C34"""
-"""2897B26586A24DFC_ABB932B9467F1C10_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=NC=C[N]3C""",21,"""AB41710177954C34"""
-"""61300340B43B3BCA_980DBB79C2D173A0_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCOCCCC""",21,"""AB41710177954C34"""
-"""F20C909A4EC92F5C_329993870BF07D73_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=CSC(=N3)C""",21,"""AB41710177954C34"""
-"""84B4BC4CA0A5B715_0FE37F8AAB160E93_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCCC(OC)=O""",21,"""AB41710177954C34"""
-"""61B0C58D73773EF4_ABDCB97537C2C034_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=CC=NC=C3""",21,"""AB41710177954C34"""
-"""478FA4339975760C_C10B967B6F85FB35_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCC(OCC)=O""",21,"""AB41710177954C34"""
-"""805E6FF09951BBCB_7716C2EF91625AC3_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCCCC(O)=O""",21,"""AB41710177954C34"""
-"""3EFE29E5BD0EAB87_4793DA3370C268B2_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=NC(=NO3)C""",21,"""AB41710177954C34"""
-"""A4F135D50AEE3A4F_62E17CB5DD5AE8DE_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC(=O)NCC#C""",21,"""AB41710177954C34"""
-"""2B2233C57351235C_DC0707A5599B81D3_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC(=O)NCC#N""",21,"""AB41710177954C34"""
-"""324F026D93F63883_AD76C21DABA5E965_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC#C[Si](C)(C)C""",21,"""AB41710177954C34"""
-"""EC6A225B31431FD2_2DBFE83038D8E23E_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCCC(NC)=O""",21,"""AB41710177954C34"""
-"""27242EC8FDD98365_6833130334BC266D_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCC(NCC)=O""",21,"""AB41710177954C34"""
-"""3FF67F9789D3FDA5_A0BE19882D0B4CE3_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=CC(=NO3)C""",21,"""AB41710177954C34"""
-"""E750E89C5C8EC01D_B9124E7C5FF78A31_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCCCC(N)=O""",21,"""AB41710177954C34"""
-"""EB139B92F8C2DCAB_7EA40ECBCD075FAB_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=C[N](C)N=C3""",21,"""AB41710177954C34"""
-"""0B22B065B0B5995B_97E922F722231B94_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCC3=CC=CS3""",21,"""AB41710177954C34"""
-"""2193BCF3B364776F_33EBB3E1558253ED_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=NON=C3C""",21,"""AB41710177954C34"""
-"""C0E89B7AE7223137_F77D9BA94D7947E5_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCCCCOC""",21,"""AB41710177954C34"""
-"""ECE6E8B7122706CD_AA19E9E903C1937F_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCC[S](F)(=O)=O""",21,"""AB41710177954C34"""
-"""CE4E113C1BFC2F85_0898352735BAFFBC_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCCOCC=C""",21,"""AB41710177954C34"""
-"""D77A9EAF15284357_5F3548EDA0B8B6F6_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCC[S](N)(=O)=O""",21,"""AB41710177954C34"""
-"""E440E861FE462E10_5E8CB8ED2CC8552C_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=NC(=CS3)C""",21,"""AB41710177954C34"""
-"""B9F175CD1AF529A7_67DF02AEA7534000_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCC(C)(C)C#N""",21,"""AB41710177954C34"""
-"""148F02F9F0C6825F_340951EEB2B366F5_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCCSCC#N""",21,"""AB41710177954C34"""
-"""95F81DC612138E73_97B579D660FE3002_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=NC=C(C)O3""",21,"""AB41710177954C34"""
-"""5B8F889A691F8EBE_B045F170A51C6489_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCC[S](Cl)(=O)=O""",21,"""AB41710177954C34"""
-"""1604587C86698A71_9A0D99A08ED6BF70_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCOCC3CC3""",21,"""AB41710177954C34"""
-"""A73B6D430D0ABD67_DB1EE561E4B371FB_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC(=O)C3CCC3""",21,"""AB41710177954C34"""
-"""C2B0F8FDC7ACDB2A_49BA82AF63948D03_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC(CC(C)C)=O""",21,"""AB41710177954C34"""
-"""13ADBE22339A4FE2_671C4681A9BCCD40_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3COCCO3""",21,"""AB41710177954C34"""
-"""38A5757C58FD93E2_619AE7F012859DB0_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCC[S](C)(=O)=O""",21,"""AB41710177954C34"""
-"""1F1445905C1007C8_8F949126260D7E58_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC[N]3N=CC=C3""",21,"""AB41710177954C34"""
-"""2FDA3CC8A92994F6_79176DFF69BD8940_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC(C(CC)C)=O""",21,"""AB41710177954C34"""
-"""A6FED1EEBE8F90E1_ED2D6D1F2ECF4FF1_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCN[S](C)(=O)=O""",21,"""AB41710177954C34"""
-"""EC05070D4DF38696_89B900F4BA37FD94_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC(CCOC)=O""",21,"""AB41710177954C34"""
-"""1DA12424B9C2F939_351BA8B0994F4B8C_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCNC(=O)C=C""",21,"""AB41710177954C34"""
-"""1BF314C785F3CF33_54F2257F88DB68E7_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3COC(=O)O3""",21,"""AB41710177954C34"""
-"""76CBBB2E2B65C5DF_B9ADC391A0C37D99_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=NN=C[N]3C""",21,"""AB41710177954C34"""
-"""EE3C2ED4BB752272_58CF3BAE3B8A7FDF_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCCNC(C)=O""",21,"""AB41710177954C34"""
-"""5526FBC07FDFFAE1_FCCBB44023521D55_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC(NC(N)=O)=O""",21,"""AB41710177954C34"""
-"""B4C152E955EE9B2F_C31EC6884AAC6C35_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3CCOCO3""",21,"""AB41710177954C34"""
-"""A6EAC68AF7C1AFE9_0CD8CB430D1CBDBA_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC[N]3C=NC=C3""",21,"""AB41710177954C34"""
-"""CD19DFFC4B47F6AE_48CC3C68076419FA_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCC(N(C)C)=O""",21,"""AB41710177954C34"""
-"""13B68D8342BBC21A_9CB5265D78E28A0E_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC(=O)N3CCC3""",21,"""AB41710177954C34"""
-"""4BE12CBAE31E56E3_34C9BBF5B9E863FB_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=CN=CC=C3""",21,"""AB41710177954C34"""
-"""23292B60894E4DDB_701523ADACFBE02D_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCC3=NOC(=C3)C""",21,"""AB41710177954C34"""
-"""056E756967E65D45_0A24D83974702039_6039_UN""","""COC2=C(C=C1C=CC=CC1=N2)COCCCCN(C)C""",21,"""AB41710177954C34"""
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-"""950CE0F359A78DEB_EF720C8E74D27385_6039_UN""","""O(CCN=[N]#N)CCCC(NC1=C(C=C(C)C=C1C)C)=O""",21,"""055753B37FA4964D"""
-"""55B1EF434506FBD2_4F4F01D191C42437_6039_UN""","""O(CCN=[N]#N)CC(NCCOC1=C(C)C=CC=C1C)=O""",21,"""055753B37FA4964D"""
-"""2950826FF6B3FE4F_3659B6C8CC7A9F68_6039_UN""","""O(CCN=[N]#N)CC(NCCCOC1=CC=CC(=C1)C)=O""",21,"""055753B37FA4964D"""
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-"""F732624CE1B42FAD_43FB418906789C84_6039_UN""","""O(CCN=[N]#N)CC(=O)NC1=CC=C(C=C1)N2CCCC2""",21,"""055753B37FA4964D"""
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-"""F99C891B8A3AB29E_A18D5EF475C407A9_6039_UN""","""O(CCN=[N]#N)CCCCCCCCCCCCCCC""",21,"""055753B37FA4964D"""
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-"""BF22AE08B480B81D_799593DB5FACD728_6039_UN""","""O(CCN=[N]#N)CCCOC1=CC(=C(C=C1C)CC=C)C""",21,"""055753B37FA4964D"""
-"""437460E7CD3578D4_BA940D3458B74586_6039_UN""","""O(CCN=[N]#N)CC1=CSC(=N1)C3=CC2=C(C=CC=C2)O3""",21,"""055753B37FA4964D"""
-"""38F316D7F2582707_A6DF9AD9558721D5_6039_UN""","""O(CCN=[N]#N)CC(NNC(CC1=C(F)C=CC=C1)=O)=O""",21,"""055753B37FA4964D"""
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-"""3932220FE9206F53_6251EE85B683E421_6039_UN""","""O(CCCN=[N]#N)CC2=CC=C([N]1N=C(C)C=C1C)C=C2""",21,"""F50619DBD6CBB094"""
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-"""18F8B69729276218_C1616172D8C9E41C_6039_UN""","""O(CCCN=[N]#N)CC1N[S](=O)(=O)N=C2CCCCCN12""",21,"""F50619DBD6CBB094"""
-"""A08953FC91C4965A_E2B7F35CA304BA14_6039_UN""","""O(CCCN=[N]#N)CC1=CSC(=N1)NN=CC2=CC=CS2""",21,"""F50619DBD6CBB094"""
-"""7FFFCCF86CB077E1_0C0027B61C3F795D_6039_UN""","""O(CCCN=[N]#N)CC1=C(C(OCC)=O)C(NC(N1)=O)C""",21,"""F50619DBD6CBB094"""
-"""9C9A2B41B25D1DF0_715C5AA7FA5AC320_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C)C=CC(=C1)C(=O)O)=O""",21,"""F50619DBD6CBB094"""
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-"""2208F8224917B945_6B13C545954D658B_6039_UN""","""O(CCCN=[N]#N)CC(N1C(CC(CC1(C)C)=O)(C)C)=O""",21,"""F50619DBD6CBB094"""
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-"""3D85CD48F6E09C70_B8B25D3820F6BE15_6039_UN""","""O(CCCN=[N]#N)CCC(=O)NC1=CC2=C(C=C1)OCO2""",21,"""F50619DBD6CBB094"""
-"""0A30E40C6EEA78BF_7859DAC7BBD96373_6039_UN""","""O(CCCN=[N]#N)CC(N(CC)CC1=CC(=CC=C1)F)=O""",21,"""F50619DBD6CBB094"""
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-"""F5365C9C271A6B36_D6D5C2CF7B91D8EC_6039_UN""","""O(CCCN=[N]#N)CC1=NC(=NO1)C2=CC(=C(C)C=C2)F""",21,"""F50619DBD6CBB094"""
-"""E62D3CE29699B8F1_970C19FE2B3104E9_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC1CCOC2=C1C=CC=C2""",21,"""F50619DBD6CBB094"""
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-"""DF03C0E5E3626A63_B4E8366F147380A3_6039_UN""","""O(CCCN=[N]#N)CCCN2C(=O)C1=C(C=CC=C1)C2=O""",21,"""F50619DBD6CBB094"""
-"""B7232B34381DB3D8_6F7FE73F3CA758A5_6039_UN""","""O(CCCN=[N]#N)CC1=COC(=N1)C2=CC=C(OC)C=C2""",21,"""F50619DBD6CBB094"""
-"""8839311612DB2D05_ED844F6CBC131C88_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC2=C1C=CC=NC1=CC=C2""",21,"""F50619DBD6CBB094"""
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-"""5284DD7268872AAB_511D772D10EA2E7D_6039_UN""","""O(CCCN=[N]#N)CC(C1=C(C(=C(C)[NH]1)C(OC)=O)C)=O""",21,"""F50619DBD6CBB094"""
-"""2D5B044030D90854_DE5A7A1CBC77B0CF_6039_UN""","""O(CCCN=[N]#N)CC(NCCSC1=CC=C(C)C=C1)=O""",21,"""F50619DBD6CBB094"""
-"""9B3335C8B0BCE7F7_E30368A45BD9CC30_6039_UN""","""O(CCCN=[N]#N)CCCCC[N]1C2=C(N=C1)C=CC=C2""",21,"""F50619DBD6CBB094"""
-"""48472D2A702B06E2_2878DF1811FC2485_6039_UN""","""O(CCCN=[N]#N)CC2=NC1=C(N(C(N(C)C1=O)=O)C)[NH]2""",21,"""F50619DBD6CBB094"""
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-"""CDC5D269BAC426D1_6352774BFB7CEE45_6039_UN""","""O(CCCN=[N]#N)CC(NC(C(C)C)C1=CC=CC=C1)=O""",21,"""F50619DBD6CBB094"""
-"""B8C8ACBBD06025D2_A3B3018F2DE84119_6039_UN""","""O(CCCN=[N]#N)CC2=C(OCC)C=C1CC(OC1=C2)C""",21,"""F50619DBD6CBB094"""
-"""CF51162DBAAF2F21_7927E57FFFBF7316_6039_UN""","""O(CCCN=[N]#N)CC1=CC(=NO1)C2=C(OC)C=CC=C2""",21,"""F50619DBD6CBB094"""
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-"""BCA11E6B25117B81_3EA30A89307310A8_6039_UN""","""O(CCCN=[N]#N)CC(N(CC1=CC=CC(=C1)OC)C)=O""",21,"""F50619DBD6CBB094"""
-"""F3931502F5F49CA7_E0E2AD38821F18D8_6039_UN""","""O(CCCN=[N]#N)CC(N(C)CC1=C(C=C(C=C1)C)C)=O""",21,"""F50619DBD6CBB094"""
-"""136375F7B40EC72C_32206DB5DE53168E_6039_UN""","""O(CCCN=[N]#N)CC(N(CC1=CC=C(CC)C=C1)C)=O""",21,"""F50619DBD6CBB094"""
-"""7F7981496B6D4709_3B260150923021C7_6039_UN""","""O(CCCN=[N]#N)CC(N(CC1=CC=C(OC)C=C1)C)=O""",21,"""F50619DBD6CBB094"""
-"""0452550D0E35811D_8A3FBBD66A21E6FF_6039_UN""","""O(CCCN=[N]#N)CCCC(NC1=C(C)C=CC=C1C)=O""",21,"""F50619DBD6CBB094"""
-"""04DAEFBD715DAEE3_282F502A233B33E0_6039_UN""","""O(CCCN=[N]#N)CC(=O)N(CC1=CC=CC=C1)C2CC2""",21,"""F50619DBD6CBB094"""
-"""00FC03D4EE706DEC_498899CD7A408CD3_6039_UN""","""O(CCCN=[N]#N)CC1=CC=C(O1)[S](=O)(=O)N2CCCC2""",21,"""F50619DBD6CBB094"""
-"""2267CAF27B1A4604_80109CEA013F3942_6039_UN""","""O(CCCN=[N]#N)CCC(NC1=C(C(N)=O)C=CC=C1)=O""",21,"""F50619DBD6CBB094"""
-"""A6A9CDA7F8AD0B07_30AB55A8AA395781_6039_UN""","""O(CCCN=[N]#N)CC1=NC(=NO1)CC(NCCCC)=O""",21,"""F50619DBD6CBB094"""
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-"""896CD16B4E84E643_2755919D54AADE02_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC(=N[N]1C)C(C)(C)C)=O""",21,"""F50619DBD6CBB094"""
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-"""A295FC971F11CC91_D6817D61E2598B83_6039_UN""","""O(CCCN=[N]#N)CC(N(C)C2=NC1=C(C=CC=C1)S2)=O""",21,"""F50619DBD6CBB094"""
-"""4BCD42B4A290FA08_36B54C92075A6EC3_6039_UN""","""O(CCCN=[N]#N)CC(NCC1=CC=CC(=C1)COC)=O""",21,"""F50619DBD6CBB094"""
-"""03615ADC81A2213E_F0AE691E08CBE0B5_6039_UN""","""O(CCCN=[N]#N)CC(NCCOC1CCCCC1C)=O""",21,"""F50619DBD6CBB094"""
-"""CC2E7157B3112A68_D19756B54884C923_6039_UN""","""O(CCCN=[N]#N)CC(=O)NCC2CC1=C(C=CC=C1)O2""",21,"""F50619DBD6CBB094"""
-"""0B805CF43C475357_6596C42BC1B13D6B_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC1(CCC1)C2=CC=CC=C2""",21,"""F50619DBD6CBB094"""
-"""E914E220E0D35387_ADEF38C7CE1AEB80_6039_UN""","""O(CCCN=[N]#N)CC(N1CCC(C)C2CCCCC12)=O""",21,"""F50619DBD6CBB094"""
-"""687CF5B6A2A69CB8_6FE4D23B196F927E_6039_UN""","""O(CCCN=[N]#N)CC(NC(C)C(=O)N1CCCCC1)=O""",21,"""F50619DBD6CBB094"""
-"""5E69EC4B9861AB79_82A658434704FE94_6039_UN""","""O(CCCN=[N]#N)CC(=O)N1CCN(CC1)C(=O)C2CC2""",21,"""F50619DBD6CBB094"""
-"""BFA8C913D0D7BEA6_00B32A2F7049F2F8_6039_UN""","""O(CCCN=[N]#N)CCCOC2=C1C=CC=CC1=CC=C2""",21,"""F50619DBD6CBB094"""
-"""E245F34CFB1351E0_D7336088A8346B2D_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C[N](CC(NC)=O)N=C1)=O""",21,"""F50619DBD6CBB094"""
-"""872E3162EF35CA0D_D0629AD184A82125_6039_UN""","""O(CCCN=[N]#N)CCCC1=NN=N[N]1C2=CC=CC=C2""",21,"""F50619DBD6CBB094"""
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-"""1BB3297A991233D5_08466EF19F715488_6039_UN""","""O(CCCN=[N]#N)CC2=NC=C(C1=CC=C(OC)C=C1)O2""",21,"""F50619DBD6CBB094"""
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-"""78444C2A6073F8A9_7231575660D1110D_6039_UN""","""O(CCCN=[N]#N)CC1=C(C=CC=C1)OC2=CN=CC=C2""",21,"""F50619DBD6CBB094"""
-"""7C8127B1D6C3C886_AF19C1712FAAE8C9_6039_UN""","""O(CCCN=[N]#N)CC1=NN=N[N]1C2=C(C=CC(=C2)C)F""",21,"""F50619DBD6CBB094"""
-"""ED1CDA8D06DB815A_D958ED14AB6502AC_6039_UN""","""O(CCCN=[N]#N)CC(C1=CC=C(N[S](C)(=O)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
-"""D82CCE7FCC19556B_ECA3419C00B631E8_6039_UN""","""O(CCCN=[N]#N)CC1=NC2=C(N(C)C1=O)C=CC(=C2)F""",21,"""F50619DBD6CBB094"""
-"""7055BD63841CB5BA_6BB5B3C84068750F_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C([S](N)(=O)=O)C=CC=C1)=O""",21,"""F50619DBD6CBB094"""
-"""079F6F3CE7792324_5558B773184036D7_6039_UN""","""O(CCCN=[N]#N)CC2=C[N]1C=CC=C(C(OC)=O)C1=N2""",21,"""F50619DBD6CBB094"""
-"""E3638713D3ADD841_D2520EAA2AD4E749_6039_UN""","""O(CCCN=[N]#N)CC1=CC=CC(=C1)C(NCC(C)C)=O""",21,"""F50619DBD6CBB094"""
-"""338418D0F2272231_2317BC8C4DF30AAE_6039_UN""","""O(CCCN=[N]#N)CC(NC1=NN=C(CC(F)(F)F)O1)=O""",21,"""F50619DBD6CBB094"""
-"""2CAB74EFAA4CE758_B67694F4E5BA5AA2_6039_UN""","""O(CCCN=[N]#N)CCCOC1=CC2=C(C=C1)C=CC=C2""",21,"""F50619DBD6CBB094"""
-"""87558A8A5069CA67_8082B6A6123A804D_6039_UN""","""O(CCCN=[N]#N)CCCOC1=CC=CC(=C1)C(C)(C)C""",21,"""F50619DBD6CBB094"""
-"""24EC1003C13EE870_50C129EAF100486F_6039_UN""","""O(CCCN=[N]#N)CC1=CSC(=N1)N(CCOC)C(=O)C""",21,"""F50619DBD6CBB094"""
-"""DCC65CE2F16EAE4E_C5FAEF2C2C6E7FE0_6039_UN""","""O(CCCN=[N]#N)CC2ON=C(C1=C(F)C=CC=C1F)C2""",21,"""F50619DBD6CBB094"""
-"""8753EB35A9D678A9_565A0F7998F183EF_6039_UN""","""O(CCCN=[N]#N)CC(C1=CC=C(OCC(N)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
-"""22459A06E8FE63D2_B6734B0B1317E720_6039_UN""","""O(CCCN=[N]#N)CCC(=O)NCC(=O)C1=CC=CC=C1""",21,"""F50619DBD6CBB094"""
-"""5119C4FA59089F40_8C31BCEB2A6B9B02_6039_UN""","""O(CCCN=[N]#N)CC(C[S](C1=CC=C(C)C=C1)(=O)=O)=O""",21,"""F50619DBD6CBB094"""
-"""F6C1E997871D1DC6_742B87934DAAB7E5_6039_UN""","""O(CCCN=[N]#N)CC(C1=CC=C(CCC(N)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
-"""52486B5DEEE4BC69_02369F8AF0BF14C1_6039_UN""","""O(CCCN=[N]#N)CCOC1=C(C=C(OC)C=C1)[N](=O)=O""",21,"""F50619DBD6CBB094"""
-"""90E0978FADE93179_10E9906EA08F69AB_6039_UN""","""O(CCCN=[N]#N)CC1=NN=C(O1)C2=CC=C(C=C2)C#N""",21,"""F50619DBD6CBB094"""
-"""E0F604B4B5A1F22D_5F2D5DA01A00F41D_6039_UN""","""O(CCCN=[N]#N)CC1=NN=C(O1)C2=CC(=CC=C2)C#N""",21,"""F50619DBD6CBB094"""
-"""A2B7FEB40D603036_0207CC6B3F31621D_6039_UN""","""O(CCCN=[N]#N)CC2=NC=C(C1=CC=CC(=C1)OC)O2""",21,"""F50619DBD6CBB094"""
-"""1BA75DAC77AFFD80_2C5F64860B1E54E9_6039_UN""","""O(CCCN=[N]#N)CC(=O)C1=C[N](N=C1)C2=CC=CC=C2""",21,"""F50619DBD6CBB094"""
-"""F9539B66C9D3A109_8D99AF497E507125_6039_UN""","""O(CCCN=[N]#N)CC2=NC=C(C1=C(OC)C=CC=C1)O2""",21,"""F50619DBD6CBB094"""
-"""3A6E87BF69181FCF_A8BF7B1ADC89F816_6039_UN""","""O(CCCN=[N]#N)CC1CC(=NO1)CCC2=CC=CC=C2""",21,"""F50619DBD6CBB094"""
-"""0485F0CF5BDB9D04_A00714BC82CC0D81_6039_UN""","""O(CCCN=[N]#N)CC1=NC(=NO1)CC2=C(C)C=CC=C2""",21,"""F50619DBD6CBB094"""
-"""F7FAC74ADFC31780_61560EE02F78F8C2_6039_UN""","""O(CCCN=[N]#N)CC1=NOC(=N1)CC2=C(C)C=CC=C2""",21,"""F50619DBD6CBB094"""
-"""7ACFA71E14B4F877_C20F83709FAE82E6_6039_UN""","""O(CCCN=[N]#N)CC(NCC1=C(COC)C=CC=C1)=O""",21,"""F50619DBD6CBB094"""
-"""27E8BC67A9C7C8A2_CBAD9490D714DFB6_6039_UN""","""O(CCCN=[N]#N)CC(C1=C(CC)C(=C([NH]1)C)C(=O)C)=O""",21,"""F50619DBD6CBB094"""
-"""275293D75A91C403_685C8CDB83CB034C_6039_UN""","""O(CCCN=[N]#N)CC(=O)NCCCOC1CCCCC1""",21,"""F50619DBD6CBB094"""
-"""72F588A95931EAC8_8507BBE220FE2196_6039_UN""","""O(CCCN=[N]#N)CCCN1C(CSC1=CC(OC)=O)=O""",21,"""F50619DBD6CBB094"""
-"""B50EE7B88F71D47F_D30D61217156A456_6039_UN""","""O(CCCN=[N]#N)CC2=NN=C(CC1=C(C)C=CC=C1)O2""",21,"""F50619DBD6CBB094"""
-"""64FB1CC4E009BEC7_E94EAE51A580088A_6039_UN""","""O(CCCN=[N]#N)CC1=NC(=NO1)C2=CC(=C(F)C=C2)F""",21,"""F50619DBD6CBB094"""
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-"""47C36CCB39631679_D4E41B89523445A3_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C(C)C)C=CC=C1C)=O""",21,"""F50619DBD6CBB094"""
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-"""906AFC7F58A6664D_E1AE2902CCC6DE11_6039_UN""","""O(CCCN=[N]#N)CC1=NN=N[N]1C2=CC=C(OC)C=C2""",21,"""F50619DBD6CBB094"""
-"""D5436510C065D09A_FA4328503A49A798_6039_UN""","""O(CCCN=[N]#N)CC(C1CCCN1C(C(F)(F)F)=O)=O""",21,"""F50619DBD6CBB094"""
-"""979F886076455793_14BC9E35CA030CED_6039_UN""","""O(CCCN=[N]#N)CC(N(CCC(C)C)CCC(C)C)=O""",21,"""F50619DBD6CBB094"""
-"""2883997A134AEDDB_ED4940FA88598DA2_6039_UN""","""O(CCCN=[N]#N)CCC[S](C1=C(OC)C=CC=C1)(=O)=O""",21,"""F50619DBD6CBB094"""
-"""39240132C9810F86_2C5C3C86EA4675E5_6039_UN""","""O(CCCN=[N]#N)CC(C1=CC=C(C(OCC)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
-"""9FDA3B67CE77740D_0A40ECB1A6DF8B2A_6039_UN""","""O(CCCN=[N]#N)CCN([S](C)(=O)=O)CC1=CC=CC=C1""",21,"""F50619DBD6CBB094"""
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-"""8886EACE3A82FC97_CB4BE34839B85939_6039_UN""","""O(CCCN=[N]#N)CC(=O)CC23CC1CC(CC(C1)C2)C3""",21,"""F50619DBD6CBB094"""
-"""675F9C6D3AEE6681_C8970CD0C2375086_6039_UN""","""O(CCCN=[N]#N)CC(N[S](C1=CC=C(C)C=C1)(=O)=O)=O""",21,"""F50619DBD6CBB094"""
-"""C987C640A378E61C_2070FFECCDC8C9A7_6039_UN""","""O(CCCN=[N]#N)CCC(=O)C1=CC2=C(C=C1)OCCO2""",21,"""F50619DBD6CBB094"""
-"""DD6280ECF6599746_DE7D0C90D27CE60B_6039_UN""","""O(CCCN=[N]#N)CC(CC1=CC=C(OC(C)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
-"""3CF2F9969463990C_66B6CB459EB8943E_6039_UN""","""O(CCCN=[N]#N)CC(C1=CC=C(OCCCC)C=C1)=O""",21,"""F50619DBD6CBB094"""
-"""AB880FAF71B911CA_6BB2367AAF454323_6039_UN""","""O(CCCN=[N]#N)CCC2=C(C)N=C1C=CC=CN1C2=O""",21,"""F50619DBD6CBB094"""
-"""FA6743E97CFC4DD5_CB28AFF13EF4AB2A_6039_UN""","""O(CCCN=[N]#N)CC(N1CCC(C(OCC)=O)CC1)=O""",21,"""F50619DBD6CBB094"""
-"""0FE709388E4A8CD0_22EBCEC86C5F9128_6039_UN""","""O(CCCN=[N]#N)CC1=NOC(=C1)C2=CC=CC(=C2)OC""",21,"""F50619DBD6CBB094"""
-"""1FB62EFC0F358EED_BD481ADB05DE9D8A_6039_UN""","""O(CCCN=[N]#N)CC1=C(C=CC(=C1)[N](=O)=O)C(F)(F)F""",21,"""F50619DBD6CBB094"""
-"""38F9A4540D2508AD_8AC6AB60B0F93CB2_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC1=CC2=C(C=C1)OCCO2""",21,"""F50619DBD6CBB094"""
-"""2A041C6CB831EBDF_F113452BEC422A42_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C)C=CC=C1C(=O)O)=O""",21,"""F50619DBD6CBB094"""
-"""4AA22788040A2CF7_1C0423F144586112_6039_UN""","""O(CCCN=[N]#N)CC1=NC(=NO1)C2=CC(=NC=N2)OC""",21,"""F50619DBD6CBB094"""
-"""670269C83B8D2F9B_0B0DFC2FB9780F89_6039_UN""","""O(CCCN=[N]#N)CC(NC2=NC1=C(C=C(F)C=C1)S2)=O""",21,"""F50619DBD6CBB094"""
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-"""09AE2C50F0E440A5_7D03952A47752010_6039_UN""","""O(CCCN=[N]#N)CC2CN=C(C1=CC=C(OC)C=C1)S2""",21,"""F50619DBD6CBB094"""
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-"""B50B246497090483_8EFAA9B330203012_6039_UN""","""O(CCCN=[N]#N)CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""F50619DBD6CBB094"""
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-"""2E7C947FD77107CB_0988141D3D5A51B1_6039_UN""","""O(CCCN=[N]#N)CC1=NC=CC(=C1C)OCC(F)(F)F""",21,"""F50619DBD6CBB094"""
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-"""47555361ADB61205_839FC44161681961_6039_UN""","""O(CCCN=[N]#N)CC1=NC=C(O1)C2=CC=C(C=C2)C#N""",21,"""F50619DBD6CBB094"""
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-"""37FAD4431C851316_102324056B5BB0A6_6039_UN""","""O(CCCN=[N]#N)CC1=COC(=N1)C2=CC(=C(F)C=C2)F""",21,"""F50619DBD6CBB094"""
-"""9935684E026FCA47_40BE820B15449D22_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C)C=C(C=C1)SC#N)=O""",21,"""F50619DBD6CBB094"""
-"""53263A2AFFA2145B_0076385C989F9FDE_6039_UN""","""O(CCCN=[N]#N)CC#CC1=C[N](N=C1)C2=CC=CC=C2""",21,"""F50619DBD6CBB094"""
-"""322CECAE1A80FEF0_A3D0CB3747D80DED_6039_UN""","""O(CCCN=[N]#N)CC(N1CCN(C(OCC)=O)CC1)=O""",21,"""F50619DBD6CBB094"""
-"""2F4E7BE33876741A_69D241D8C2012EC8_6039_UN""","""O(CCCN=[N]#N)CCOC1=CC=C(OC(F)(F)F)C=C1""",21,"""F50619DBD6CBB094"""
-"""AAB38192DC8314BC_67B5390B36672E31_6039_UN""","""O(CCCN=[N]#N)CC1=CC=CC(=C1)[S](C(F)(F)F)(=O)=O""",21,"""F50619DBD6CBB094"""
-"""8014B57B2A936348_DDCA3A011C4FEB67_6039_UN""","""O(CCCN=[N]#N)CC1=NC(=NO1)C2=NN=C(OC)C=C2""",21,"""F50619DBD6CBB094"""
-"""312C0E01ACF85038_095AC3B797154453_6039_UN""","""O(CCCN=[N]#N)CCC(NC(NCCC(F)(F)F)=O)=O""",21,"""F50619DBD6CBB094"""
-"""45103F112DED2135_1216AF0617BED672_6039_UN""","""O(CCCN=[N]#N)CCCNC(=O)OCC1=CC=CC=C1""",21,"""F50619DBD6CBB094"""
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-"""CA4D8949A293DF39_F464A26253599AE8_6039_UN""","""O(CCCN=[N]#N)CC1=C(C(OC)=O)C=CC=C1[N](=O)=O""",21,"""F50619DBD6CBB094"""
-"""AAA389A5035E21BE_E250031299E6B06D_6039_UN""","""O(CCCN=[N]#N)CC2=CC=C(C1(C(OC)=O)CC1)C=C2""",21,"""F50619DBD6CBB094"""
-"""072D609424450386_569A4BFEA335E9B0_6039_UN""","""O(CCCN=[N]#N)CC1=C2C(=C(C)N=C1)OC(OC2)(C)C""",21,"""F50619DBD6CBB094"""
-"""FE2E2B3A257B2616_541927F21AD371A6_6039_UN""","""O(CCCN=[N]#N)CC2=N[N]1CCCCC1=C2C(OC)=O""",21,"""F50619DBD6CBB094"""
-"""6C9DB6512DBA910C_067828CDD49280B3_6039_UN""","""O(CCCN=[N]#N)CC(C(C1=CC=CC(=C1)OC)=O)(F)F""",21,"""F50619DBD6CBB094"""
-"""AC14F91405A180FB_324DAD71D50D14FE_6039_UN""","""O(CCCN=[N]#N)CC(C(C1=CC=C(OC)C=C1)=O)(F)F""",21,"""F50619DBD6CBB094"""
-"""3D72C6589ACA6DFA_A16C20B02096F9E2_6039_UN""","""O(CCCN=[N]#N)CC1=COC(=N1)C2=CC=CC(=C2)OC""",21,"""F50619DBD6CBB094"""
-"""89D78B2F4E79F5AD_597CA168A37BF439_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C=C(OC)C=C1)OC)=O""",21,"""F50619DBD6CBB094"""
-"""3E776824BD898015_82E9F92BF1BE0622_6039_UN""","""O(CCCN=[N]#N)CCC1=CC=C([S](N(C)C)(=O)=O)C=C1""",21,"""F50619DBD6CBB094"""
-"""D869C1608D0D02DE_F2893E7AA0186626_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC2=C(C=C1)[NH]C(=N2)C)=O""",21,"""F50619DBD6CBB094"""
-"""09445FBA3C81F8E9_24091FB3DDDABDAC_6039_UN""","""O(CCCN=[N]#N)CC(C1=CC=C(C(F)(F)F)C=C1)(F)F""",21,"""F50619DBD6CBB094"""
-"""EC2AFC982B989B36_D1D54A8F10CD4BF3_6039_UN""","""O(CCCN=[N]#N)CC2=NC=C(C1=CC=C(CC)C=C1)O2""",21,"""F50619DBD6CBB094"""
-"""A82310BEEC965A1A_727FE546A8DD7D4B_6039_UN""","""O(CCCN=[N]#N)CC(NCC(C1=C(F)C=CC=C1)=O)=O""",21,"""F50619DBD6CBB094"""
-"""2B7D5066F2EA5E67_E70053D9EBFA1E1A_6039_UN""","""O(CCCN=[N]#N)CC1=C[N]2C(=N1)C=C(C(F)(F)F)C=C2""",21,"""F50619DBD6CBB094"""
-"""6DF25AEC03AC3548_68E5DDF214203198_6039_UN""","""O(CCCN=[N]#N)CC(=O)NNC(=O)CC1=CC=CC=C1""",21,"""F50619DBD6CBB094"""
-"""063811F753917E73_97B9C8A45398E8F9_6039_UN""","""O(CCCN=[N]#N)CC2=CC1=C(C=C(C(OCC)=O)S1)S2""",21,"""F50619DBD6CBB094"""
-"""871685E6962D5249_E3CEF3874BD592DD_6039_UN""","""O(CCCN=[N]#N)CC1=CC=C(C=C1)CC2=CC=CC=C2""",21,"""F50619DBD6CBB094"""
-"""A101F2C730543880_2CD9C996CDD0D2A0_6039_UN""","""O(CCCN=[N]#N)CC(F)(F)C(=O)C1=CC=C(C=C1)C#N""",21,"""F50619DBD6CBB094"""
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-"""88DF747295B569C8_7774AEE818235261_6039_UN""","""O(CCCN=[N]#N)CC(C1=CC=C([S](NC)(=O)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
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-"""F5E640E86A849576_C018BE12BD152888_6039_UN""","""O(CCCN=[N]#N)CCC2=C(C)N=C1CCCCN1C2=O""",21,"""F50619DBD6CBB094"""
-"""B57F6DCBB01A22F9_65B99BACD761C972_6039_UN""","""O(CCCN=[N]#N)CC1=NOC(=N1)C2=C(OC)C=CC=C2""",21,"""F50619DBD6CBB094"""
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-"""E525F91C5EC1A55A_3BD87DA6E44D0065_6039_UN""","""O(CCCN=[N]#N)CC(N1CCCC(C(OCC)=O)C1)=O""",21,"""F50619DBD6CBB094"""
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-"""E61ACB2B6E3B9407_7196B1BA19C6702A_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC2C1CC3CC(C1)CC2C3""",21,"""F50619DBD6CBB094"""
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-"""029A33A15056B5A6_7AED642982F06ED7_6039_UN""","""O(CCCN=[N]#N)CC1=CC(=NC(=N1)C2=CC=CC=C2)C""",21,"""F50619DBD6CBB094"""
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-"""17748E361E355E03_2F08B5804F990129_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCOC2CCCC2""",21,"""081BFB862396070F"""
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-"""8183586D3D45A468_853D4503870D4407_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC2=C(C)N=CS2""",21,"""081BFB862396070F"""
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-"""52431B6C11B925BD_C33F9544803B1F06_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=CN=C(C)C=N2""",21,"""081BFB862396070F"""
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-"""34B8437F72E211B2_31DC90FF0333D197_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCC(OC)OC""",21,"""081BFB862396070F"""
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-"""D6FE874454EB5D63_CA46FE40ECA133F9_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC(NC(N)=O)=O""",21,"""081BFB862396070F"""
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-"""EA3FC103B8AE5F44_2967F07519422017_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)NCCC#N""",21,"""081BFB862396070F"""
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-"""B1E8399019C95DA9_8ED6041179A2E988_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC#C[Si](C)(C)C""",21,"""081BFB862396070F"""
-"""A7A7659C3B894011_CEE219813DE44873_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC2=NC=CN=C2""",21,"""081BFB862396070F"""
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-"""7867EEBA33620DD1_6E170B4DC29E1F1D_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC[N]3N=CC=C3""",21,"""4AC2EB6A93062D71"""
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-"""1907BB9B16AAA9EA_683A9A9F5EA49CD1_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(CCOC)=O""",21,"""4AC2EB6A93062D71"""
-"""CB0E1E893E4D1AF0_D49832DB7DDC2AC9_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCNC(=O)C=C""",21,"""4AC2EB6A93062D71"""
-"""AE5F6437DB5EFD4A_B571BF146C4809A2_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3COC(=O)O3""",21,"""4AC2EB6A93062D71"""
-"""D0CEB4A120CA2539_582E59FA44501CDC_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NN=C[N]3C""",21,"""4AC2EB6A93062D71"""
-"""DF371250CE56F842_B94CA1C5DF191E9A_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCNC(C)=O""",21,"""4AC2EB6A93062D71"""
-"""CB7277B48650FB0B_1D482E2BC7C17C10_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(NC(N)=O)=O""",21,"""4AC2EB6A93062D71"""
-"""AC7524A4BF5B7C0B_229D5CE3AE3F0D70_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3CCOCO3""",21,"""4AC2EB6A93062D71"""
-"""F405079425C3404C_ED5B5128E98FDCFF_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC[N]3C=NC=C3""",21,"""4AC2EB6A93062D71"""
-"""98221A577CC5BA93_A94FA603E3F778BF_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(N(C)C)=O""",21,"""4AC2EB6A93062D71"""
-"""33773DD5F2DCB7B0_7D36BC369C71EB4B_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(=O)N3CCC3""",21,"""4AC2EB6A93062D71"""
-"""32446DD0EB923F3D_D54A219E5D7B02BE_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CN=CC=C3""",21,"""4AC2EB6A93062D71"""
-"""C76ADB58C8E18D04_9196B9C648688168_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NOC(=C3)C""",21,"""4AC2EB6A93062D71"""
-"""E542EEB6A99A94C7_EBA7425290E3417C_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCCN(C)C""",21,"""4AC2EB6A93062D71"""
-"""F57F48EEC7074CDA_C8A583D9ABF7D453_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CN=C[N]3C""",21,"""4AC2EB6A93062D71"""
-"""9B977B0F6CCD338A_3EF89F04BA441DFA_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(=O)CCC=C""",21,"""4AC2EB6A93062D71"""
-"""5B6087C773D262E6_C6CD3BECEF611B9A_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCOCCOC""",21,"""4AC2EB6A93062D71"""
-"""DD8FCB01E74D7EBC_ABC0AE98321526AF_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CC=N[N]3C""",21,"""4AC2EB6A93062D71"""
-"""06E3D1BBBE6D4337_2EAAC5B16553D20F_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NN=C(C)S3""",21,"""4AC2EB6A93062D71"""
-"""812D0F24C031E7B9_2C391D9B6FCE2039_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=C(C)OC=N3""",21,"""4AC2EB6A93062D71"""
-"""F05167ABDE4BA363_917A6DBCB5393BCB_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCSC(C)=O""",21,"""4AC2EB6A93062D71"""
-"""B5114675859A4427_541EE78BE4CD6610_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCSCC(C)C""",21,"""4AC2EB6A93062D71"""
-"""5A29E055B6787AC2_5197EFFE80EBD94D_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=C[N](C)N=N3""",21,"""4AC2EB6A93062D71"""
-"""713D1D15E70A7355_E29185F00220CB69_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(=C)[S](=O)(=O)Cl""",21,"""4AC2EB6A93062D71"""
-"""17530A96817350FA_310859FE0330E1AA_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(=O)NC3CC3""",21,"""4AC2EB6A93062D71"""
-"""37689AAFC3E16485_A9778A989F70B682_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCN3CCCC3""",21,"""4AC2EB6A93062D71"""
-"""530CD3D81AF4C3B3_8B2E997DE799C0C0_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(NC(C)C)=O""",21,"""4AC2EB6A93062D71"""
-"""36D2E99FD96B1FA3_6274EBCCB3B468C1_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCC(CC)=O""",21,"""4AC2EB6A93062D71"""
-"""8A1B9C4119E3E40B_50CC91F3D88ECEA4_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCCC(C)=O""",21,"""4AC2EB6A93062D71"""
-"""F1484DA1919B6089_405C64815124258C_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NC=CC=C3""",21,"""4AC2EB6A93062D71"""
-"""344114A1E67FC605_9509B35486298C8C_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NN=N[N]3C""",21,"""4AC2EB6A93062D71"""
-"""F845A3B9029A6145_7B398B810D6FD699_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC([S](F)(=O)=O)=C""",21,"""4AC2EB6A93062D71"""
-"""A6F84167579BAD81_30E635C51C593A1E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(N(CC)C)=O""",21,"""4AC2EB6A93062D71"""
-"""78D695F523F9B95C_2B9CFF62FC033B26_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCN(CC)CC""",21,"""4AC2EB6A93062D71"""
-"""51063DD6F37B1DBB_646CC469F731B1F4_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=C(C)ON=C3""",21,"""4AC2EB6A93062D71"""
-"""B82E93B2EA8EF0B5_90860852B7635C50_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3=C[NH]N=C3""",21,"""4AC2EB6A93062D71"""
-"""82BF5ABBE361AEF8_05E31F9F09F4911E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCC(C)(C)C""",21,"""4AC2EB6A93062D71"""
-"""005881149FDE27DE_1535C8DF8FF56A09_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3CCCO3""",21,"""4AC2EB6A93062D71"""
-"""E7C95FD0747A1AF2_4D5BC6B32DC7730F_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(O)=O)(F)F""",21,"""4AC2EB6A93062D71"""
-"""F704449C554F5CD6_036B669081FF8BCD_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCOCC(F)F""",21,"""4AC2EB6A93062D71"""
-"""F4B2350D46559CEE_CFFA79119E93343C_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3CCC(C)O3""",21,"""4AC2EB6A93062D71"""
-"""2DDE452C8D8C015F_EE70803A408E9C5F_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(C)(C)C)=O""",21,"""4AC2EB6A93062D71"""
-"""34E78AB355479923_7F0980142200B8C3_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=C[N](C)C=N3""",21,"""4AC2EB6A93062D71"""
-"""270135109576CF22_A16B85EB510D7A99_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NC=CC=N3""",21,"""4AC2EB6A93062D71"""
-"""87014E68570F0B5D_29C0DBF081769278_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(=O)CC3CC3""",21,"""4AC2EB6A93062D71"""
-"""1EFFE94F1A9F370D_BD7BB9B96014251E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCCCC=C""",21,"""4AC2EB6A93062D71"""
-"""F343424FFAC2354D_AD26829FD8BCBEF2_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=N[N](C)N=N3""",21,"""4AC2EB6A93062D71"""
-"""B87B4406A8312F2D_19C72BBD838DC283_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C3(C)CC3)=O""",21,"""4AC2EB6A93062D71"""
-"""2A8559897B322A9C_B7ED5833FBA621F2_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3CNC(=O)O3""",21,"""4AC2EB6A93062D71"""
-"""1F974B126D29411C_916BD1D027363200_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCSC(C)(C)C""",21,"""4AC2EB6A93062D71"""
-"""2CFB4E612A06CBF4_C9B0A3411452AE67_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCOC(C)C#N""",21,"""4AC2EB6A93062D71"""
-"""8C9298FA02AF65E1_F350EBA7FB449558_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3=CSC=N3""",21,"""4AC2EB6A93062D71"""
-"""E6F4D26DF2C72BED_03108FFD788FCA3F_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=N[N](C)C=C3""",21,"""4AC2EB6A93062D71"""
-"""425A75314029210F_7CEDF701C746114A_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CN=N[N]3C""",21,"""4AC2EB6A93062D71"""
-"""A86E1B151A3F32E7_2A8FFFA37F1773D9_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCOC3CCC3""",21,"""4AC2EB6A93062D71"""
-"""759163BB0FF962E3_F0790133A14A95C8_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=N[N](C)N=C3""",21,"""4AC2EB6A93062D71"""
-"""FC1DE5BB5A78E668_60AAEC55ABDB662A_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(OCC)=N""",21,"""4AC2EB6A93062D71"""
-"""924AA7DAD9D053CC_537BA735E059A0FB_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCCCCN""",21,"""4AC2EB6A93062D71"""
-"""1CE0B915C53285BD_12A5613FD3066817_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=C(C)N=CS3""",21,"""4AC2EB6A93062D71"""
-"""7FE94FEE4C082EE9_514ADC29DA0626D7_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3=C[NH]N=N3""",21,"""4AC2EB6A93062D71"""
-"""F37D1C37A6B6B4E5_540D38C6AF69F814_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCOCCC#N""",21,"""4AC2EB6A93062D71"""
-"""C762BFF0DF20DC95_F6B035FCE37454E6_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=COC(=N3)C""",21,"""4AC2EB6A93062D71"""
-"""166322ABDD870D53_2EDA4ABAFC72678A_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(=O)NCC=C""",21,"""4AC2EB6A93062D71"""
-"""F78F1165A34BD836_A5E33C82D3DCD309_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CON=C3C""",21,"""4AC2EB6A93062D71"""
-"""27E05D7C6BB0F8E4_7487433463245D1F_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CN=CN=C3""",21,"""4AC2EB6A93062D71"""
-"""86B1604249765737_D7C687A42EEFB16A_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(NCCC)=O""",21,"""4AC2EB6A93062D71"""
-"""A19B848DFDD2D0F6_0F154C0492D12271_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(=C(F)F)F""",21,"""4AC2EB6A93062D71"""
-"""1B78F9D49B1ACCD6_6249FC4ACF80AF5F_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC[S](CC)(=O)=O""",21,"""4AC2EB6A93062D71"""
-"""FD8E2D737A896534_06FF79F2D0F5CF88_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NC=N[N]3C""",21,"""4AC2EB6A93062D71"""
-"""3146D783D6DA4D6C_0A9EDFC28F285560_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C=NO)=NO""",21,"""4AC2EB6A93062D71"""
-"""604D3C59A292E0C7_03BE257D414EAE36_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3CCOC3""",21,"""4AC2EB6A93062D71"""
-"""83812958D65A7C11_3209E25CB791E26A_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3N(C)CCC3""",21,"""4AC2EB6A93062D71"""
-"""F2AF7E2946113966_D07764E67466EB53_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3=CON=C3""",21,"""4AC2EB6A93062D71"""
-"""C8E7E60FEF561BA6_FF81750E9EB536C2_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3CCC(=O)O3""",21,"""4AC2EB6A93062D71"""
-"""DF41763D6295F087_C9F85BD15D182ECA_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(COCC)=O""",21,"""4AC2EB6A93062D71"""
-"""B2740F70FC413468_7B4493690E81E3C6_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NNC(=O)S3""",21,"""4AC2EB6A93062D71"""
-"""C405DF80BDFAC760_683D649CD45C4A99_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(OC)(C)C""",21,"""4AC2EB6A93062D71"""
-"""AD21B6D4B6CC3513_C214BA4757C1B2A5_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC=CCCC""",21,"""4AC2EB6A93062D71"""
-"""AA0113E9ED455A55_8F828099883E552D_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCOC(C)C""",21,"""4AC2EB6A93062D71"""
-"""B7B52CC0A6F64697_6B8FC8207AD6655E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3CCCC3""",21,"""4AC2EB6A93062D71"""
-"""69FC9DE33C7CF03D_961BD65792716FC8_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3OCCO3""",21,"""4AC2EB6A93062D71"""
-"""269CD0ED25CE4B10_37940150EC872998_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCN(CC)C""",21,"""4AC2EB6A93062D71"""
-"""FCED2E98BD5BD975_01E3FA654109FC69_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CSC(=C3)C""",21,"""4AC2EB6A93062D71"""
-"""60C1BEEB6AE79707_B2D37FFFC1ACA923_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3=CN=CS3""",21,"""4AC2EB6A93062D71"""
-"""1FF5D86CFCBD4023_6725304649FCE1B0_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3=NN=N[NH]3""",21,"""4AC2EB6A93062D71"""
-"""4751FF13C2310F9E_4B2BA87C879E5363_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NC=C(C)S3""",21,"""4AC2EB6A93062D71"""
-"""4ADA336FA18B4FE8_9E92C55D630EE148_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(C)=O)=NO""",21,"""4AC2EB6A93062D71"""
-"""0EB24E8BFB194E17_5E31CA391A525F72_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(CC)(C)C""",21,"""4AC2EB6A93062D71"""
-"""C8A863983F5F77A9_620840ED2098640D_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3CC3(Cl)Cl""",21,"""4AC2EB6A93062D71"""
-"""B2C6A267D9F7A287_7652F54DF6554CE1_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C)NC(=O)C""",21,"""4AC2EB6A93062D71"""
-"""F7C6EF3A0E6D3036_D1FD1696EAF7BA14_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(OC)C(C)C""",21,"""4AC2EB6A93062D71"""
-"""A59B26A405763A12_3F8096B5258A98FB_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(OC)C3CC3""",21,"""4AC2EB6A93062D71"""
-"""EFCBF97CD830D5AB_16DF08EBBF68BACC_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)C[C@@H]3N(C)CCC3""",21,"""4AC2EB6A93062D71"""
-"""496A7364038F75C3_1168EC2C6DF97DA2_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(CC(O)=O)=O""",21,"""4AC2EB6A93062D71"""
-"""4C329A6E1537CE74_00739BC33DACE543_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(OC)OC""",21,"""4AC2EB6A93062D71"""
-"""5C49C8E1080F5433_8DA290AD1FD83C11_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCN(C)CC=C""",21,"""4AC2EB6A93062D71"""
-"""4E90B7877139ABB1_B9B114E78A84C1A4_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)C[C@@H]3CCC(=O)N3""",21,"""4AC2EB6A93062D71"""
-"""0EB7D93C68CD3248_D03261C8E3312B1B_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCC3CCC3""",21,"""4AC2EB6A93062D71"""
-"""916858F09F19EE7E_74E95FED1C936084_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3SCCS3""",21,"""4AC2EB6A93062D71"""
-"""2FB7947B1091FB6D_C7386E2EC687E52A_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCCN=[N]#N""",21,"""4AC2EB6A93062D71"""
-"""A831BCED9B812AB2_F62E9D819345644E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(COC)OC""",21,"""4AC2EB6A93062D71"""
-"""80749C79C6F8E655_DFFD0C2E41A9D5C9_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(C)C(=O)C""",21,"""4AC2EB6A93062D71"""
-"""24957755C3A83B03_63280513CDE4956E_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3OCCNC3""",21,"""4AC2EB6A93062D71"""
-"""DBC0E2F15F22E674_33E762F7C1FBC537_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=C[NH]C(=N3)C""",21,"""4AC2EB6A93062D71"""
-"""279DF41F54FD9EBE_9A96BD4682285A3D_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCCCC#C""",21,"""4AC2EB6A93062D71"""
-"""B2816E784223EE6C_0A80B1CE6C2E5A3D_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=C(C)C=CS3""",21,"""4AC2EB6A93062D71"""
-"""8C5B79FA83FD8EF4_72DFF5F0FB3B98AE_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(CCCC)=O""",21,"""4AC2EB6A93062D71"""
-"""1E0B06DD4C298B24_F14578D5C6557790_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(CC(C)C)N""",21,"""4AC2EB6A93062D71"""
-"""B8C4D56C0837C8B3_82D9E267FC69018E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC[N]3C=NN=N3""",21,"""4AC2EB6A93062D71"""
-"""7371B1DF70BD7400_B3A143649BADA369_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCSC(F)(F)F""",21,"""4AC2EB6A93062D71"""
-"""F10C42A003907F54_E3919756B1BEA108_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CC(=NS3)C""",21,"""4AC2EB6A93062D71"""
-"""F60C9A64D8D47708_C1109111D6BB652D_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=N[NH]C=C3C""",21,"""4AC2EB6A93062D71"""
-"""711D79B2D84EFD00_B3B1512BB1817BD4_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NOC=C3C""",21,"""4AC2EB6A93062D71"""
-"""6A597222870A1091_E450AD1732623AC0_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3ON=C(C)C3""",21,"""4AC2EB6A93062D71"""
-"""F27CFEF19E5815C1_07EB066854358B59_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(F)(F)F)=O""",21,"""4AC2EB6A93062D71"""
-"""0F2B775D4B1602DF_CC0F2135D58500E7_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCC(C)(F)F""",21,"""4AC2EB6A93062D71"""
-"""0D7693CE8A0A214E_ABE31E74F3E74E32_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C3CC3C)=O""",21,"""4AC2EB6A93062D71"""
-"""63D5BAFDEB263397_1EBE305F64A09991_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3=CC=NS3""",21,"""4AC2EB6A93062D71"""
-"""7FEB68DAFA9B1CF6_529F7EF2AB96106B_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3CCCCO3""",21,"""4AC2EB6A93062D71"""
-"""38B3C2633CF22FD1_16A8DBF892B0D569_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC[S](=O)(=O)Cl""",21,"""4AC2EB6A93062D71"""
-"""5A38D08A7BA5910A_3D7A7053C5CDA253_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCNC3CC3""",21,"""4AC2EB6A93062D71"""
-"""C9438AA31325FA0A_FB19B21B13C9B6BC_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(NCCN)=O""",21,"""4AC2EB6A93062D71"""
-"""BC4B50277F5262EE_57B0FACA40931E20_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCC3(C)CC3""",21,"""4AC2EB6A93062D71"""
-"""035E1E4E49B4AD08_56E46F36E1754009_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC=C(COC)C""",21,"""4AC2EB6A93062D71"""
-"""AAAE347CF314DB81_178918A308BBA2EA_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCCC3CC3""",21,"""4AC2EB6A93062D71"""
-"""3D41527C7E930678_284BF4E999AF4A5B_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(C)(C)F)=O""",21,"""4AC2EB6A93062D71"""
-"""DD40EC4C0C3615DB_A039317C57AA95F5_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCOCC(O)=O""",21,"""4AC2EB6A93062D71"""
-"""DCF0CBCCE35DF7AA_118831C2197DE457_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC[S](O)(=O)=O""",21,"""4AC2EB6A93062D71"""
-"""CDD372858B907CFE_4DF8AE0038BC965D_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NC(=C[NH]3)C""",21,"""4AC2EB6A93062D71"""
-"""FA211A73CB13C49F_54993D5C0EA727C4_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NOC(=N3)C""",21,"""4AC2EB6A93062D71"""
-"""36EB29BFF6F1E0BC_BC3EBD1D77466A23_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CN=C(C)S3""",21,"""4AC2EB6A93062D71"""
-"""D59DDAF51A2AB9A4_4BA1EBCC978C9D1E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NC(=O)NN3""",21,"""4AC2EB6A93062D71"""
-"""F1EDAF476A94E1FB_131FE308357A277C_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC[N]3N=CN=C3""",21,"""4AC2EB6A93062D71"""
-"""A0BD919EEFE215F5_E5F9C925D79350CC_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(NC(C)=O)=O""",21,"""4AC2EB6A93062D71"""
-"""25302EAABB243EB9_3B5A539DB7FCFD08_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC#CC(OC)=O""",21,"""4AC2EB6A93062D71"""
-"""778CB44016730839_508717C9E001A04F_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCC(OC)=N""",21,"""4AC2EB6A93062D71"""
-"""6F7AB88A7299BAFB_774D005D1F2BBBCF_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCOC3COC3""",21,"""4AC2EB6A93062D71"""
-"""A36A73043E0F5BA8_466B5F44D24D3D2F_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(C)C)ON""",21,"""4AC2EB6A93062D71"""
-"""D5C71C46C154A373_833B7DDBAC8C045C_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(OC)=O)=C""",21,"""4AC2EB6A93062D71"""
-"""3F153D499042356B_F4FDEF63F76D167E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC[N]3C=CN=N3""",21,"""4AC2EB6A93062D71"""
-"""B5BCE2D978FCF2BE_76D33B1ACC337AD7_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(C(C)=O)F""",21,"""4AC2EB6A93062D71"""
-"""3B22C403EFC6DF03_C22A4AB23083FFB1_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)C[C@H]3OCC[C@H]3C""",21,"""4AC2EB6A93062D71"""
-"""17FAFA58931312C9_AC142D8E79410F4E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(CC)(F)F""",21,"""4AC2EB6A93062D71"""
-"""6EB7AC2190153B85_0435DEE7828C6E97_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CN=C(C)O3""",21,"""4AC2EB6A93062D71"""
-"""3FF201D88D95D8F6_B2BE76C374B97E10_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(C)(F)F)=O""",21,"""4AC2EB6A93062D71"""
-"""262FCC19D2477607_4A37CF2E7D65F76B_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(C)=O)(F)F""",21,"""4AC2EB6A93062D71"""
-"""31A369456C7EE86C_FEE1588F4ED6FB03_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3CC3(C)C""",21,"""4AC2EB6A93062D71"""
-"""2E249C0E747EC4CE_2496B3FFA0E2E601_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)C[C@H](COC)OC""",21,"""4AC2EB6A93062D71"""
-"""4309C00FA21F8B2B_E60BCC4EE83652E0_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCC3CC3C""",21,"""4AC2EB6A93062D71"""
-"""392AD5D78366CFB0_C14BC100ED067228_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=CC(=N[NH]3)C""",21,"""4AC2EB6A93062D71"""
-"""6103C7C57058CC27_E6DCAB0085EA5DDC_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)C[C@@H](C(OC)=O)N""",21,"""4AC2EB6A93062D71"""
-"""E87097963BD2F044_5FE8195606C9F2C4_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCOC(F)F""",21,"""4AC2EB6A93062D71"""
-"""8189D69973D789D7_244DE88521FDAB4C_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCCCCO""",21,"""4AC2EB6A93062D71"""
-"""D1E43C14CAB015A5_DA94E0AEBFF6A25F_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NC(=NS3)C""",21,"""4AC2EB6A93062D71"""
-"""1906B05625C39A08_B1CAAA742780C411_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NN=CC=C3""",21,"""4AC2EB6A93062D71"""
-"""AD6B3E0EC109F803_0882AE26027F4A31_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3(CC3)C#N""",21,"""4AC2EB6A93062D71"""
-"""D8F6DA454BBD6C75_980AE5676ED6A41E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCO[Si](C)(C)C""",21,"""4AC2EB6A93062D71"""
-"""CC0FB0F394B528E4_C0C9C914C824791A_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(C)C(F)F""",21,"""4AC2EB6A93062D71"""
-"""1382C5BC6278A3A2_2DBA626CAC8F6E27_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3CN(C)C3""",21,"""4AC2EB6A93062D71"""
-"""72FED7D4F4BCD89C_39D7A778C2FE4954_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCOCCC=C""",21,"""4AC2EB6A93062D71"""
-"""C4710E38C974399B_8CE415F9FDC56B8C_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(SC)C(=O)O""",21,"""4AC2EB6A93062D71"""
-"""635D679FDE37E638_7B1FF2E698BE7855_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC=C(C)C(=O)O""",21,"""4AC2EB6A93062D71"""
-"""9CEC7A0B5C6B13CD_BEE0DABADDAA147F_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCOCC3CO3""",21,"""4AC2EB6A93062D71"""
-"""596AE61DE87F4F83_2D79FDE435B4C807_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NC=NC=C3""",21,"""4AC2EB6A93062D71"""
-"""CB3A268B4DAE7CDE_0A01A73F52E96A25_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NOC(C)C3""",21,"""4AC2EB6A93062D71"""
-"""64976234E759349A_3061C458EACA80F7_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NOC(=N3)O""",21,"""4AC2EB6A93062D71"""
-"""8894C05421C3AA14_9C7BDEBF405A8B7E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NC=CN=C3""",21,"""4AC2EB6A93062D71"""
-"""D307BC8B37D53A5F_D8DE82A6E74407C5_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C3(N)CC3)=O""",21,"""4AC2EB6A93062D71"""
-"""6A9A2A29CBEE0018_43E216DB7339F25E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC[Si](Cl)(Cl)Cl""",21,"""4AC2EB6A93062D71"""
-"""A1313E50B0530482_3F52F1C8B3B4ACFB_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC#CCSC#N""",21,"""4AC2EB6A93062D71"""
-"""F1EDAF476A94E1FB_763171938B3CFDDF_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC[N]3C=NC=N3""",21,"""4AC2EB6A93062D71"""
-"""4E2D43AE869D9FE7_F4BF690CE72281EC_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCCC(F)(F)F""",21,"""4AC2EB6A93062D71"""
-"""BDEFFE9B10D36075_F10F302F33957822_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C3CNC3)=O""",21,"""4AC2EB6A93062D71"""
-"""BC22F47285D2B516_1BB995D7C41CB800_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3OCCC3F""",21,"""4AC2EB6A93062D71"""
-"""1C2136B188253AA0_3FE5BF6A3EF18AA6_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=C(C)N=NS3""",21,"""4AC2EB6A93062D71"""
-"""0A5A2632B3DF36D6_30E76CACB77C0EC2_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=NC(=N[NH]3)C""",21,"""4AC2EB6A93062D71"""
-"""EBFD3FCC77F97551_3BA121E8920F55E9_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCOCC(C)C""",21,"""4AC2EB6A93062D71"""
-"""829D4A8C190B80D1_E13B49D527909F36_6039_DP""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC3CCNC3""",21,"""4AC2EB6A93062D71"""
-"""AC87646A3978520B_DE6B466FDAA533D3_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=C(C)[NH]C=N3""",21,"""4AC2EB6A93062D71"""
-"""84B4D2F1CF6A2842_91440B0F435FED18_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCN(CC)C#N""",21,"""4AC2EB6A93062D71"""
-"""2C674690E59A76ED_425FE6023C569DD5_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC(=C(C)C)C""",21,"""4AC2EB6A93062D71"""
-"""A6FC898E35FE1DAD_CADE524A5A2943EA_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3=C(C)N=CO3""",21,"""4AC2EB6A93062D71"""
-"""2B5700ACD25CDB51_506949725A537D4E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC[S](=O)(=O)C=C""",21,"""4AC2EB6A93062D71"""
-"""40DE62FA59878493_0061D77DD5B8191E_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(F)F)(F)F""",21,"""4AC2EB6A93062D71"""
-"""2ACCAB43ACAF27D2_0A7C3CF5D236EEB8_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC[S](NC)(=O)=O""",21,"""4AC2EB6A93062D71"""
-"""597C585643F14474_70FDF323BCAEA9D9_6039_DP""","""N2CCC(OCC(NC(C1=CC=C[N]1C)=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""5053F21438FDE3BC_40D0865322EDAD4B_6039_DP""","""N2CCC(OCC(C1=CC(=C(OC)C=C1)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""947F62040A504677_C0267A4477E1989A_6039_DP""","""N2CCC(OCC(N1CCCC(C(N)=O)C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C83F6979B51E65F5_E327CAC9F7E5BE94_6039_DP""","""N3CCC(OCC1CN=C(O1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""98CF39803962C490_E023F66BEB17A59C_6039_DP""","""N1CCC(OCCCCCCCCCCCC)C12CCC2""",21,"""20C70AFE40B0D0A8"""
-"""72241DCD6A4F6214_67A9C829C140F3B7_6039_DP""","""N2CCC(OCC(N1CCC(C(N)=O)CC1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""6281584FC853B5CE_8E9C6E2605FC1BE1_6039_DP""","""N3CCC(OCCCC2=NC1=C(C=CC=C1)O2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""8F534475DB452444_8DA006254C00BF5A_6039_DP""","""N2CCC(OCC(C1=CC(=C(C)C=C1C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""163F5F6A5711E77D_A3DA6F5E51DC8F51_6039_DP""","""N2CCC(OCC(NC1=C(C=C(C)C=C1)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""4B04DA15D1E77B60_7C388180A44790F5_6039_DP""","""N2CCC(OCC(C1=CC=C(OCC)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""40203E17AEC166FB_B996DF331904C7FB_6039_DP""","""N2CCC(OCCOC1=CC=C(OCC)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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-"""8C029095B85695F6_237ED0ED071A7E33_6039_DP""","""N3CCC(OCC2=NC1=CC(=C(C=C1[NH]2)F)F)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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-"""033CF77171C72AB1_FB2B36C2BD4CFD94_6039_DP""","""N3CCC(OCC1=N[N](C=C1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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-"""57B19885DC19E1CD_EDBACD8977305EC6_6039_DP""","""N1CCC(OCC(NCCOCCC(C)C)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
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-"""1C5B4144F1A1FDD9_0AA3BC6535DC0462_6039_DP""","""N2CCC(OCC(NCC1=C(ON=C1C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""0F7198AFB1B7B6E1_65DDF4B57FD5005C_6039_DP""","""N2CCC(OCC(C1=CC(=CO1)C(OC)=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""0A121F6F9A10D69B_83B277F4E6B39A6C_6039_DP""","""N3CCC(OCC2=NN=C(C1=C(C)C=CO1)O2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""04D71C5403669329_C176882CA1FB266A_6039_DP""","""N3CCC(OCC1=CN=C(C=C1)[N]2C=NC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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-"""3019DF475636210E_1CD9139F0B9C0A6D_6039_DP""","""N3CCC(OCC1=C(C)OC(=N1)C2=CSC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""A9B5B57E48223146_AFFE3F70EF7E80B8_6039_DP""","""N3CCC(OCCC1=CC2=C(C=C1)C=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""F003841795A8860D_8A266665F928A4B5_6039_DP""","""N3CCC(OCC1SC(=NC1)N2CCOCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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-"""347423C7CA511F49_8814BFBC9449E58E_6039_DP""","""N2CCC(OCCCOC1=CC=C(C=C1)C#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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-"""4F41BA289DA82461_92FBE5B748E61C8A_6039_DP""","""N3CCC(OCC1=CC(=NC2=C1C=CC=C2)C)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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-"""3247C6CFD38CC70C_BF23064A8847962D_6039_DP""","""N2CCC(OCC(C1=CC(=C(C)C=C1F)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""054C13950812F44A_D4E09EE385E38618_6039_DP""","""N2CCC(OCC(=O)N1CCN(CC1)CC#C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""74FF64A53286B0FE_69EAE5BD80FD448E_6039_DP""","""N2CCC(OCCN[S](C1=C[N](C)N=C1)(=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""05F8D98445E88FE6_CCEAB97F5BE65805_6039_DP""","""N2CCC(OCCC=CC1=CC=CC(=C1)OC)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""15E6B413A709E24F_D4B17674FE56FFED_6039_DP""","""N2CCC(OCC1=C(C=CC(=C1)OC)[N](=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""D6C2076EF6233F06_8922DCC666D77FE0_6039_DP""","""N2CCC(OCCOCC1=CC=C(OC)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""96AC40E7B88798B1_C7454752C505A98F_6039_DP""","""N3CCC(OCC1=C(C)OC(=N1)C2=CC=CO2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""761E3E2F32083C47_9B13553B6F62BB97_6039_DP""","""N2CCC(OCCOC1=CC=C(C=C1)CC#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""8B1AD6F8A9333826_184BA88026B44DA9_6039_DP""","""N2CCC(OCC(C1=CC(=C(C(=C1)C)F)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""7627A0566AA00CE9_85E90F8CF1C26001_6039_DP""","""N3CCC(OCC1=NOC(=N1)C2=C(C)N=CS2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""7A41C06AA363B1B5_A867AC3E4695F30D_6039_DP""","""N2CCC(OCC1=CC(=C(C(OC)=O)C=C1)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""6FE6BEA0F6D55802_55E8EFD0E23178EE_6039_DP""","""N3CCC(OCCN1C2=C(CCC1)C=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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-"""33773234C49E47E0_A8D4A81F9F8DBDB5_6039_DP""","""N2CCC(OCCC(C1=CC=C(OC)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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-"""C2C61A1A7FF74AA8_13E74AB627CC2CEC_6039_DP""","""N3CCC(OCC1=COC(=N1)C2=CC=NC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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-"""F9E6B94CF5C3BF80_5BE58F8B57BFBF2A_6039_DP""","""N2CCC(OCC(N1CC(C)OC(C1)(C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""983F818DA906C9E1_EB03F357046D0B16_6039_DP""","""N2CCC(OCC(C1=CC=CC(=C1)[N](=O)=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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-"""3DD39010CDD9C011_A4BF49126AC145F0_6039_DP""","""N2CCC(OCC(NC1=C(C)C=CC=C1C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""76F45DA9D652D8C0_B9374869C61299FC_6039_DP""","""N2CCC(OCC1=C(C(=C(C)C(=C1C)C)C)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""8419B98BF6B04856_15EEA0DB4F29E256_6039_DP""","""N2CCC(OCC1=C(OC)C=CC(=C1)C(=O)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""DFB1E9F95977FFFF_FBF0B2E1FDC7E277_6039_DP""","""N2CCC(OCC(=O)NC1=C(C=CC=C1)C#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""70CB9608A0D47DDD_7057C60DB6D4567E_6039_DP""","""N2CCC(OCC(NC1=CC=C(CC)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""16404F60A5239AA1_B5DC80AED8E8C09F_6039_DP""","""N2CCC(OCC(N(CC)C1CCCCC1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""A8926EB48BEED800_0157C2789F92B995_6039_DP""","""N2CCC(OCC(N(CC)C1=CC=CC=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C1CD86BCAF867469_F8EA14766E404CF5_6039_DP""","""N2CCC(OCC(N1CCC(C(O)=O)CC1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""644B48D383EF122A_CF227BDDCBD2A12E_6039_DP""","""N4CCC(OCCC2C1CC3CC(C1)CC2C3)C45CCC5""",21,"""20C70AFE40B0D0A8"""
-"""9EA1357E63E32182_7C4E19A0780DAD25_6039_DP""","""N3CCC(OCCOC1=CC2=C(C=C1)OCO2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""4F950D50CE3736EA_C7E14952DAD094D5_6039_DP""","""N2CCC(OCCC1=CC=CC(=C1)C(F)(F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""EAC2E787278900A8_534DB8EC36C6AFC0_6039_DP""","""N2CCC(OCCC1=CC=C(C(F)(F)F)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""12FA3C0CDC1239E5_5CE545DCE5A743C9_6039_DP""","""N3CCC(OCC2=NC1=C(C=CC(=C1)OC)[NH]2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""E770C83508190A63_9E0B0DC84ACB365F_6039_DP""","""N3CCC(OCC1OC(CC12CCNCC2)=O)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""0FCB4F6B7815D9B4_BDAC6E7506F5716C_6039_DP""","""N3CCC(OCC1OC(=O)CC12CCOCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""E8DC43E3DFA1A4B7_353729E69BD5CC27_6039_DP""","""N2CCC(OCC(=O)NC1=CC=C(C=C1)C#C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""E6C293FF650DE23A_498A76552497E019_6039_DP""","""N2CCC(OCC1=C(C)C=CC(=C1)[S](=O)(=O)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C6A3B301BE5D34AC_EB981EADC54B8879_6039_DP""","""N2CCC(OCCCCCCCCCC1CC1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""329E7154585315EB_643E587BF8B61CB7_6039_DP""","""N2CCC(OCC1=C(C)C=CC(=C1)[S](=O)(=O)Cl)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""F62BCC1E02CC14D2_7D30F61A61FC8936_6039_DP""","""N3CCC(OCC2CCC1(CCCCCC1)O2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""498E9BA49A0617F9_4AF8534BBF77D107_6039_DP""","""N2CCC(OCC(=O)CCCC1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""13FAAAFE7A2E6347_DF031360344FCA57_6039_DP""","""N2CCC(OCC1=CC(=C(OC)C=C1)C(=O)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""98FF946750D2EF50_5A153E37D860D31F_6039_DP""","""N2CCC(OC[C@@H]1CCC[C@@H](C(OCC)=O)O1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""075295EB9550E6D9_7B476003F7E206F8_6039_DP""","""N3CCC(OCC2CCC1(CCNCC1)CO2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""2AE204289F89ECC8_BF29D1B70183575F_6039_DP""","""N3CCC(OCC1=N[N](C=C1)C2CCCCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""816BBB0AC1745BC5_FB05D51F38CEF996_6039_DP""","""N2CCC(OCC1=CSC(=N1)COCC(F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""63ADBB0EB76C19EB_17A146465B597F30_6039_DP""","""N2CCC(OCC(C1=CSC(=N1)C(C)(C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C4BFFD9AD03F87B1_57B3175A8961E55E_6039_DP""","""N3CCC(OCC2CC1(CCOCC1)C(=O)N2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""A3A09DCF91A66E5B_F2D8907EC8CB1BD7_6039_DP""","""N2CCC(OCC(=O)NC(=O)C1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""D1834EB23701D598_994383CDDF3A9E4D_6039_DP""","""N2CCC(OCC(=O)NCCC[N]1C=CC=N1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""50156C24F2A837E9_5201C38164C58FC4_6039_DP""","""N2CCC(OCC1=CC(=C(C=C1)[N](=O)=O)OC)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""E04EF4DF00FAD016_C67A612833B15D88_6039_DP""","""N2CCC(OCC1=CC=C(N[S](C)(=O)=O)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""78E09E632F3490A4_4D816295009AE87F_6039_DP""","""N3CCC(OCC1=NN=N[N]1C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""9FD9D4E4A6193300_E4597FDBD34DCA76_6039_DP""","""N3CCC(OCC1=NC=C(S1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""D776A91B2CD5C25A_9055E9F477D52D4B_6039_DP""","""N2CCC(OCC(C1=C(OC)C=CC(=C1)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""19C8C53142565D8A_7A1F92496EA29799_6039_DP""","""N3CCC(OCC(=O)N1CCOCC1C2CC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""45007DF40B1FC672_24025496E4662C6E_6039_DP""","""N3CCC(OCC(=O)C2=CC1=C(C=CC=C1)O2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""CDA6E5759443FF17_C2CDCA86BF1A5094_6039_DP""","""N2CCC(OCCOC1=C(C(C)=O)C=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""9077479E7EB89398_A9B47358A002B599_6039_DP""","""N2CCC(OCC=NNC(=O)C1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""B232F058FA59FE08_01BF004224565EBF_6039_DP""","""N2CCC(OCC(NC1=CC=CC(=C1)OC)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""1B13BDA648C53B77_4C1F50D92526B490_6039_DP""","""N2CCC(OCCC(=O)NC1=C(C=CS1)C#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""1B68E921EB4A602F_1EA167EFCDF1E935_6039_DP""","""N1CCC(OCC(N(CCCC)C(C)CC)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
-"""BF8143C954A4E825_DD3B5C0FF560FBEE_6039_DP""","""N1CCC(OCC(NCCCC(OCC)=O)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
-"""1F59B0F6779C240D_D82AED5992909E50_6039_DP""","""N3CCC(OCC1=CC=C(C=C1)[N]2C=NC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""E39E1DEE62131A31_A81FFD6C74D7F316_6039_DP""","""N2CCC(OCC1=CC=C(OC(F)(F)F)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""B6057E81581CCA80_6BC565BDD5B43D47_6039_DP""","""N2CCC(OCCCOC1=C(C=CC(=C1)C)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""0BBB824D337C285A_E6FF137DF13B838C_6039_DP""","""N2CCC(OCC(NCC1=C(C)C=CC=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C528B5A518F760F3_6382C82C672CD3FD_6039_DP""","""N2CCC(OCC1=CC(=C(C(OC)=O)C=C1)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""677DE2DBF8BD8C47_BAA19B892650905A_6039_DP""","""N2CCC(OCC1=N[N](C(=C1[S](=O)(=O)N)C)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""7BFF1873899858E8_635C6F346957FFA5_6039_DP""","""N2CCC(OC[C@@H]1C[C@](OC)(CN1)C(F)(F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""33386365E55F8BE0_9F471E5F2AA2A5C5_6039_DP""","""N2CCC(OCC(NC1=C([N](N=C1C)C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""D50FCFBACC492668_B131EA289B55160F_6039_DP""","""N3CCC(OCC1=NN=C(O1)C2CCOCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""E08F031A45A03183_792CAE9E908B30AB_6039_DP""","""N2CCC(OCCC(C(F)F)N1CCOCC1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""2D289C9530C6BCA1_0AE59CBDED2AEC22_6039_DP""","""N1CCC(OCC(N(CCOC)CCOC)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
-"""DD5AA9727886F780_57E7D957E81434AD_6039_DP""","""N3CCC(OCC1=NOC(=N1)N2CCOCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""FCFF1341B85BFF2C_4291D9B5417C328E_6039_DP""","""N3CCC(OCC1=CC=C(C=C1)C2CCCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""76ED12B0E321C4CB_3663B3A1C1C5215B_6039_DP""","""N3CCC(OCC1=NC(=NS1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""57F7984E45C2CDD3_EB259C19B4ACA968_6039_DP""","""N2CCC(OCC1=CC(=CC(=C1)OC(C)=O)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""7C1116CEAB4FE6C0_5CAD4C3C48548122_6039_DP""","""N3CCC(OCC1=CC(=CC=C1)OCC2CC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""26885879D4AE868C_C2720E0D90912BB4_6039_DP""","""N3CCC(OCC2=NC1=C(CCCC1)C(=O)N2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""5BCBAB2BA7EDE0EC_40D3424480E4E39E_6039_DP""","""N3CCC(OCC(=O)C2=CC1=C(C=CC=C1)[NH]2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""D1D81F910CF0246C_1EC3B6358BD7277F_6039_DP""","""N3CCC(OCC2=NC1=C(CC(C)(CC1)C)S2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""FB2056378F12992D_2F518D97D260A1FE_6039_DP""","""N3CCC(OCC(=O)C1=CN=C2N=CC=C[N]12)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""48056B2139FD6304_26F0EAFDF54CE266_6039_DP""","""N2CCC(OCC(C1=C[N](C)N=C1C(F)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""B07099E175E6E9D4_8D04483AFF6C2C7A_6039_DP""","""N3CCC(OCC(=O)C2=CC1=C(C=CC=C1)S2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""DABE576F495B4700_99E058389D0C5026_6039_DP""","""N3CCC(OCC(=O)C1=CN=C2[N]1C=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""1D4804B200959617_E1F3C49600667F23_6039_DP""","""N3CCC(OCC1=NN=C([N]1C)C2=CC=CS2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""D72729C747C57CE2_D086655C8CD6514E_6039_DP""","""N3CCC(OCC(=O)C1=CC2=C(C=C1)OCO2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""42063EC532BCDFCC_75E70C0A9CA26E1B_6039_DP""","""N2CCC(OCC1=CC(=C(C(OC)=O)N=C1)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""3EBAE1D6C1426930_CB541B5082C937D6_6039_DP""","""N2CCC(OCC(C1=CSC(=C1)C(OC)=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""1C5621F6845F2519_C106006073D545A8_6039_DP""","""N3CCC(OCC1=CC=CC2=C1OC(C)(C)C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""91F7703C8483B3F4_0E6B0D13CC626F54_6039_DP""","""N2CCC(OCC1=CC(=C(C=C1)C)C(OC)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C798C8F3C1B4F538_3E8113A3184490F3_6039_DP""","""N3CCC(OCC1=NC=N[N]1C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""8ECBB72F713B6E81_2D5EB3FD9FA33D17_6039_DP""","""N3CCC(OCC2=NC1=C(C=C(OC)C=C1)S2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""95E0C511AC3F5B95_B8493ED2C47332DC_6039_DP""","""N2CCC(OCCC(C)OCC1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""0486762DBB16D7AA_54A3742D7F8AACBA_6039_DP""","""N3CCC(OCC1=NN=C[N]1C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""12D7F1BDF8040269_1B5072FA2C5AAF3B_6039_DP""","""N2CCC(OCC1=C(OC(F)(F)F)C=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""8AFDE436269FF421_A8ADA1A18CB6B047_6039_DP""","""N2CCC(OCC(C1=CC(=C(C=C1)C#N)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""29A6D51C6867D87D_DC7389BF4D609EFC_6039_DP""","""N2CCC(OCC1=CC=CC(=C1F)C(F)(F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""551A72A9631BADD8_EF509E350ECB05BB_6039_DP""","""N2CCC(OCC1=CC(=CC(=C1)C(F)(F)F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""678D2F294749B775_49F8E7EC1A0EE51E_6039_DP""","""N2CCC(OCC1=C(C=CC(=C1)F)C(F)(F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""43FF035C37EDB5A4_0A8E696293D525BF_6039_DP""","""N2CCC(OCCC1=CC=C(NC(C)=O)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""7362A6098798E227_913373F238E9A1EB_6039_DP""","""N2CCC(OCC1=CC(=C(F)C=C1)C(F)(F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""8AA3BA20FD3C3A58_36D5A30792CEAC6D_6039_DP""","""N2CCC(OCCC1=CC(=C(OC)C=C1)OC)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""FB4475E8D182B527_911CCE5B6642F3B6_6039_DP""","""N2CCC(OCC1=CC=C(O[S](F)(=O)=O)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""BCF3A2A43865A71B_48215E6018341800_6039_DP""","""N2CCC(OCCC1=CC=CC(=C1)NC(C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""55259B0D2342BD27_B591BFBB8B5ECE9F_6039_DP""","""N2CCC(OCC1=C(C)C=C(C=C1)C(F)(F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""E6D7AC57439947FC_84137A42392FA6A7_6039_DP""","""N2CCC(OCCC1=C(C(F)(F)F)C=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C97A00AFE60B767D_B18DA3CAB64677BF_6039_DP""","""N3CCC(OCCC1=C[N](C)C2=C1C=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""B85479911904ECA9_F38739619C1BA98B_6039_DP""","""N1CCC(OCC(=O)NCCCCCN=[N]#N)C12CCC2""",21,"""20C70AFE40B0D0A8"""
-"""78EC78791AB5A233_91416378E6459E54_6039_DP""","""N2CCC(OCCC1CCCC(C(F)(F)F)C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""F5A24895E8A652AB_6EAB895877CBE478_6039_DP""","""N3CCC(OCC1=CC=C(C=C1)C2CC(=O)C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""464567769D992018_DC58560BDDB71530_6039_DP""","""N2CCC(OCC(C1=CSC=C1C(OC)=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""33BBD70D2B29D909_B637CB7CC613E5A1_6039_DP""","""N3CCC(OCC(=O)C2=C1C=CC=C[N]1C=N2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""CFF2383496074C75_64AF0D6421F50095_6039_DP""","""N2CCC(OCC1=C(C(=N[N]1C)C)[S](=O)(=O)Cl)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""EC08CB0ED7996BF5_BB8177CCA75C8988_6039_DP""","""N2CCC(OCC(C1=C(C)OC(=C1)C(=O)N)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C757592795A68990_CB3FE3B599B61566_6039_DP""","""N3CCC(OCC1=NN=C(O1)N2CCCCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""D2BD3B744E8C6534_F112898D6AE9A4A2_6039_DP""","""N3CCC(OCC1COC(O1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""64D1688E4D7C0E40_205B7B847FE8F9D3_6039_DP""","""N3CCC(OCC1=NN=C(O1)N2CCOCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""F4F4BBC57CD5EF43_9B0D11986268950F_6039_DP""","""N3CCC(OCC1=CC=C(C=C1)C2=NC=CO2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""A633E281BAF8AC4E_4742706B05431954_6039_DP""","""N2CCC(OCC1=N[N](CCC(F)(F)F)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""3BC8001DB6EB38E3_BCAC3303FBC8EAB5_6039_DP""","""N2CCC(OCC#CC1=CC(=CC(=C1)F)C#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""F8B7E819ECA28319_80007B6DCD00924E_6039_DP""","""N3CCC(OCC1=CC(=N[NH]1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""B38F0428B9947B03_CEB5054A268804A1_6039_DP""","""N2CCC(OCC1=CC=CC(=C1)SCCCC)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""BE80F6B8F4D9A1E5_E0AAACB6DDC192B6_6039_DP""","""N3CCC(OCC2=CC1=C(N(C)C(=O)S1)C=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""1B322EC4E8FE5872_BBADF35ACC1B71F8_6039_DP""","""N2CCC(OCC1=CC=CC(=C1)CCCOC)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""A241E91C98B35A1C_EEFB0F2D717F729E_6039_DP""","""N3CCC(OCC1=CC(=NO1)C2CCNCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""ADFCBE02F78B1BA4_C17D47BE5F93E0ED_6039_DP""","""N2CCC(OCCC(C(F)F)C1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""026115654F22E93C_5195BF4F4C04716E_6039_DP""","""N2CCC(OCC1=CC=C(CNC(C)=O)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""A5E0801C3F992A72_9705179D08A6D46C_6039_DP""","""N3CCC(OCC1=NC=C(O1)C2CCOCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""0ACEE44252669AE4_9CE72A66CDC4B69B_6039_DP""","""N1CCC(OCCCCO[S](C(F)(F)F)(=O)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
-"""B1753F07B6B6A482_44B81F2362672FAE_6039_DP""","""N1CCC(OCC(N=[S](N(C)C)(=O)N(C)C)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
-"""D9A0888225A8E1F1_DB1A536FA839AF2A_6039_DP""","""N3CCC(OCC2=CC1=C([N](CC)N=N1)C=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""C512D3662BCF7E3D_C3EC45176F42AF79_6039_DP""","""N2CCC(OCC1=CC=C(NC(OC)=O)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""BC29F57568C932D2_E0D339767012247A_6039_DP""","""N2CCC(OCC1=CN=C(C(OC)=O)C=C1C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""7DF952F61EB31CC8_AE17ECC735029F37_6039_DP""","""N2CCC(OCC1=N[N](C=C1C(OCC)=O)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""1E5056CEE960192F_9309DBD9E47A5FFE_6039_DP""","""N3CCC(OCCC1=NOC2=C1C=CC(=C2)F)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""D2B829C82D0ECA0B_C89D9DCA7254FEE2_6039_DP""","""N3CCC(OCC(=O)N2CC1=C(C=CC=C1)C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""6A459998B8A37516_5C4A88826947E1D2_6039_DP""","""N3CCC(OCC2=CC1=C(N(C)C(=O)O1)C=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""509EF1E9E729AD96_C3BDB46D13C4B9A7_6039_DP""","""N3CCC(OCC1=CC(=NC(=N1)CC2CC2)C)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""B1F67C25AD9B47F1_F88222089111773E_6039_DP""","""N3CCC(OCC1=CC(=NC(=N1)C2CCC2)C)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""9EFFFADE756888DB_B53576EA4D623DA2_6039_DP""","""N2CCC(OCC1=CC(=NC(=N1)C(F)(F)F)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""EFF6BE1D7FC0D036_9A5FAE9662205F3C_6039_DP""","""N3CCC(OCC1=CC=N[N]1C2CCCCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""307AB42DC9CFB869_D242B771C7DF81E3_6039_DP""","""N2CCC(OCC(C1CCN(C(C)=O)CC1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""52FDCC75CC78D4AE_C5679ACB19908A81_6039_DP""","""N3CCC(OCC2CC1(CCOCC1)C(=O)O2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""B02245EBBCCC57FD_356B291DB155994F_6039_DP""","""N2CCC(OCC1=C(C(=N[N]1C)C)[S](=O)(=O)N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""D22DE494B1B10056_85FF0AF920ED3DCB_6039_DP""","""N1CCC(OCC(C(CC(OCC)=O)(C)C)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
-"""D05C3D5CBF32F1F8_1F1A48DF10CB9FB6_6039_DP""","""N2CCC(OCC1=C(C(OCC)=O)C=N[N]1C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C81FAD5CEF580871_90E6649DE6C9CCA7_6039_DP""","""N2CCC(OCC[N]1N=C(C(OC)=O)C=C1C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""801C60771C3D0666_6CE57B4C184B99FA_6039_DP""","""N3CCC(OCC(=O)C1CCCC2=C1C=CS2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""1563D77DA8F3B27E_E10515B9A86291B2_6039_DP""","""N3CCC(OCC1=NC=C(O1)C2CCCCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""822BCA3E0468E871_9335D71DB9E56265_6039_DP""","""N3CCC(OCC1=NC2=C([N]1CC)C=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""1683C46B627E5712_16C53E2ADE7965AF_6039_DP""","""N2CCC(OCC1=C(C)C=C(C=C1)CC(=O)O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""289DAA18A3CA125C_53AF5F308B8D2EFF_6039_DP""","""N3CCC(OCC1=CC(=NC(=N1)C2CC2C)C)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""430F4051DA135721_052E76C5B19F2ABB_6039_DP""","""N2CCC(OCC1=C(CC)C=CC(=C1)[N](=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""12673E6C8BC642AE_7A45D1CF8ED2787F_6039_DP""","""N2CCC(OCC(C1CCCN(C(C)=O)C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""E0F8A5ACB2A7CD44_5200B4EE98C51DCB_6039_DP""","""N3CCC(OCC1=C(F)C=CC2=C1N=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""046B10AEABCBD146_1D546CFCA8C2E5E4_6039_DP""","""N3CCC(OCC1=CSC(=N1)COC2CCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""2F749304D7D4BC1F_43E72CB0E9EAD058_6039_DP""","""N3CCC(OCC2=NC1=C(C(=CC(=C1)F)F)[NH]2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""DABE576F495B4700_2718080DBEB38D44_6039_DP""","""N3CCC(OCC(=O)C1=CN=C2C=CC=C[N]12)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""14DF8C1ED4F9D608_447306B8821C78D6_6039_DP""","""N2CCC(OCC(F)(F)C(=O)C1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""EEA9A259327CBCF0_21210B07486A407C_6039_DP""","""N2CCC(OCC(CC1=C(OC)C=CC=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""54CF8E58CED8ABBA_13D9D1D1D066DB80_6039_DP""","""N3CCC(OCC1=CN=C(C=C1)[N]2C=CC=N2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""07640A2968030144_230123EBA0807C01_6039_DP""","""N2CCC(OCC1=CC=C(C(C(O)=O)N)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""926A1273618D5313_E43AE8E6AC98E9AF_6039_DP""","""N2CCC(OCC(NC1(C)CC[S](=O)(=O)C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C2AF495934F2AC85_0D888C608C59E2C1_6039_DP""","""N2CCC(OCCC(C1=CC=C(CC)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""6E198FDE3D993C25_04844709E8A92DFD_6039_DP""","""N3CCC(OCC1=N[S](=O)(=O)C2=C1C=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""772CA9617B7340BD_BCAE83DDE0EC926B_6039_DP""","""N2CCC(OCC(=O)NC1CCCCNC1=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""A3A1659BE106B0B5_80E729D3DA3B9E37_6039_DP""","""N2CCC(OCC(NC1=CC(=C(C)C=C1)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""B1B8C77AE4582885_8D0F62F5766DD5C1_6039_DP""","""N2CCC(OCC(NC1=NC=C([N](=O)=O)S1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""E377B3DBB305ADD0_2016B72FFE8EE2CB_6039_DP""","""N3CCC(OCC1=N[N](N=C1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""971C58EB4F1E440A_5039098148650BA5_6039_DP""","""N2CCC(OCC[N]1N=C(C)C(=C1C)C(=O)O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""0075556FA4C2F4FB_5883D88DA374E65C_6039_DP""","""N3CCC(OCC1CC(=NO1)C2CCCCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""7104EFB13257DD78_9DE184BDC204F3FE_6039_DP""","""N3CCC(OCCN1C(=O)OC2=C1C=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""5B0DC5771B5A4E60_AD3AFF947556736B_6039_DP""","""N2CCC(OCCCCC[N]1N=C(C)N=C1C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""F405FBBA9E1EB062_FF3EE0A34EBD512E_6039_DP""","""N2CCC(OCC1=C(C=C([N](=O)=O)C=C1F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""53A85AB3C6A1475B_29F10629A8845C4D_6039_DP""","""N3CCC(OCC1=CN=C([NH]1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""9F1062380927DDB0_7FF7862A31523433_6039_DP""","""N3CCC(OCC1=CSC(=N1)C2=C[N](C)N=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""4C07CA5112B916A9_7A1A660B4C9A43DB_6039_DP""","""N3CCC(OCC1=CSC(=N1)C2=NC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""8966B0AB4B9A0C71_3A0E3BE3FB40C0B2_6039_DP""","""N2CCC(OCC1=N[N](C(=C1[S](=O)(=O)Cl)C)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""4D697C81B5CD15CE_4B9F021E52510C26_6039_DP""","""N3CCC(OCC1=CC=C(C=C1)C2=CSC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""DF5917629E587B3D_CA8C8BD2BFDCB758_6039_DP""","""N3CCC(OCC(=O)C1=CC2=C(N=C1)OCO2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""F084219B5E5A29DD_7F00D6335727923E_6039_DP""","""N2CCC(OCC1=CC=CC(=C1)SC(F)(F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""C3A5AC077020923D_C2F3FBE476B6796F_6039_DP""","""N2CCC(OCC(OC)CC1=CC=C(C=C1)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""B3D308950DCC961F_111563366D6EACE7_6039_DP""","""N2CCC(OCC1=C(C(C)(C)C#N)C=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""7C95B22D88CD70C9_2E30DC579EE6E533_6039_DP""","""N2CCC(OCC(N(C)C1=CC=C(C=C1)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
-"""94434BECAB7E6F71_9E676273441857B0_6039_DP""","""N3CCC(OCC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
-"""9BEBAEDC4D1825B4_2707617D04A6DA78_6039_DP""","""N1CCC(OCCCCCCCCCN=[N]#N)C12CCC2""",21,"""20C70AFE40B0D0A8"""
-"""00A04AB013066B2A_F0661B316B161702_6039_UN""","""CC(C)(COCC1=NOC(=N1)C2=CSC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""15ED85A6A3245B69_314933CD283D3580_6039_UN""","""CC(C)(COCC1=CSC(=N1)C2=CC=CO2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4630CBC9268EC7BD_C4DC61B779DDB9EE_6039_UN""","""CC(C)(COCC1=CSC(=N1)C2=CC=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""07DE66EBD46EB831_8BCF1D1885A91438_6039_UN""","""CC(C)(COCCOC1=CC=CC(=C1)CC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F099B1494726C7CF_6332E61BCF795EC0_6039_UN""","""CC(C)(COCCC(C1=CC=C(F)C=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""BD91202315C1891A_41E06CE6C46448A3_6039_UN""","""CC(C)(COCCCOC1=C(C)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""D8DD7B7E7971124B_0F6EE06616AAE018_6039_UN""","""CC(C)(COCCOC1=CC(=CC=C1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""ED1C53DECEDC199A_25F60367CDBABFB9_6039_UN""","""CC(C)(COCC(C1=CC(=C(C)C=C1)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""5DFDF92F50DADEC8_F733EAD7F5B14587_6039_UN""","""CC(C)(COCC(C1=CC(=C(F)C=C1)F)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""5FA08B0181819B41_EAE53C5E7BCB8624_6039_UN""","""CC(C)(COCCOC1=CC(=CC(=C1)C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4DA1518236D50E06_48BDAF591383D51A_6039_UN""","""CC(C)(COCC(NC(NC(C)(C)C)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7EF059F7ADE13F93_DAB4DDCEEB03D7E2_6039_UN""","""CC(C)(COCC(=O)NC1CC[S](=O)(=O)C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""44E5166346C33785_D795400564DDA5BD_6039_UN""","""CC(C)(COCC(NC1=NN=C(CC)S1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""2A18343689398217_6C030C4350D56920_6039_UN""","""CC(C)(COCC1=C(C(OCC)=O)C=CO1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""5F8165B3422358E8_A3188A3ED62F1A95_6039_UN""","""CC(C)(COCCOC1=CC=C(OC)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""E92A1E776393F9E7_7868B2B7FD7E586A_6039_UN""","""CC(C)(COCC(CC1=C(F)C=CC=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F8D8D9A71ED218D8_749AE9B7945B7EFE_6039_UN""","""CC(C)(COCC(CC1=CC=C(F)C=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""62BCA4D372293E0C_AA8C65752732A6A4_6039_UN""","""CC(C)(COCC(NC1=C([NH]N=C1C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""CBC187CBCF77B831_F709C2E8E273AD45_6039_UN""","""CC(C)(COCC1=CC=C(C(F)(F)F)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""1CAEEF1F83151F3D_A76CCDD3E69F75E3_6039_UN""","""CC(C)(COCC1=C(C=CC(=C1)OC)OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""51323796C0701C88_4A0B0F5AF47F6C0C_6039_UN""","""CC(C)(COCC(NC(C)C1=CC=CO1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""A4526B0C208D7072_A7FF68C094172960_6039_UN""","""CC(C)(COCC1=COC(=N1)C2=CC=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""0FEE84528268FF25_797C5626D8E8ADE0_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2=CSC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""A5C08CCD228B7DBF_9DFACC7A9B381A06_6039_UN""","""CC(C)(COCC1=NOC(=N1)C2=CC=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""56ACAA5316CF051B_134FF756532720DC_6039_UN""","""CC(C)(COCC(NC(CCC(C)C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""DD2BE01772645EBF_38A5B83D43078F57_6039_UN""","""CC(C)(COCCOC1=CC=C(C=C1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""72D715062A0E22F4_8A188F335558C36F_6039_UN""","""CC(C)(COCC(=O)NCC1=NC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F54F34B6847F142C_5932BA838A402EF5_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""3AD42FC4B8ADBBF4_6B5168663A73FF4C_6039_UN""","""CC(C)(COCC2=C[N]1C=C(C)C=CC1=N2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F337BC862FE31C95_7C6CFC0AC82CEE29_6039_UN""","""CC(C)(COCC2=C[N]1C=CC=C(C)C1=N2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""8EA63D49764953B9_D5C4E3F4E1C29352_6039_UN""","""CC(C)(COCC1=NC2=C(C=C1)C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""076FD2075170D218_C8021F18CA764F9D_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)C(OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""14096A2109D41126_A883D1C0F4A938FA_6039_UN""","""CC(C)(COCC(C1=CC(=C[NH]1)[N](=O)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""E3F8D063BC37B3D1_978F8746D7837408_6039_UN""","""CC(C)(COCC1=NN=C(O1)C2=CC=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""06F83B22B556FFB5_6CAB3BFDAB3E7EB1_6039_UN""","""CC(C)(COCC(C1=C(C=C(F)C=C1)F)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""2EAB597E1D7AA92C_F41E9F728DEC0AC5_6039_UN""","""CC(C)(COCC(C1=C(C=CC(=C1)C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""82DD8D39C8E14A81_5CB0453ADDBA9D97_6039_UN""","""CC(C)(COCCCCOC1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""B92AB55B0384BB9D_AF95B4C8F0AB1ADF_6039_UN""","""CC(C)(COCC(=O)C1=CC=C(C=C1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""B18F16019B46D3F7_775377FC4F09B043_6039_UN""","""CC(C)(COCC2=C1N=CC=CC1=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""CCDA3893EAD78318_AB2C6439F3ECBF0B_6039_UN""","""CC(C)(COCC1=NC=C[N]1CC(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4C41337B0941C279_2AE6D5F5E5492E7F_6039_UN""","""CC(C)(COCCC1=NC=C(C(C)(C)C)O1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""797129EDC4632135_5FEDF10B6C023EBD_6039_UN""","""CC(C)(COCC1OCCC2=C1C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""CA638E31D7BC2116_3C1F85D81D358850_6039_UN""","""CC(C)(COCC1=N[N](C(CC)CC)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""0CF918FEE48A69D0_0ACE307921573B3C_6039_UN""","""CC(C)(COCCN1CCN(C(C)C)CC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""D7181C6B6E0D36BB_0568568CC28D4910_6039_UN""","""CC(C)(COCC2=C1C=CC=CC1=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""B0C038AC9B46272A_279520075A43642A_6039_UN""","""CC(C)(COCC2=C1OCCOC1=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""09F0A92BC7EE770C_2352B14E38FBB986_6039_UN""","""CC(C)(COCCOC1=CC=C(SC)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""80259387B41B7BCE_9A273DDD63BA1D5D_6039_UN""","""CC(C)(COCC1=CC=C(C=C1)OCC#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""ED8EA494D388F0CB_50BF16B9376EEB32_6039_UN""","""CC(C)(COCCN(CCCC)CCCC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""F91A4ABF269DFD1F_9DAEBA620DCFBA7C_6039_UN""","""CC(C)(COCC1=NC(=NO1)C[S](C)(=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""C6C8275BB3A33E2D_24A70EE30EB71249_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2=N[NH]C=N2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""443FD126DE8F4CB4_3DF42087697976F7_6039_UN""","""CC(C)(COCC(C1=CC(=C(C=C1)F)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""3807771ED0CC2583_7140A200436C9306_6039_UN""","""CC(C)(COCC2=NC1=C(C=CS1)C(=O)N2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""CB9219615F7F912D_28CEA9380582EB0C_6039_UN""","""CC(C)(COCCCNC(=O)C1CCCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""FC212855443AC9B6_E988D7750434A157_6039_UN""","""CC(C)(COCCN[S](CCCOC)(=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""FE3F841AB23A6365_DCBE82F2E6558E9A_6039_UN""","""CC(C)(COCC1=CC=C(OC(C)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""92F1C8DD300A2467_25508130235C5F8F_6039_UN""","""CC(C)(COCC(C1=CC(=CS1)C(O)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""81D967C7CFB66AF4_0282668B94EFC6D9_6039_UN""","""CC(C)(COCC1=NOC(=N1)C2=COC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7BE10033C5A91F46_44366459D6F65DC6_6039_UN""","""CC(C)(COCC(C1=CC(=CS1)C(N)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7FAFF2CF3F80218D_D6D3119BB09F1354_6039_UN""","""CC(C)(COCC1=NC=C(O1)C2=CC=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""A2BFB96898635A02_93EED6F511771A09_6039_UN""","""CC(C)(COCC(=O)NCC1=CN=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""FE19D0DAA7292F64_0E9F9CE094B8A72C_6039_UN""","""CC(C)(COCC2=CC1=C([N](C)N=N1)C=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""6FF484CF74524C76_867463E6EE0FE31A_6039_UN""","""CC(C)(COCCNC(=O)C1=NC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7BACD92A54ED9382_EB414301D132C6C5_6039_UN""","""CC(C)(COCC1=C([N](C)N=C1)C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""45CC24CBBBF85244_EA26337F8414FE2A_6039_UN""","""CC(C)(COCC1=NC(=NO1)CCC(C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""44F369A846C2C243_D8DACEBAABEFE675_6039_UN""","""CC(C)(COCC1=NC(=NO1)C(SCC)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""DF8A61FBA0632E87_0C900AD1D0C81795_6039_UN""","""CC(C)(COCC1=C[NH]C(=N1)C2=CC=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F392F7A8453A35D0_9CD6647DAB64553B_6039_UN""","""CC(C)(COCC1=C(OC)C=CC(=C1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""90E8E46F12DA89E6_1DA29574F5472115_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)NC(=O)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""893A40D2D6E137C4_377835B296485205_6039_UN""","""CC(C)(COCCOC1=CC=CC(=C1)OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""E9991482A07937D6_6BD6664F71FF2538_6039_UN""","""CC(C)(COCC1=CC=C(C(OC)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""44541B074946042A_DFF95EEE6AC939F5_6039_UN""","""CC(C)(COCC(NC(NCC(C)C)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""A981AFE067696D65_7D7FABB0411C304B_6039_UN""","""CC(C)(COCC(NC1CCC(C)CC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""75C27674B07BF24D_9F60027A3E957FA1_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2=CC=CO2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""30457A8878B0255F_FD9B59E9988CAA7C_6039_UN""","""CC(C)(COCCOC1=C(C)C=CC=C1C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""AE0C614F13766E77_EE14F8F102FD7282_6039_UN""","""CC(C)(COCC1=CSC(=N1)C2CCCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""25DDC5EBA11CEEFF_694948B53D29A3F0_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2CCCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""C6AC1A0132416E07_F85D97BA89719172_6039_UN""","""CC(C)(COCC(N(CC(C)C)C(C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""66EE19D85C1E39BF_C079A5AA1D3C449D_6039_UN""","""CC(C)(COCC1=CC=C(CC(O)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""E49F4E293FE26AE4_5B0EFDB54D46C014_6039_UN""","""CC(C)(COCC(NCCOCCCC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F21AC4404E23499A_A3E86D971DA1C40A_6039_UN""","""CC(C)(COCC1=CSC(=N1)C(OCC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""39FB6F1F970554A2_D572FB4971370A2C_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2=CC=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9F9D66111DC62051_74F00E2D836EFC07_6039_UN""","""CC(C)(COCC(=O)NC(C1CC1)C2CC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""168EC05CC6BDFC0A_7C93345BBE6801C6_6039_UN""","""CC(C)(COCC[N]1C=C(C(OC)=O)N=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""8C158A30105F8177_0EDF06E18B8374C7_6039_UN""","""CC(C)(COCC(N1C(CCCC1C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""3966D74CB447CB2F_EF80E37D2CFB9D79_6039_UN""","""CC(C)(COCC1=CC(=C([N](=O)=O)C=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""1350C251E85D3A58_577956C9EF8E194A_6039_UN""","""CC(C)(COCC[N]1C(=CN=C1C)[N](=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9782480ECAE3E183_DBF2648374AD275D_6039_UN""","""CC(C)(COCC1=NC=CC(=C1OC)OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F250AE183AED2A65_F29936D63025F241_6039_UN""","""CC(C)(COCC1=CC(=C(OC)C(=C1)F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F147806735D3D78C_6B47F9E09DBA18B1_6039_UN""","""CC(C)(COCC2CCC1(CCCCC1)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4769B423E9804D9D_792BA66495E043FC_6039_UN""","""CC(C)(COCC(C1CCC(F)(F)CC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""E2111E4BD34A5623_CA223D69F1CD208C_6039_UN""","""CC(C)(COCC1=NC=C(C(F)(F)F)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""1FC579ED633C774C_137B4B402709882D_6039_UN""","""CC(C)(COCC1=CC=C([Si](C)(C)C)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""54830CF4E0FEE883_14EAE3BC19E6208E_6039_UN""","""CC(C)(COCC1=NN=N[N]1CC(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""62F1A45C5FFA511B_EDFE9E88E4307562_6039_UN""","""CC(C)(COCC1=CC=C(C=C1)C2CCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""7E952E1A75F2BF83_48F73DE7C63B7141_6039_UN""","""CC(C)(COCC1=CC=CC(=N1)C(OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""F398A3890748363E_718F7AFD58AE5209_6039_UN""","""CC(C)(COCC(C(C(OCC)=O)(C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""915F01F479218276_06446DB1B377A733_6039_UN""","""CC(C)(COCC1=CC=C([S](Cl)(=O)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""742A23671902377A_FA0F16FF68C1465D_6039_UN""","""CC(C)(COCC1=CC2=C(N=C1)C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""3924440B3418F2C4_6E2842F6E5C71B91_6039_UN""","""CC(C)(COCC1=CC=C([S](C)(=O)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""86E019179EA69BAE_D6E66003E0BCB866_6039_UN""","""CC(C)(COCC1=C(C=CC=C1)[S](=O)(=O)Cl)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""CA970EFD5215C8AB_E6ED47512651C40C_6039_UN""","""CC(C)(COCCCC1(CCOCC1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""87EE0C77462548EE_AF8883F32F5BB328_6039_UN""","""CC(C)(COCC1=C(OC)N=C(C=C1C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4236973663A5ADDD_BD9BE6F82A538F13_6039_UN""","""CC(C)(COCC1=CC(=CC=C1)[S](=O)(=O)Cl)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9E76F4F4F87F251C_32083ACF67E7B39C_6039_UN""","""CC(C)(COCC1=C(C(F)(F)F)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""6B398BAC69BDE2CF_FACD3EE7034FD90A_6039_UN""","""CC(C)(COCC(=O)COC1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7A5735F87964A5EF_EEDB2C918BAD2ED2_6039_UN""","""CC(C)(COCCC(CC(OCC)=O)(C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""D9B0D0A1EE797836_DED0857DBA77A505_6039_UN""","""CC(C)(COCC1=CC=C(NC(C)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""D0D91184F56086B8_A63167AB27AC33F5_6039_UN""","""CC(C)(COCC(C1=CC(=NC=C1)OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4236973663A5ADDD_94647B5D2FC5EB7A_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)[S](Cl)(=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""18CEDAA251253CA5_EEE0ECAC0F723E0A_6039_UN""","""CC(C)(COCC1=CC=C([S](F)(=O)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4287D87060F04F3A_6FBF3AB920BA85C4_6039_UN""","""CC(C)(COCC(C1=CC=CC(=N1)OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""3398ADDC6BAC57D5_6B3D761118AB8B01_6039_UN""","""CC(C)(COCCN1C2=C(CC1)C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9738582576CC61E3_B8E1842A00FF1FBA_6039_UN""","""CC(C)(COCC1=C(N=C(C(C)C)C=C1)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""77C956AB3A746EEC_BD7E24B4D6B1CF52_6039_UN""","""CC(C)(COCC1=NC(=CS1)C(OCC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""02C84BFDCC072007_23971CC1A5A73DB1_6039_UN""","""CC(C)(COCC1=N[N](CC(F)(F)F)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""105BB7C014662AD8_1985F5DD5338F4E7_6039_UN""","""CC(C)(COCCN(C)CC1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""21861C2BD60ED2CE_A4B70C51D1BF81A9_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)[S](C)(=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""3FD561BD53132652_E0E6E3C8BCD07CBB_6039_UN""","""CC(C)(COCC1=C[N](CC(OC)=O)N=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7492D20B975797E9_ECA7F3E55EB25C90_6039_UN""","""CC(C)(COCC(N1CC(CC(C)C1)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F02DCA66AE90268F_C84B11F4FBAE8472_6039_UN""","""CC(C)(COCC(N1CCCCC1CC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""1707EA795E75CFFE_F3B5A40D21B26BE2_6039_UN""","""CC(C)(COCC1=CC=N[N]1C2CCCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""028B01F4D877AF65_B64939D2E89860EE_6039_UN""","""CC(C)(COCC1=CC=N[N]1CC(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""D0F49CA1E12546CB_418FA24E0506964D_6039_UN""","""CC(C)(COCC2COC1=C(C=CC=C1)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""ABB5A9635CF42C63_29FA903EBC4DFC8F_6039_UN""","""CC(C)(COCC(N(C)CC1=CC=CO1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""A3CEEAC2045362AE_1F0424CE1D4810A1_6039_UN""","""CC(C)(COCC(=O)CCC1CCCCO1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""8E02F2F6F9D051D6_D1A4D395BD0DA976_6039_UN""","""CC(C)(COCCC(NC1=NOC(=C1)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""5F80FB363141B72B_C25976BD4892179C_6039_UN""","""CC(C)(COCC(=O)NC1=C(C=CS1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9BB93CD0227370D4_5D4006393784E43E_6039_UN""","""CC(C)(COCC1=NOC(=C1)C2=CC=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""3572622A90BD3A87_A858F36C8817194A_6039_UN""","""CC(C)(COCC(OC)CC1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""BA3D4A1BEB2AC836_DCC1B133D6836883_6039_UN""","""CC(C)(COCCOC1=C(C=CC=C1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""08E85F0829406FB7_24E15C2692458067_6039_UN""","""CC(C)(COCC(NC(NCCCC)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""2EF37C27BE2BDA82_09F44A87F0817B7D_6039_UN""","""CC(C)(COCC2=NC1=C(C=C(F)C=C1)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9968C56D12D9C7CE_7AC5F439084B8BBD_6039_UN""","""CC(C)(COCC1=C(ON=C1)C2=CC=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4382EF936124BF0A_4A18945A7A7ACAC8_6039_UN""","""CC(C)(COCC1=CSC(=N1)C[S](C)(=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""F98470C5AEF030E1_3B002F1C4C88E36E_6039_UN""","""CC(C)(COCC1=NC(=NO1)C(OCC)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""19C73B0177D7A8DC_32B16CBFAB92DDC5_6039_UN""","""CC(C)(COCC1=N[N](C=C1)C2CCCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4F1DAB980F64A0E6_6EF1E47684356337_6039_UN""","""CC(C)(COCCCSCC1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""0C09D9BA8E1A1664_9F77BB9736774F23_6039_UN""","""CC(C)(COCC1=C(OC(F)F)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""B2A52454A3D7C228_7B067321DDF45E51_6039_UN""","""CC(C)(COCC1=C(C=CC=C1)OC2CC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""3B5F43EEAF71CDF1_175DD5BC08310B49_6039_UN""","""CC(C)(COCC1=CN=C(C(F)(F)F)N=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""060E7C2861F27139_100C2626748AAC55_6039_UN""","""CC(C)(COCCC2=NC1=C(C=CC=C1)[NH]2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""48AED598211B25A3_D5546D66AA1173F4_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)C(C)(C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""7125F84EDF4CC909_885F903726402202_6039_UN""","""CC(C)(COCCCN(C)C1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""949858B2256FB58D_0355631C4805EEF5_6039_UN""","""CC(C)(COCC1=NC2=C(N=C1)C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""632B07332DE1E888_430EB453F3639F68_6039_UN""","""CC(C)(COCCO[P](OCC)(=O)OCC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""C95FE83748AEC9CD_30F435483D513672_6039_UN""","""CC(C)(COCCSC1=C(C=C(F)C=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""FC3EEBB8B5915886_EF183814EB0C3384_6039_UN""","""CC(C)(COCCCOCCOCCOC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""1BF6F0BDCE607638_6A503FCA83D412E6_6039_UN""","""CC(C)(COCC1=C([N](=O)=O)C=C(C=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""282F9EB9C23441AD_B4E4442127E25A83_6039_UN""","""CC(C)(COCCC1=N[N](C(C)(C)C)N=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""325A9BEB7FC79D4D_BFAD83EEADA543A4_6039_UN""","""CC(C)(COCCC1CCC2=C1C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""028BF794C07B5CA1_F3A777684D70112D_6039_UN""","""CC(C)(COCCCC(CC(OCC)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""033626463C2B854D_87E8F48186D4E2AD_6039_DP""","""CC(C)(COCC1=CC=CC2=C1CCNC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""054040BBFB52E880_274962A301C0E4AA_6039_UN""","""CC(C)(COCC(OC)C1=CC=C(C=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7A116FD9979C79D9_37FAF9613FC17033_6039_UN""","""CC(C)(COCC2=NC1=C(C=CC(=C1)C)S2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""AD9A2AD189375BC9_690A43126904737F_6039_UN""","""CC(C)(COCC1=C(C(F)(F)F)N=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""1AF544D006BE7C04_25846D712FE98FC4_6039_UN""","""CC(C)(COCC(N(CC)CC(F)(F)F)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""6B786FCC6475980A_3042D421DAB53EEB_6039_UN""","""CC(C)(COCC(NC1=C(C)C=CC=N1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4E6766A17ABE3FA2_931CBA897741C846_6039_UN""","""CC(C)(COCC1=CC=CC(=C1F)[N](=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""692256E592C95045_5E8B61F9266E777D_6039_UN""","""CC(C)(COCC1=CC(=NO1)C(OCC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""741AE6511E2D2110_98AD110D338F3F37_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)C=CN=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""792AD8E67B924AEF_421826B57781DD35_6039_UN""","""CC(C)(COCC2=C1CCOCC1=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""052E129820E39055_E3D3085D3AF39F2F_6039_UN""","""CC(C)(COCC(NC1CCN(C)CC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""D64B098C388302BB_ACC1555E0D119954_6039_UN""","""CC(C)(COCC1=CC(=C(C)C=C1)[N](=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4DF3894CDFE6B354_207CA445A89A8D8A_6039_UN""","""CC(C)(COCC1CC2(CO1)CCCCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""2D1B7B221E7EBA9E_AB11790146A3237D_6039_UN""","""CC(C)(COCC1CC2(CO1)CCOCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""01299F852E9CE55D_2B5ACA153F18177B_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)N=CC=N2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""1CE4C0A43F1F8DBD_9F04B8782136C92C_6039_UN""","""CC(C)(COCC1=CN=C(C(OCC)=O)S1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""8E88369B21CC894A_0B02E6EDAD689A97_6039_UN""","""CC(C)(COCC2CCC1(CCOCC1)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""BDEF661F0B366331_46051701E26DAF6B_6039_DP""","""CC(C)(COCC2OCC1(CCNCC1)C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""2C795ED42F6B2769_A52C28CFC574E1A6_6039_UN""","""CC(C)(COCC2COC1(CCCCC1)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""D0B1745E430E5754_EB8D62FCEC6371F7_6039_UN""","""CC(C)(COCC(N1CC(C)(C)OCC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F169010F1B910E9E_513EE102D1FE36C1_6039_UN""","""CC(C)(COCC(C1=CC=C(OC)C=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7FA652C6E5018FDB_600D9B327E46D7A6_6039_UN""","""CC(C)(COCC(=O)N1CC2CCC(C1)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""E73D17BF052659C9_7B9EA59905D35BB2_6039_UN""","""CC(C)(COCC(C1=CC=C(F)C=C1)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""8FBF1DAFF01F5C05_55A8BACE0C40AD27_6039_UN""","""CC(C)(COCC(=O)NC1CCCCCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9D0716B5450C3573_0E01B5FBD6158629_6039_UN""","""CC(C)(COCCCOC1=CC=C(F)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F5318123B9FCD0E8_FF5E699EE7B1658A_6039_UN""","""CC(C)(COCCOC(=O)C1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""3CAF0C0CF680FEC5_B2FF68A3EBB712F6_6039_UN""","""CC(C)(COCCC[S](NC(C)(C)C)(=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""C3C717300942DE28_14B580913A50F238_6039_UN""","""CC(C)(COCC(C1=C(OC)C=CC=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9E76EDBA212371D3_78D0AE71D224FEB7_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""61E3193608DF8935_D8B67CC774EA1A06_6039_UN""","""CC(C)(COCC1=C(F)C=C(C(=C1)C#N)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9675B082EF48FAF7_9E94F4DB4EE8E4F5_6039_UN""","""CC(C)(COCC1=C(CC(C)C)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""88C341A4CF98AC6B_62C5DD36C2BB7390_6039_UN""","""CC(C)(COCC(=O)NCC1CCCCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""BE129D1726575D11_32DC23F3DED81F9F_6039_UN""","""CC(C)(COCC(N(C)C1CCCCC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""E6231FBE09589164_570115478724763C_6039_UN""","""CC(C)(COCC1=NC(=NO1)COC(C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""8C2DB00E88B08F40_0B4B3B16A3E64159_6039_UN""","""CC(C)(COCC2COC1(CCOCC1)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""88B3BE20DE5904C3_6FECC33F2F5CE4D8_6039_UN""","""CC(C)(COCC1CCCC(C(F)(F)F)O1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""E4F0E9B4F66D833B_9BFBDB43C4E94023_6039_UN""","""CC(C)(COCC1=NSC(=N1)C(OCC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""B879320433EEBC0B_FF93E532CB9AB450_6039_UN""","""CC(C)(COCCCCCCCCCCC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""06D3FB776E1D92D6_C5C64602E1D816B1_6039_UN""","""CC(C)(COCC1=NN=C2C(=O)NC=C[N]12)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""C59DB7B7E1DFE3CE_484252AD6C99C3C0_6039_UN""","""CC(C)(COCC1=NC(=C(S1)C(C)(C)C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4BB0E9358BCB5E98_BA7B88AE9E447431_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)C=NC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""596DA2CD9072C80C_0770D6BE919E9552_6039_UN""","""CC(C)(COCC1=C(C)C=C(C=C1C)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7C067D3C9962DD3C_A72D46D917A2B8F6_6039_UN""","""CC(C)(COCC1=CN=CC(=C1)C(OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""BC54FDD543CDE617_DE2C7382542E8FA2_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)[S](F)(=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""53DA54589878F555_2376504573895592_6039_UN""","""CC(C)(COCC1=C(CC(C)=O)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""EA734964F3BE001C_45429428116D662F_6039_UN""","""CC(C)(COCC1=CC(=NN=C1C2CC2)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""BAE92016FFA08BB0_CF0151935BCED9AB_6039_UN""","""CC(C)(COCC1=C([N](C)N=N1)C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""401F1015AA77047B_84E7DD89B9780B77_6039_UN""","""CC(C)(COCC(NCCCOC(C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""614058767A75CA64_3EFE6B4009719806_6039_UN""","""CC(C)(COCC1=NCCC2=C1C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""915F01F479218276_C2C344D097E754A3_6039_UN""","""CC(C)(COCC1=CC=C(C=C1)[S](=O)(=O)Cl)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""5F46AE8DC83804A0_C28C15BC646B336A_6039_UN""","""CC(C)(COCC(N(C)CC1=CSC=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""FD17B21DAC1D371C_2C29CB862FDCD7EA_6039_UN""","""CC(C)(COCC1=C(C)OC=C1C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""B55B543EF3A7A073_A164E5902E0AEF98_6039_UN""","""CC(C)(COCC2=CC1=C(CN(C)C1)C=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9B1FB0DCDA488701_633EE177FB7C7BCB_6039_UN""","""CC(C)(COCC1=C(C(OCC)=O)[NH]N=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""3AA38685D2BC2D9C_FCFE7497A3E64FBA_6039_UN""","""CC(C)(COCC1=CC(=C(C)O1)[S](=O)(=O)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""B3CFEDE3354FBA2A_187513892D46C54F_6039_UN""","""CC(C)(COCC1=CC=CC2=C1N=C(C)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""8D9CF3C0D6451DB6_85D4E469E0FF97AB_6039_UN""","""CC(C)(COCC(C1=CC=CC(=C1)OC)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""A6967CB9F5BB6589_1150441831766652_6039_UN""","""CC(C)(COCC1=NN=C2[N]1CCOCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7C94BDA9D15A0476_9E5BAA70D4970EA0_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)CCOC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7E51BFB214EE4E2C_CACF62937D597029_6039_DP""","""CC(C)(COCC1(OC(CC12CNC2)=O)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""A87CB756BF51B6DA_323BA9343423BBD4_6039_UN""","""CC(C)(COCC2=NC1=C(CC(C)CC1)S2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""43D309C1A41DBAAE_CF13C6B07ECB3CEA_6039_UN""","""CC(C)(COCC(C1=CC=C(SC)C=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""3F012844FDED13AB_1A9C4BEC496D7DF8_6039_UN""","""CC(C)(COCC1=CN=C(C(OC)=O)C=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""072857DA9029ED8F_A3ED92AE92741F94_6039_UN""","""CC(C)(COCCC(N1CCN(C)CC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""220896C28FA4B42A_7D0DFF297D7F0389_6039_UN""","""CC(C)(COCC1=C(C(F)(F)F)C=CC=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""2D608F79372E5422_2772D2712BBE43F4_6039_UN""","""CC(C)(COCC1=C(C(OCC)=O)SN=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""232CAD30CC0E985E_39A7E44C251F599B_6039_UN""","""CC(C)(COCC1=CN=C2[N]1C=C(F)C=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7643E5B14F044D18_5E58BB12D7118E8F_6039_UN""","""CC(C)(COCCCC(=O)N1CCCCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""6FC2B09A4623273C_1071423D7AC8079A_6039_UN""","""CC(C)(COCC1=C(C(C)(C)C)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""61401F3C27E8EC79_928B438AFF2726D1_6039_UN""","""CC(C)(COCCC1=CC(=C(C(=C1)F)F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""CD96066C2525828C_23F7C2E8A25AE9E9_6039_UN""","""CC(C)(COCC1=NC=CC(=C1)[S](F)(=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""7BB536B825F30D5D_74FD4E92A969C46E_6039_UN""","""CC(C)(COCC1=CN=C(C(F)(F)F)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""89197B6708ACCD5C_86EE9B7206BA0EC1_6039_UN""","""CC(C)(COCC1=CC(=NC=C1)C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""36AAC885874AFDD5_38F816B9802FB05C_6039_UN""","""CC(C)(COCC(=O)C1=CC=C(C=C1)C#C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""C37C53911D4199FD_089D3CD649820C68_6039_UN""","""CC(C)(COCC1=CC=C(OC(C)C)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""FE0CD3441BBEA44A_B72B1CF305734875_6039_UN""","""CC(C)(COCC1=CC(=C(C(O)=O)C=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""68D099A32EBA395A_04195616BD394F4A_6039_UN""","""CC(C)(COCC1=C(NC(C)=O)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""AFF0EBFC7998BC06_EC79FFCC1851D562_6039_UN""","""CC(C)(COCC2CN1CC(CCC1=O)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""B793EB006AF88DD8_A58EE563E230EFAA_6039_UN""","""CC(C)(COCC1=NN=C(O1)N2CCCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""3E2A6ECB679B47F0_E9CC633FAC43CC2A_6039_UN""","""CC(C)(COCC1=NOC2=C1CCCCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""EC41E47B53A0780A_B79C8179C16FA069_6039_UN""","""CC(C)(COCC1=NOC=C1C(OCC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""C0F4031E8F63174F_1449DEBDE9D7291F_6039_UN""","""CC(C)(COCC1=NOC(=C1)C(OCC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""CE0981F25FB208A5_D8837C4867E94A52_6039_UN""","""CC(C)(COC[C@@H](C(C)(C)C)N[S](=O)(=O)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""AE363CEA7362D405_6750CC0E1ACF01C1_6039_UN""","""CC(C)(COCC(=O)C1=CN=C2[N]1C=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""CDAFDB98F273B233_2601F4CFB860FC37_6039_UN""","""CC(C)(COCCCOC1=CC(=O)CCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""5BD5F950AA85A36E_977810FB5D7E2A17_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)SCCC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""BA5881FCBC4A99E9_0D0DAD1797ED8EDC_6039_UN""","""CC(C)(COCCCC1=C(F)C=CC=C1F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""81552BD3D91E0958_C1CF72AC1EEB2FFC_6039_UN""","""CC(C)(COCC1=NOC(=C1)C2CCCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""FFABDBA51FD4F5C2_501CA351941A10E5_6039_UN""","""CC(C)(COCC1=CC=CC(=N1)C(C)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4124731D832A9470_DB4F5B42F9DD9F17_6039_UN""","""CC(C)(COCC(C1=CC(=CC(=C1)F)F)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""088A42791B2575FC_66758FFA4BF7BBFA_6039_UN""","""CC(C)(COCC1=CC=C(C(CC)C)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""6781E401583EA419_6AB432AC99587EB5_6039_UN""","""CC(C)(COCC1=CC=CC2=C1OC(=N2)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""A90872B178ECD088_B00AA4652BF897C3_6039_UN""","""CC(C)(COCC(NC(N=[S](C)(=O)C)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""38C25ADFE60747A0_8EA15F7982877C61_6039_UN""","""CC(C)(COCC1=C(C(F)(F)F)N=CC=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""F6C2962F472365F4_D5553819BB5BC8DC_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)[S](C)(=N)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""BB2637C5C04E3780_393CEDE6956A10AC_6039_UN""","""CC(C)(COCC1=NOC(=N1)C(OCC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""598B7FBC47002FC6_2802EB2A4B6A4A58_6039_UN""","""CC(C)(COCC1=N[N](C)C=C1[S](=O)(=O)Cl)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9AC922221BE4E153_1762E7C026B48A06_6039_UN""","""CC(C)(COCC1=CC(=N[NH]1)C(OCC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""5A5C5AD5833422EB_168D7D89DBE5136D_6039_UN""","""CC(C)(COCC2CC1(CCCC1)C(=O)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""6DC8CE75FD52E95D_726A8542427F3877_6039_UN""","""CC(C)(COCC1=N[N](C)C=C1[S](=O)(=O)N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""9A3DD2009BA5A4E5_7747A4F037879541_6039_DP""","""CC(C)(COCC2CCC1(CCNCC1)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""0B9E649CF6E5EC6E_16332BC07A3EA792_6039_UN""","""CC(C)(COCC(OC1CN(C)CCC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""46BFBF44860259CC_29BC7F8B7A3A785F_6039_UN""","""CC(C)(COCC1=CC(=NC(=C1)OC)OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""24559DCA54CE75EC_E48F9D0F38354A79_6039_UN""","""CC(C)(COCCC1(C(O)=O)CCOCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""04DEF98BFB4F7289_BE942B60EF831B0B_6039_UN""","""CC(C)(COCC1=C(C(OCC)=O)C=NO1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""092AA30B0D4E5939_8EE9C5978B97633E_6039_UN""","""CC(C)(COCC1=CC(=NC(=N1)C2CC2)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""0343D566696F7F99_7DE4CC040AF11C97_6039_UN""","""CC(C)(COCC1=CC(=NC(=N1)OC)OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""0667F00DAF6A9970_1370B774BA3A3266_6039_UN""","""CC(C)(COCC1=C(C(C)(C)F)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""FF7AB2138B2772D6_1F946840F0CE07A5_6039_UN""","""CC(C)(COCC1=C(C(OCC)=O)C=N[NH]1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""D8CFBBDDAFED51E7_ABFC886CB28E336A_6039_UN""","""CC(C)(COCCOC1(CCOCC1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""4EA635DC2A58CF6F_39C944CCD9A9DF47_6039_UN""","""CC(C)(COCC#CC1=CC=CC(=C1)OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
-"""FD82B75618F7F930_534C15F7D31526F0_6039_UN""","""CC(C)(COCCCO[S](C(F)(F)F)(=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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-"""9DF8B52056E5DCD8_4DDE72823420A84F_6039_UN""","""COC(=O)C(OCC1=CC(=NO1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""C969A9687E223A67_F51AADF5EC1B0910_6039_UN""","""COC(=O)C(OCC1=NOC(=N1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""C3DAD98DEE1D5D37_ADD1B3E5B6AEE9E2_6039_UN""","""COC(=O)C(OCCC(NC1=CC=C(F)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""ED8A437FDD5EA260_2FB9FC428CBE9515_6039_UN""","""COC(=O)C(OCC2=NC(=C1C=CC=CC1=N2)C)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""AD33F4D7136D009C_0803123C03822F8F_6039_UN""","""COC(=O)C(OCC(C1=CC=C(CC(N)=O)S1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A23759E0098A2D30_C615FFEACC512EF2_6039_UN""","""COC(=O)C(OCC(=O)NNC(=O)C1=CC=CS1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""30808DF94D7A14E7_79CFE12FFEB9B79F_6039_UN""","""COC(=O)C(OCCC(NC1=CC=CC(=C1)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""20F0D15982B28347_4BB7CF7CCB04ACB4_6039_UN""","""COC(=O)C(OCC(=O)NCC(=O)N1CCCC1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6043D802BA0DD9E2_3A061A4F5FF2A55C_6039_UN""","""COC(=O)C(OCC2=NC1=CC(=C(C=C1[NH]2)F)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1C4096A33121E39C_925B35B438566296_6039_UN""","""COC(=O)C(OCC(C1=C(OC)C=CC(=C1)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1DA882543A0BEB49_74BDCBACC27FC4ED_6039_UN""","""COC(=O)C(OCCCOC1=CC=C(OC)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""59460B8FEE5A8F47_5DEBC76C0891BAD0_6039_UN""","""COC(=O)C(OCC(N(CCCC)CCCC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""93AC63140AC7EF69_0D6511F15A93A5B2_6039_UN""","""COC(=O)C(OCC(N(C1CCC(C)CC1)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""90D5079B8BD17F5C_520C5FF09A9ABD62_6039_UN""","""COC(=O)C(OCC(NC(NC(COC)C)=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""0592466A015EC995_C6CA98AAC1627937_6039_UN""","""COC(=O)C(OCC(NC1=CC=N[N]1C(C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E6178D4634FEEFB4_7A5EA9428ECDA164_6039_UN""","""COC(=O)C(OCC1=NOC(=C1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7E2EBF7D1D98EB8E_D33E647784186C40_6039_UN""","""COC(=O)C(OCC(N(C)CC1=CC=C(C)O1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1E90935CA660C8A3_97BA605181420C44_6039_UN""","""COC(=O)C(OCC1=NC(=NO1)C2=CN=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6348434A0F78F363_300273E7F0234432_6039_UN""","""COC(=O)C(OCCCN1C(NC(C)(C)C1=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1950D60342AF2ABC_F85078D667D2DEB3_6039_UN""","""COC(=O)C(OCCOC1=CC=CC(=C1)[N](=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""2391D4D76E9F1562_5B59596BFB062B87_6039_UN""","""COC(=O)C(OCCOC1=C(OCC)C=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D568F288CC1541F6_D578218D33E484C9_6039_UN""","""COC(=O)C(OCCOCCOC1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C05D0BCBEE39868D_D703E692E5823892_6039_UN""","""COC(=O)C(OCC1=CC(=CC2=C1N=CC=C2)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""EAD3BA27F96E052D_6354BF139A17EA63_6039_UN""","""COC(=O)C(OCC(=O)NOCC1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F2E12EFB0634D4BA_29B6736C4A6455DD_6039_UN""","""COC(=O)C(OCC1=C[N](N=C1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""0C3120BC90C2EA17_A9C023BC4B1264C9_6039_UN""","""COC(=O)C(OCC(NC(NCC(F)(F)F)=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""9C914B9DCB63887E_4D03FC47792DE0CD_6039_UN""","""COC(=O)C(OCC(C1=C([N](CC)C(=C1)C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""241AEFE67F373E8D_40CF89AD3FB0F4FB_6039_UN""","""COC(=O)C(OCC(NCC1=C(F)C=CC=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""B6A64A635E9048D9_E78C5822F554780D_6039_UN""","""COC(=O)C(OCC1=CN=C(S1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A05F8BFA9D7F8944_879E43B9737A0860_6039_UN""","""COC(=O)C(OCC(N(C)C1CC[S](=O)(=O)C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""88F04D5D4D35BF11_07A0852EE3AB2D8A_6039_UN""","""COC(=O)C(OCC(C1=CC=C(C(C)C)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C3AC8FCAA7CD4FE0_B2D394C5954297AE_6039_UN""","""COC(=O)C(OCC(=O)C(C#N)C1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C2CD9EBE43099AD8_8270C55547429371_6039_UN""","""COC(=O)C(OCCOC1=CC=C([N](=O)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""4B6CB23AA9A849F7_AB058FCC645CC762_6039_UN""","""COC(=O)C(OCC(NC1=CC(=CC(=C1)F)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""31E96732C1D12891_52CD8AEE8A78F5D1_6039_UN""","""COC(=O)C(OCC(=O)C1=CC2=C(C=C1)OCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""8D524972774FF7BF_D8BB482F66E7BE11_6039_UN""","""COC(=O)C(OCCCOCCC1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""444C0D4CCA9713D8_1037C2D3AEBFE279_6039_UN""","""COC(=O)C(OCC(C1=C[N](C)C(=C1)C(=O)N)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7FC156A2D2DD39E5_9C4A80E361F3043C_6039_UN""","""COC(=O)C(OCC(=O)NC1=NN=C(O1)C2CC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5AD81EAB4DDEAB8F_33B91BD3D8543EF7_6039_UN""","""COC(=O)C(OCC1=CSC(=N1)C2CCCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""773D6A32E165F095_8F848E7626F7609A_6039_UN""","""COC(=O)C(OCC1=CSC(=N1)C2=CC=C(C)O2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""39A3E1044483FAB5_BB547976EB156F81_6039_UN""","""COC(=O)C(OCC1=CSC(=N1)CC(N(C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""4EE32C1B107A60EC_E6E65820DB07DD72_6039_UN""","""COC(=O)C(OCC(NCC1=CC=CC(=C1)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5CA21359FB6FFD69_7BA8D67E6D438B75_6039_UN""","""COC(=O)C(OCC(N(C)CC1CCCCC1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""8188B5CB9EB29918_50CA07A22E9F3FE8_6039_UN""","""COC(=O)C(OCC(=O)NCCC1CCCCC1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""BF4067C364ED3686_F73EADD973A9CC66_6039_UN""","""COC(=O)C(OCC(NCC1=CC=C(CC)S1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3F155BC3884FEF81_A8BBE2E7D9625DF6_6039_UN""","""COC(=O)C(OCC(=O)NC2=NC1=C(CCC1)S2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""157A9AD9358BC3AC_D6C9ADD9E8FF4005_6039_UN""","""COC(=O)C(OCC(=O)N(C1CC1)C2CCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7A655A689B85E0D9_968510083AB4253F_6039_UN""","""COC(=O)C(OCC(NC1=CC=N[N]1CCC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C2D23F8DAC7009B6_227512CF52809B64_6039_UN""","""COC(=O)C(OCC(=O)NCC1CC[S](=O)(=O)C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A0936FFB4966BBED_8ABEAA481A0DA08E_6039_UN""","""COC(=O)C(OCC1=CC=CC(=C1)C(N(C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""73E5C6086515A2BE_3CEAE6A7E9062A79_6039_UN""","""COC(=O)C(OCC2=NC1=C(C=N[N]1C)C(N2)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D0B0148120669BA5_AEC33E478A456286_6039_UN""","""COC(=O)C(OCC(NC1=NC(=C(S1)C)CC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7A3B8E9E96AAD864_8E87534F424CDC92_6039_UN""","""COC(=O)C(OCC1=CC=C([S](N(C)C)(=O)=O)O1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""27CF4382C6519F5C_E253FC60E5A426FB_6039_UN""","""COC(=O)C(OCC1=N[N](C=C1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D36CCC68BC87DB74_E04935B8EF45DDB5_6039_UN""","""COC(=O)C(OCCC1=CC=C([S](N)(=O)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1F7A129F4E4DAEC7_F4C2072B2FD885A9_6039_UN""","""COC(=O)C(OCC(NCCOCCC(C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""69EDE106AA10F5BC_5939EAF44F6191FF_6039_UN""","""COC(=O)C(OCC(=O)C1=CC2=C(C=C1)CCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F925CA425DCAE87E_DB1A261C1C3B3E43_6039_UN""","""COC(=O)C(OCCOC(=O)NC1=CN=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A9A02D4EA94DA4C5_2A8F182DFA32A2E1_6039_UN""","""COC(=O)C(OCCCN(CCCC)CCCC)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C147C6760F0C21D9_13DB76C76D34DF0D_6039_UN""","""COC(=O)C(OCC(NCC1=C(ON=C1C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F2242BF16E796225_7CA53E17273DDB33_6039_UN""","""COC(=O)C(OCC(C1=CC(=CO1)C(OC)=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""1CAEFDAEA221CEB9_E12723C8B29A1E8F_6039_UN""","""COC(=O)C(OCC1=C[N](N=N1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""74F421FF65260C1F_05A1D93D5374D102_6039_UN""","""COC(=O)C(OCC1=C(C)OC(=N1)C2=CSC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""4E6CE84AA287F83D_B686F5D2B7965BD7_6039_UN""","""COC(=O)C(OCCC1=CC2=C(C=C1)C=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7E886BE5997A2C68_935EACC7A1C07FDA_6039_UN""","""COC(=O)C(OCC1SC(=NC1)N2CCOCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""BCA8FFDA39930513_87F0FD4C57E60ABA_6039_UN""","""COC(=O)C(OCC(C1=C(C)OC(=C1)C(=O)O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3C888F7D63DEEB18_E6F3036AAF9CA78F_6039_UN""","""COC(=O)C(OCC(=O)NCC(=O)C1=CC=CS1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6C9C813FBBAE4D06_916C751ECCA13EE1_6039_UN""","""COC(=O)C(OCCCOC1=CC=C(C=C1)C#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""386DF0457D26D234_A6C5580BEAADD0F5_6039_UN""","""COC(=O)C(OCC(NCC1=CC=CC(=C1)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A01F14415F6E6CF5_81B59861C7667B20_6039_UN""","""COC(=O)C(OCC1=NOC(=N1)CCC(OC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""9C25A2318D813C21_8B832F15100EC7E5_6039_UN""","""COC(=O)C(OCC1=CC(=NC2=C1C=CC=C2)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""EF6F58EA32B33AAD_7D5A60706A0E63BE_6039_UN""","""COC(=O)C(OCC(NC1=C(C(=C(C)S1)C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""EBE568C210455859_A65BCCE8D0AF4D42_6039_UN""","""COC(=O)C(OCC(C1=CC(=C(C)C=C1F)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""629F0E5BFE13DA46_CD985441DD0B5D77_6039_UN""","""COC(=O)C(OCC(=O)N1CCN(CC1)CC#C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5B936B71A38C5BC1_70922F1FD8159FE1_6039_UN""","""COC(=O)C(OCCN[S](C1=C[N](C)N=C1)(=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""04D00DC3E745AA39_D59273DD030E836A_6039_UN""","""COC(=O)C(OCCC=CC1=CC=CC(=C1)OC)C(C)C""",21,"""39BFC05C18580BC7"""
-"""8A4F167D69E44979_CDC9BCD6A6BE2482_6039_UN""","""COC(=O)C(OCC1=C(C=CC(=C1)OC)[N](=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""85C9F965D2D3CFB3_905A16643E3FA48F_6039_UN""","""COC(=O)C(OCCOCC1=CC=C(OC)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1B2D904C7F1AD2E6_DE3D8DF09DED72E0_6039_UN""","""COC(=O)C(OCC1=C(C)OC(=N1)C2=CC=CO2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""2EDF06FBC05D7FAB_826B9F99378A60F8_6039_UN""","""COC(=O)C(OCCOC1=CC=C(C=C1)CC#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E281B46D261525FC_013362227E5C96C6_6039_UN""","""COC(=O)C(OCC(C1=CC(=C(C(=C1)C)F)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3F0815CA64D246A8_9C91C52EA92ABB6E_6039_UN""","""COC(=O)C(OCC1=NOC(=N1)C2=C(C)N=CS2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""814E238BBFB73620_B11F669C1E7D2862_6039_UN""","""COC(=O)C(OCC1=CC(=C(C(OC)=O)C=C1)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A842889C2E12FE1A_4C902572BAD9A381_6039_UN""","""COC(=O)C(OCCN1C2=C(CCC1)C=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C8326DB9C62B0E2E_20F127A9B790853F_6039_UN""","""COC(=O)C(OCCCOC1=CC(=CC=C1)C#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5D2996FF48A73CF2_4F0255C7DC50ADC9_6039_UN""","""COC(=O)C(OCC(NC1=NN=C(C(C)C)S1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E3EDC4E5F1126A70_1D5E7AF571DD6D50_6039_UN""","""COC(=O)C(OCC(=O)C1=CSC2=C1C=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""814C1F5DBB4C4A79_DF1CBA9E45A33F36_6039_UN""","""COC(=O)C(OCC1=CC(=CC(=C1)[N](=O)=O)OC)C(C)C""",21,"""39BFC05C18580BC7"""
-"""61A0DDE84AFF85AA_43F4FCF3933654A2_6039_UN""","""COC(=O)C(OCCC1=C[N](CC(OC)=O)N=N1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""DE3D9EEBBAF44561_1CB76A565ADD36D5_6039_UN""","""COC(=O)C(OCCCC1=NN=C(C(F)(F)F)O1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1FC8A20741D8CF38_1DC954AD8209C330_6039_UN""","""COC(=O)C(OCCC(N(C)C1=CC=CC=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A9CB64A4E9CA9EE2_51D965B0F424FF37_6039_UN""","""COC(=O)C(OCC(=O)NC1(CCCCC1)C#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""BF3CDB91608C9470_13FB670CDE6EEEA3_6039_UN""","""COC(=O)C(OCC(NC1=CC=C(SC)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E7E468235F3CF0C3_3D90E079950BD533_6039_UN""","""COC(=O)C(OCC1=NN=C(O1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F7E0CE6D166E7D00_1A0BCD4B9E1409EB_6039_UN""","""COC(=O)C(OCC1=NC(=NO1)C2=NC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""08D23B0A830E5078_08DD22BBA31BE269_6039_UN""","""COC(=O)C(OCC(=O)C1=C[NH]C2=C1C=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""229A1EF057775B91_4C7E9E48E155ECF9_6039_UN""","""COC(=O)C(OCC1=C(CC(OC)=O)C=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5A4592F3C96CAAE6_5B749F0A5D04DBD8_6039_DP""","""COC(=O)C(OCC1=CC(=CC(=C1)C(F)(F)F)N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D393027BD55FE4E3_169A01F99993D71F_6039_UN""","""COC(=O)C(OCCC1=NC2=C([N]1C)C=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""721AF24B13A431C2_54C2A2C5AE56BD51_6039_UN""","""COC(=O)C(OCCN1C=C([N](=O)=O)C=CC1=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""4520C1562D2DA8C1_E53237102517FE67_6039_UN""","""COC(=O)C(OCC(N1CCCCC1C(N)=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""ED89F35979EDC82D_EFFF9E55668A6042_6039_UN""","""COC(=O)C(OCC1=CC(=C(OC)C=C1)[N](=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""308E6AAF258B6B38_FA7B44CE6F7DA59D_6039_UN""","""COC(=O)C(OCC2=NN1C(C=C(C)N=C1S2)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""25B5BE7F624F703D_D0AA52B083FB469C_6039_UN""","""COC(=O)C(OCC(NC1CCN(CC)CC1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""49EB3C9952FB4A29_EB111835CF644682_6039_UN""","""COC(=O)C(OCC(N(C1CCCCC1C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""026826BE58C49283_AB3C1D309E655B2F_6039_UN""","""COC(=O)C(OCC(N(C(C)C1CC1)C2CC2)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""AD1BF6D116493B18_5C53A44CF69FED0D_6039_UN""","""COC(=O)C(OCC1=CC(=CC2=C1OCOC2)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""EA9F411DFAABE417_D4615608CADA9A14_6039_UN""","""COC(=O)C(OCCCOC1=CC(=CC(=C1)C)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""20B8AECF548FD26F_B739F530630E8835_6039_UN""","""COC(=O)C(OCC(N(C(CC)C)C(C)CC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F5DD6D362AF5F1CA_852ECC8E15FE0D98_6039_UN""","""COC(=O)C(OCCC1=CC=C(C=C1)[S](=O)(=O)Cl)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D4E550C207588444_DC66630F7196D20A_6039_UN""","""COC(=O)C(OCC(=O)N2CCC1=C(C=CS1)C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""14C5E0B6DC3157A9_DB66C83161EFA611_6039_UN""","""COC(=O)C(OCC2=C[N]1C=CC=CC1=C2C#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A4EDE033999918D3_F542FD0EB54F46C7_6039_UN""","""COC(=O)C(OCC2=NC1=C(C=CC=C1)C(=O)O2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""11886A6F013FCD79_CC81A6CFC5AF8B4D_6039_UN""","""COC(=O)C(OCC1=C(C)OC(=N1)C2=CC=CS2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""ED47F1FA0D2B0127_C8EE033A31C56A87_6039_UN""","""COC(=O)C(OCC(N(CC(NCCC)=O)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""98A2F5556BBA49EA_F3BC0AC4ABA0803A_6039_UN""","""COC(=O)C(OCC1=NOC(=N1)C2CCCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E776A1640D96F33D_B5B32280E96D23BB_6039_UN""","""COC(=O)C(OCC(=O)NC1=CC(=CC=C1)C#C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""82F108EF621A34AC_2E0A5D91D801D23B_6039_UN""","""COC(=O)C(OCC1=C(C=CC=C1)N2CCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""DA073E674709E844_E866F2E2215848B0_6039_UN""","""COC(=O)C(OCC1=C(C)C=CC2=C1C=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C50B68A0730761C5_95969F65103EC331_6039_UN""","""COC(=O)C(OCC1=C(CC)OC(=C1)C(=O)OC)C(C)C""",21,"""39BFC05C18580BC7"""
-"""59672569287BC119_126996875AF14109_6039_UN""","""COC(=O)C(OCC1=C(C(OC)=O)C=C(C=C1)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C517F5507149EE3C_3F0436CD5472D2BB_6039_UN""","""COC(=O)C(OCC1=N[N](C=N1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""972BF1DD98766144_B1F7E2D33ACC4189_6039_UN""","""COC(=O)C(OCC(=O)C1=C[NH]C2=C1C=CC=N2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""80CDF2F08D7970B9_1AFF868C456BDD28_6039_UN""","""COC(=O)C(OCC2=NC1=C(N=C(OC)C=C1)[NH]2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""52FC5F3CA22F3DCE_E7C18DF306533234_6039_UN""","""COC(=O)C(OCCN1C(=O)OC2=C1N=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D322E7E956209DAB_764B5AA3F1210261_6039_UN""","""COC(=O)C(OCC(NCC1=CC=C(F)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""DFD096BB36A7895D_B8E7F840AB6EB20D_6039_UN""","""COC(=O)C(OCC(NC1=C(C=C(F)C=C1)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6D37299374B1B750_64490B5430F9B9DD_6039_UN""","""COC(=O)C(OCC(=O)NCCC1=CCCCC1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5983734FC9C2F28D_68DD82467FF54DAF_6039_UN""","""COC(=O)C(OCC1=COC(=C1)[S](N(C)C)(=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D168557D96DEEC83_AD07703CE6871EAE_6039_UN""","""COC(=O)C(OCC1=CC(=CC=C1)[N]2N=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""4BC608ECE2D3E844_4F3821746AB792D0_6039_UN""","""COC(=O)C(OCCC1=CC2=C(C=C1)OCCO2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""9B1E8B2CDFFA2A4C_697658CBFE79A7F1_6039_UN""","""COC(=O)C(OCC(NC1=C(C=C(C)C=C1)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F4EA782625420311_8B243A16E1DBBE77_6039_UN""","""COC(=O)C(OCC(NC1=CC=C(OC)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C797253FF1F86FF2_A4C3DE17602FE411_6039_UN""","""COC(=O)C(OCC(=O)NC1CCCCCCC1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""61BF723DEB6AB3AF_1975AECD80CD6350_6039_UN""","""COC(=O)C(OCC(NCC1=CC=C(C)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""128D739AABF7B142_7166C24D573365B0_6039_UN""","""COC(=O)C(OCC(N1CCN(C(C)=O)CC1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""CCB3A0B833E4CF6C_5CE96647E581897C_6039_UN""","""COC(=O)C(OCC(NC1=C(C=CC(=C1)F)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7BE570655164F1FE_AC04800F51FD4E65_6039_UN""","""COC(=O)C(OCC(NC1=CC=CC(=C1C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""1E4359F816A37229_23441A08C8C38226_6039_UN""","""COC(=O)C(OCC(NC1=C(C=CC(=C1)C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""BBCC2068B4A06C46_C691F3B2B13323D5_6039_UN""","""COC(=O)C(OCC(NC1=CC(=CC(=C1)C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1905E240CA1DC8FF_9F278F5C1CCB9053_6039_UN""","""COC(=O)C(OCC(NC1=CC(=C(C)C=C1)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F11C9B65CB13A072_C8E3B977AC91F948_6039_UN""","""COC(=O)C(OCCCC(C1=CC=C(F)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""2ED9FFDB0D841A91_C3469B57B800B805_6039_UN""","""COC(=O)C(OCCOC(=O)NC1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""862638B5F9F60736_EE018C6AA63BE3DD_6039_DP""","""COC(=O)C(OCCOC1=C(C(O)=O)C=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""ADA0469346291F16_5E9DF8AA52729D24_6039_UN""","""COC(=O)C(OCC1=NN=C(S1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""897604F5ED5656E9_E1BA554EC24F8334_6039_UN""","""COC(=O)C(OCC1=CC(=NC=C1)OCCOC)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""5B2AD84D1E17C5D3_E189273119854B08_6039_UN""","""COC(=O)C(OCC(=O)N1CCC2=C1C=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""37C900077F25CDEE_37287E697145B9D7_6039_UN""","""COC(=O)C(OCC1=CC=C(C(C)(C)C#N)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""7533977AEB860F25_71DC406054A9DC90_6039_UN""","""COC(=O)C(OCC(=O)N(CCC#N)CCC#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""FB0ADD293E4778AE_9AAAC4CA13874B98_6039_UN""","""COC(=O)C(OCC(CC1=CC=C(OC)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E7DFE8A1641F1A3C_DD5353C436215F9C_6039_UN""","""COC(=O)C(OCC(C1=CC=C([N](=O)=O)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""4F8E73412202F485_B3CD5142193AFFC9_6039_UN""","""COC(=O)C(OCCC[S](=O)(=O)C1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3649F1D4C09AB278_8C9420B06DD59B9E_6039_UN""","""COC(=O)C(OCC1=CC(=NO1)C2=C[N](C)N=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""2D8B3EC8B7196A58_BCA6114616A80CC5_6039_UN""","""COC(=O)C(OCCCN1CCN(C(C)C)CC1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""0D667A0CF56C3407_102652439A000F0B_6039_UN""","""COC(=O)C(OCC1=CC=C(C(C)C(=O)O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""06194DFE6F8C209D_D7E0341703617E01_6039_UN""","""COC(=O)C(OCC1=C(C(OCC)=O)C=NC=N1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C649491645114699_3833AC7E2B7F714E_6039_UN""","""COC(=O)C(OCC1=CC=C(C=C1)C2=CC=CS2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""661F8908EFADD165_A95745479E6A5B83_6039_UN""","""COC(=O)C(OCC1=CC=C(C=C1)OCC2CC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1A05A1A344EB1C85_F4716EDA04F9534D_6039_UN""","""COC(=O)C(OCC1=NC=C[N]1C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6792200106BCCF04_C40B3A4610EAE78A_6039_UN""","""COC(=O)C(OCC1=NC(=CS1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""554E0FE9DC462326_AF9C732E80E5C68F_6039_UN""","""COC(=O)C(OCC1=NC(=CS1)C2CCCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""004C29A05E2CADC0_86A8294AB802E276_6039_UN""","""COC(=O)C(OCCCC2=NC1=C(C=CC=C1)[NH]2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""DA1AD19877FA094C_BE7DBFD5F149B97E_6039_UN""","""COC(=O)C(OCCCC1=N[N](C)C=C1C(=O)O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1755C9ECFD3C0F20_5F17B4298C64BD04_6039_UN""","""COC(=O)C(OCC1=NN=N[N]1C2CCOCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""335E023EDF37FF5F_D2A62796CBC38F93_6039_UN""","""COC(=O)C(OCC(N(C)CC1=CC=CC=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""60B16AF06D3D0805_18667DB6A3758F6C_6039_UN""","""COC(=O)C(OCC[S](=O)(=O)CC1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5D0CD5B380AE9FA6_0B3FFA9BD6C85FED_6039_UN""","""COC(=O)C(OCC(=O)C1(CC1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""EA7A0F666DFAE2D9_7A04C9E7E0D7E583_6039_UN""","""COC(=O)C(OCC1=NC(=N[NH]1)C2=NC=NC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""B4FF4E787422A905_DEFDA009D6D89E89_6039_UN""","""COC(=O)C(OCCCB1OC(C)(C)C(O1)(C)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""0FAFD7C51D6171D2_B465490466CABFF7_6039_UN""","""COC(=O)C(OCC(C1=CC=C(CCC)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""B227654DF7172106_0CD116C26CA477DF_6039_UN""","""COC(=O)C(OCC1=CC=C(C(CC)(C)C)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""0CCF31CF349374B6_EDC5E947BF6851DB_6039_UN""","""COC(=O)C(OCC2=CC1=C(OC(F)(F)O1)C=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D48D02058157D901_CE55FA67F9A106B1_6039_UN""","""COC(=O)C(OCC(C(CC)(CC)C(=O)OC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7E41D66EE43AFCC4_F6CAED141E97BA33_6039_UN""","""COC(=O)C(OCC1=CC=CC(=C1)OCC(C)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""9E20A388DB17C44B_B1AC62BDC76566DA_6039_UN""","""COC(=O)C(OCCC(C1=CC=C(OC)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F70FCFCBD6E3B12D_C2352E0CE97A7846_6039_UN""","""COC(=O)C(OCC(N[C@H](C(OC)=O)C(C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""974107CBDF36837E_EEF768892D3AF489_6039_UN""","""COC(=O)C(OCC1=CN=N[N]1C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""AEBC55D258844CA3_83875F8A88FBF231_6039_UN""","""COC(=O)C(OCC1=N[NH]C(=C1C(OCC)=O)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E76F4BF452193075_607769F408F349FE_6039_UN""","""COC(=O)C(OCC1=NOC(=C1C(OCC)=O)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""856F052B007D2734_D5B4EAEBED02365D_6039_UN""","""COC(=O)C(OCC1=C(C=CC(=C1)C)OC(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""059D132C72FCBD24_1C9E6E5C1C401E89_6039_UN""","""COC(=O)C(OCC(OC(C)C)C1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D66AC1979462FFA0_EADDAAB841E615EA_6039_UN""","""COC(=O)C(OCC1=C(CC)N=C(C=C1)C(C)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""52621B6795B9BFF9_0DE86C1C501B8FBD_6039_UN""","""COC(=O)C(OCC(=O)NCCC1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D473B55F232A3C26_C8A4974CE861DD30_6039_UN""","""COC(=O)C(OCC(NC1=C(OC)C=CC=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""04D379F6BE67F38F_50CC8E0988D6AB3A_6039_UN""","""COC(=O)C(OCC1=CC=C([S](CC)(=O)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""9A250BA3EBFC1FCD_DE300C92E8ED625B_6039_UN""","""COC(=O)C(OCC(=O)NC1=CC=C(C=C1)C#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""09F5608F6FA4050C_DFADF9DE3530291C_6039_UN""","""COC(=O)C(OCC1=C([N](=O)=O)C=CC=C1C#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""BEBA9E7A62B93FB7_8AC30973AABC1CF8_6039_UN""","""COC(=O)C(OCC1=NN=N[N]1C2CCCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""61D57C57E10A7985_709C71BCCBC91295_6039_UN""","""COC(=O)C(OCCN2N=C1C=CC=CN1C2=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""65F3210DC3102790_019BD5C276B1D67A_6039_UN""","""COC(=O)C(OCC2=CC1=C([N](N=C1C)C)N=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3EDC211C9A054184_59FB6575EC1FB551_6039_UN""","""COC(=O)C(OCC2=C1N=CC=CC1=C(F)C=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""B45ED6C71A0C5EFC_CFEB6AF1C06A2F21_6039_UN""","""COC(=O)C(OCCCOC1=C(C)C=CC=C1C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6B0462F308E5CC7E_5F34A0100EBD6D82_6039_UN""","""COC(=O)C(OCC(C1=C(OCC)C=CC=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""CA9C69C762C3D2DA_BBC46FC6F13D5044_6039_UN""","""COC(=O)C(OCCCOC1=CC(=C(C)C=C1)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""50CA2485252A93F0_EA1B094B43A56C7C_6039_UN""","""COC(=O)C(OCC(N(C)CC1=C[N](N=C1)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""774593D054CCB250_23DD86F2A98699B5_6039_UN""","""COC(=O)C(OCC(N(C(C)C)CC(F)(F)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""157DCBF55E0E4C0F_0508D4D61FB7B6E2_6039_UN""","""COC(=O)C(OCC(NC(CCCCCC)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7CC1B9F7ADC1A3DC_3CD7AE0FE1D4F9E8_6039_UN""","""COC(=O)C(OCC1=CN=C(C(OCC)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""81529D4D68F69A39_B9398DA1C468269B_6039_UN""","""COC(=O)C(OCC(C(C)(C)C1=CC=CC=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""17B46FACE65D7FD4_87E9DE977982ED2B_6039_UN""","""COC(=O)C(OCC1=C(OC)C=C(C=C1)[N](=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""CE809E15A08289CE_0D04C720C233BC23_6039_UN""","""COC(=O)C(OCC1=CC=C(C=C1)N2CCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""65574E736B044377_9F3177BF2A45FA43_6039_UN""","""COC(=O)C(OCC(C1=CC=C(C(OC)=O)O1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""CAAC053FB10EC586_BCE2B02778864FE5_6039_UN""","""COC(=O)C(OCC(C(C1=NC(=CS1)C)C#N)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E17B54DE66FB8E50_99F87BC18A6FA348_6039_UN""","""COC(=O)C(OCC1=CC2=C(C=C1)OC(C)(C)C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""8CA30ECC55D0F415_E0CBDB2E19F830CF_6039_UN""","""COC(=O)C(OCC(=O)NC1=NC(=NO1)C2CC2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""FAC3EF83F3A29F1A_D8FD0564CFA09247_6039_UN""","""COC(=O)C(OCC1=CC=C(C=C1)[N]2C=CC=N2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D686564D4E37080D_DFF1A71A28C10ECA_6039_UN""","""COC(=O)C(OCC1=NC(=NO1)C2=NC=NC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""31FE7FE0DEF0F857_81811DDDC0234EF6_6039_UN""","""COC(=O)C(OCC1=CSC(=N1)C2=NC=CC=N2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7CCA902B5543A749_21210A464D10FA25_6039_UN""","""COC(=O)C(OCC(N(C(C)C)C1CCCC1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""29EC684BC3471F10_8C41B091361019A9_6039_UN""","""COC(=O)C(OCC(NCC(NC(C)(C)C)=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D8DB2985AA14FA8C_BECCE08B92865D4A_6039_UN""","""COC(=O)C(OCCCCCCCCCC(O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3EA495730EF3799A_84D112986380C783_6039_UN""","""COC(=O)C(OCCC(C1=C(C=C(F)C=C1)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""46F7B366DCCD7EA9_97C0608C48E292C0_6039_UN""","""COC(=O)C(OCC1=C(C(=C(F)C(=C1F)F)F)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""4B3FAC00E6FFBF45_F6C357F17E51CA36_6039_UN""","""COC(=O)C(OCC1=NC=C(C(OCC)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""2400788A7CE38A58_659F96F7D6793169_6039_UN""","""COC(=O)C(OCC(C1=CC(=C(C=C1F)F)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""66E5FE2A3FBF103D_F872D6D04CB5262E_6039_UN""","""COC(=O)C(OCC1=C(C(OC)=O)C=CN=C1F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5418740D278371C8_5A51E2E2F6FDCB52_6039_UN""","""COC(=O)C(OCC1=C(C=C(C(OC)=O)C=C1)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E293EA2640E4BF51_D32466BD3422F978_6039_UN""","""COC(=O)C(OCC2=NC1=C(C=CC=C1)NC2=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""65CF3B3564EA3308_598EAD234624A930_6039_UN""","""COC(=O)C(OCCOC1=C([N](=O)=O)C=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E88F3635E73A5970_043796F2C2FEBF1F_6039_UN""","""COC(=O)C(OCC1=NOC(=N1)C2CCOCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""11FA22595FBFF23D_266CF91064211439_6039_UN""","""COC(=O)C(OCC1=NC(=CS1)C2=CN=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""290532892B763978_9BF32B500B7C9899_6039_UN""","""COC(=O)C(OCC(NC1=C(F)C=CC=C1F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3067B5E4F10B1420_F605BF5701C98DB9_6039_UN""","""COC(=O)C(OCC1=CC=CC(=C1)OC(F)(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D701488F6D9825A7_453823E4F006FAE1_6039_UN""","""COC(=O)C(OCCC=CC1=CN=CC(=C1)OC)C(C)C""",21,"""39BFC05C18580BC7"""
-"""942FBFE207614023_E16E2E03F107B036_6039_UN""","""COC(=O)C(OCCOC(CC)C1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""12A6D968F1C1FCBF_FB2F99F623CC26FD_6039_UN""","""COC(=O)C(OCC1=C([N](=O)=O)C=C(C=C1)C#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6D95AB0FB2BCACB1_B8697B5D4524D3FB_6039_UN""","""COC(=O)C(OCC1=C(OC)C=CC(=C1)C(C)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""752FB775F5F6A17D_A08BA3784BA4DC07_6039_UN""","""COC(=O)C(OCC1=CN=C([N]1C)SC(F)(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""02902C677D026587_897E929DD3A1FA49_6039_UN""","""COC(=O)C(OCC1=C(OC(F)F)C=CC(=C1)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3DDE443C45CFB792_DE44B137C153E200_6039_UN""","""COC(=O)C(OCC1=CC=C(C[S](C)(=O)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""484178484ECDDD5F_D0CED8DAFD3A5511_6039_UN""","""COC(=O)C(OCC1=CC=CC2=C1OC(F)(F)O2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""3D437CA839B14701_4FE4C7CF7E2FF801_6039_UN""","""COC(=O)C(OCC2CN=C(C1=C[N](C)N=C1)O2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D0FC2588A3D24F03_00800587E6E4C8F5_6039_UN""","""COC(=O)C(OCC(COC1=CC=C(F)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F488D352BB40B6D6_8DF56833CF9843CB_6039_UN""","""COC(=O)C(OCC2=NC1=C(C=CC=C1)C(=O)N2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""42B3D0B617BC376A_61670DBEB49D9B5A_6039_UN""","""COC(=O)C(OCC1=NC(=NO1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3F1DC34B867B896E_F990EBC89C3E47B0_6039_UN""","""COC(=O)C(OCC1=CC=C([S](NC)(=O)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""4D3EBBDAE57651F6_693A97570387BF3B_6039_UN""","""COC(=O)C(OCC1=NN=C(O1)C2CCCOC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E60A3AD35CBFF863_7C52078AE01E4D32_6039_UN""","""COC(=O)C(OCC(N[C@H](C)C1=CC=CC=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C6F352F69B9B95D6_E60A47545558CAC3_6039_UN""","""COC(=O)C(OCC1=CN=C(O1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""16758578418B09E7_F402E602E6CF1C17_6039_UN""","""COC(=O)C(OCC(CCNC(C(F)(F)F)=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F316F35ADEB95602_E10ACE1EEF413726_6039_UN""","""COC(=O)C(OCC(N(CCC)CC(F)(F)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""DD4306065E202986_7B21659F9A03ADE2_6039_UN""","""COC(=O)C(OCC(C1=CC=C(C(OC)=O)S1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""64A36EA6F86EC6FE_B03EE061D479D1C7_6039_UN""","""COC(=O)C(OCCN(C)CC1=CC=C(C=C1)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5D5696AD7150A710_23DEA466B837D605_6039_UN""","""COC(=O)C(OCC2=CC1=C(OC(N1C)=O)C=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D8DC015F5EAA4E5C_29FDFF53B007C3D5_6039_UN""","""COC(=O)C(OCC1=CC=CC(=N1)C(OCC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A4D94DD2D1AC08CE_E4DEB1079419986B_6039_UN""","""COC(=O)C(OCC1=COC(=N1)C2=NC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""33D34677D61BA9C2_0A9F80147F24F783_6039_UN""","""COC(=O)C(OCC1=COC(=N1)C2=CC=NC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A09E399FDFC5AD37_8EFA7B906FEAD2C5_6039_UN""","""COC(=O)C(OCC1=NC(=NO1)C2=CN=C[N]2C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""26ED74AA61E1620D_5C6AFE511DFABEB9_6039_UN""","""COC(=O)C(OCC2=NC1=C(COCC1)C(=O)N2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""DEC9F0982A118C71_543F6615FE552EC3_6039_UN""","""COC(=O)C(OCC1=CNC(=O)C2=C1C=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""2B5AB839FB224E93_1A0C18EE6F5E7C37_6039_UN""","""COC(=O)C(OCC1=NOC2=C1CC(C)(C)CC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D5CEB07BD3B0A6C3_8CB98EEB01BEECC4_6039_UN""","""COC(=O)C(OCC1=CSC(=N1)C2=N[N](C)C=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E795FC5000E0C2A6_7A966D975C8B39EE_6039_UN""","""COC(=O)C(OCC1=NN=C2[N]1C=CN(C)C2=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""586EB04616527D92_C60E50D150933AEE_6039_UN""","""COC(=O)C(OCC2CCC1(CCOCC1)CO2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""86CC1CEBBEC3E0A7_C4A520966929258F_6039_UN""","""COC(=O)C(OCC2OC1=C(C=C(OC)C=C1)C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""DFDA681A37952F05_96F772301D135F49_6039_UN""","""COC(=O)C(OCC(NC1=CC=CC(=C1)CC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""93AD07AEFAEC2B1A_7FEE8E5278B1D286_6039_UN""","""COC(=O)C(OCC(NC1=CC=CC(=C1)SC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3A9728132946FB09_EF5B8358F4475D84_6039_UN""","""COC(=O)C(OCCCC[S](NC(C)(C)C)(=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F437763B89BAC1DE_AE07B72F889BBB94_6039_UN""","""COC(=O)C(OCC1=CC=C(C(N(C)C)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""0F93A6AAA6ACBC4F_429D45290F576445_6039_UN""","""COC(=O)C(OCC(N1CC(C)OC(C1)(C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""0C91C34542F18E5E_F27B39F55C85D079_6039_UN""","""COC(=O)C(OCC(C1=CC=CC(=C1)[N](=O)=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""08D46D32EA7EE979_3AD5D688548B74D3_6039_UN""","""COC(=O)C(OCC1CCC(O1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C5A2843FCF6EFEA0_5AC3242052541414_6039_UN""","""COC(=O)C(OCC1=C[N]2C(=N1)N=C(C)C=C2C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""EE9A3C5EED6B2285_BDC783B032299E9F_6039_UN""","""COC(=O)C(OCC(NC1=C(C)C=CC=C1C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E31FC35F5DB4341F_A04F82CB9EFA4293_6039_UN""","""COC(=O)C(OCC1=C(C(=C(C)C(=C1C)C)C)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""61B11D1784F50F11_0C966A7917C13939_6039_UN""","""COC(=O)C(OCC1=C(OC)C=CC(=C1)C(=O)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3A473BA3C02A1E7D_E2887843A52F3918_6039_UN""","""COC(=O)C(OCC(=O)NC1=C(C=CC=C1)C#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""80982B6485AE34EC_692F0CAFEE3C8D11_6039_UN""","""COC(=O)C(OCC(NC1=CC=C(CC)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""AD05E33C0B2FF083_ACA44A0C80001BF0_6039_UN""","""COC(=O)C(OCC(N(CC)C1CCCCC1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""26FEA25327448AD2_182F08DAC77A62FA_6039_UN""","""COC(=O)C(OCC(N(CC)C1=CC=CC=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""FB206ACF70274E22_E192DED436A8979A_6039_UN""","""COC(=O)C(OCC(N1CCC(C(O)=O)CC1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""A5FA3DC46CC75033_D65AB17F933A7A41_6039_UN""","""COC(=O)C(OCCC2C1CC3CC(C1)CC2C3)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F4975A95475DE2F5_6536D30220E5764A_6039_UN""","""COC(=O)C(OCCOC1=CC2=C(C=C1)OCO2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C28FB4F9D4D4074A_DE9983F082384FBA_6039_UN""","""COC(=O)C(OCCC1=CC=CC(=C1)C(F)(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5A157CBC71C236E4_4A35724E6E2E74AF_6039_UN""","""COC(=O)C(OCCC1=CC=C(C(F)(F)F)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""71C5DB950ED343FE_459D8F7EBD4F98A6_6039_UN""","""COC(=O)C(OCC2=NC1=C(C=CC(=C1)OC)[NH]2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D3EFE4956B018756_8773C76A1223ED30_6039_DP""","""COC(=O)C(OCC1OC(CC12CCNCC2)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F97481FF10CF6A80_A4D4A4D75E1DAA03_6039_UN""","""COC(=O)C(OCC1OC(=O)CC12CCOCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3F94A810B1665B46_2C4FE344C33D1748_6039_UN""","""COC(=O)C(OCC(=O)NC1=CC=C(C=C1)C#C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""463E6DE5F57F4EC5_50F2BCF77C7F3B76_6039_UN""","""COC(=O)C(OCC1=C(C)C=CC(=C1)[S](=O)(=O)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6D20D23D9CA57317_F2E0D40F9DA35316_6039_UN""","""COC(=O)C(OCCCCCCCCCC1CC1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D3518A8A115090F0_7D4692D9A05EC7D8_6039_UN""","""COC(=O)C(OCC1=C(C)C=CC(=C1)[S](=O)(=O)Cl)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F92F389DF0A7C74C_64483CB839145259_6039_UN""","""COC(=O)C(OCC2CCC1(CCCCCC1)O2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F5E42D70D4F773F2_538099E9E79F0A68_6039_UN""","""COC(=O)C(OCC(=O)CCCC1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C4D92C426CC4E086_C67BD9C26CA71138_6039_UN""","""COC(=O)C(OCC1=CC(=C(OC)C=C1)C(=O)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""792E682BE6510565_436DF49580880870_6039_UN""","""COC(=O)C(OC[C@@H]1CCC[C@@H](C(OCC)=O)O1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""4F76E7B4D3A99BBB_623FAAA1AF0ADD97_6039_DP""","""COC(=O)C(OCC2CCC1(CCNCC1)CO2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E968D4031421BE3E_A6511B15596B8C30_6039_UN""","""COC(=O)C(OCC1=N[N](C=C1)C2CCCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""492CF7B6BCF6CD9A_E27D1FBD602622F9_6039_UN""","""COC(=O)C(OCC1=CSC(=N1)COCC(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""358B854B74DDA100_0ED98CE403B1A45F_6039_UN""","""COC(=O)C(OCC(C1=CSC(=N1)C(C)(C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""558C6EA43DD4A1ED_4ECBDDF8D1893E31_6039_UN""","""COC(=O)C(OCC2CC1(CCOCC1)C(=O)N2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""DAB4125BA4DBE841_EBA05ADC9023C0B8_6039_UN""","""COC(=O)C(OCC(=O)NC(=O)C1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""8C93FA5EDB44774E_803B496F87D24522_6039_UN""","""COC(=O)C(OCC(=O)NCCC[N]1C=CC=N1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""87A1F8F0EB3085C6_4B7909233C2D54AB_6039_UN""","""COC(=O)C(OCC1=CC(=C(C=C1)[N](=O)=O)OC)C(C)C""",21,"""39BFC05C18580BC7"""
-"""54370176040A1E9F_DF02AB8A6B5986E7_6039_UN""","""COC(=O)C(OCC1=CC=C(N[S](C)(=O)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""62E511296F0BB242_54F9A83758723310_6039_UN""","""COC(=O)C(OCC1=NN=N[N]1C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""890553B0F47119A3_892D23562F3DF624_6039_UN""","""COC(=O)C(OCC(C1=C(OC)C=CC(=C1)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""7EEBE016B3AFE664_3D7A9E34BC8EF701_6039_UN""","""COC(=O)C(OCC(=O)C2=CC1=C(C=CC=C1)O2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""42EDFBC5DB70190E_DBB50024E7F28BFB_6039_UN""","""COC(=O)C(OCCOC1=C(C(C)=O)C=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""388E02316CC71C08_B0CCB9FAF8EA6EF6_6039_UN""","""COC(=O)C(OCC=NNC(=O)C1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""2F941D1676984EFA_18C7CAE07CBE85D0_6039_UN""","""COC(=O)C(OCC(NC1=CC=CC(=C1)OC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D3DADF3B3C2DC4FB_55679A7B7DCE6FFF_6039_UN""","""COC(=O)C(OCCC(=O)NC1=C(C=CS1)C#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""9E032B445C4E60AA_07D9AD4D9519325A_6039_UN""","""COC(=O)C(OCC(N(CCCC)C(C)CC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""46DABBDC33C889DF_C44396ADAD882081_6039_UN""","""COC(=O)C(OCC(NCCCC(OCC)=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""AC5A862C179847D8_C15227FBCA78453F_6039_UN""","""COC(=O)C(OCC1=CC=C(C=C1)[N]2C=NC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F4D9987C6317AB52_B16737CE2C3F2879_6039_UN""","""COC(=O)C(OCC1=CC=C(OC(F)(F)F)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D9CC7B44E62372F6_72BDAF1F8D5CE628_6039_UN""","""COC(=O)C(OCCCOC1=C(C=CC(=C1)C)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F35A67E91162DAC8_FF87D9DFA9D358E3_6039_UN""","""COC(=O)C(OCC(NCC1=C(C)C=CC=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3D5E80DD771FEC5E_7AFA028E3FC40892_6039_UN""","""COC(=O)C(OCC1=CC(=C(C(OC)=O)C=C1)C)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""9D6C2FA4FB6BCF3F_863FD4FD724A7EAA_6039_UN""","""COC(=O)C(OCC(NC1=C([N](N=C1C)C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E4742C03BC23CB09_A849208AC3BDCD60_6039_UN""","""COC(=O)C(OCC1=NN=C(O1)C2CCOCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7B1CFB0A892574FA_6054643CC863EBC4_6039_UN""","""COC(=O)C(OCCC(C(F)F)N1CCOCC1)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""29F6F6BCCE8FBE6E_5BE913171994E9E1_6039_UN""","""COC(=O)C(OCC1=CC=C(C=C1)C2CCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""19807672DE6AFD13_59AB88E6D80C38F1_6039_UN""","""COC(=O)C(OCC(=O)C2=CC1=C(C=CC=C1)[NH]2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""96D20D7DA1F881AE_8098929AC5E48B49_6039_UN""","""COC(=O)C(OCC(=O)C1=CN=C2[N]1C=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D00845F4FAEB8916_F88B0E34588EA44C_6039_UN""","""COC(=O)C(OCC1=NN=C([N]1C)C2=CC=CS2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""900EA37380386A52_C9FEAFFED43E8A21_6039_UN""","""COC(=O)C(OCC(=O)C1=CC2=C(C=C1)OCO2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""EBB9AE5B0B15540F_D87ECAC22B3D9EC7_6039_UN""","""COC(=O)C(OCC1=CC=CC2=C1OC(C)(C)C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""80FC7524F4BE68D3_1713C7B1948AB43B_6039_UN""","""COC(=O)C(OCC1=CC(=C(C=C1)C)C(OC)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F82597CF2A4858B2_27F9D90140AC4B9C_6039_UN""","""COC(=O)C(OCC1=NC=N[N]1C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E86C6B80EF60A81F_3426795FC74BE678_6039_UN""","""COC(=O)C(OCC2=NC1=C(C=C(OC)C=C1)S2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""7B194EE0DD360500_4DDBBE8F276277D5_6039_UN""","""COC(=O)C(OCC1=NN=C[N]1C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""C17179CFEEC1B81F_C50B431D15884593_6039_UN""","""COC(=O)C(OCC1=CC=CC(=C1F)C(F)(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""287DFA4785F6D138_50802D4E42E63E71_6039_UN""","""COC(=O)C(OCC1=C(C=CC(=C1)F)C(F)(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""87D42C1DD011E735_13F6A3C0CB3DFED0_6039_UN""","""COC(=O)C(OCCC1=CC=C(NC(C)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""8EBDA4DA3D5269A4_884BB95060017A84_6039_UN""","""COC(=O)C(OCC1=CC(=C(F)C=C1)C(F)(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""42892EF4F9FE447D_2FAD69A5CA267702_6039_UN""","""COC(=O)C(OCCC1=CC(=C(OC)C=C1)OC)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C3C1C32DBB5D7817_886404F93EAA28D9_6039_UN""","""COC(=O)C(OCC1=CC=C(O[S](F)(=O)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3ED039DE7265CAF7_515994C240DCC36F_6039_UN""","""COC(=O)C(OCCC1=CC=CC(=C1)NC(C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""23D0E8EFA6A98156_ACE97519D3B615F0_6039_UN""","""COC(=O)C(OCC1=C(C)C=C(C=C1)C(F)(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D5B125D980CCDD15_9D6BB0E061C77DC8_6039_UN""","""COC(=O)C(OCCC1=C(C(F)(F)F)C=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""59128D1D340C174C_A8F56968EEAEACD0_6039_UN""","""COC(=O)C(OCCC1=C[N](C)C2=C1C=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E7AF4ECF1B3BB4DC_EAFFF3C3C4F372E4_6039_UN""","""COC(=O)C(OCC(=O)NCCCCCN=[N]#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""01EDF01F5EDE7193_8839A9DABEAD453B_6039_UN""","""COC(=O)C(OCCC1CCCC(C(F)(F)F)C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""B1347A00102865AD_77D343FA2F233F17_6039_UN""","""COC(=O)C(OCC1=CC=C(C=C1)C2CC(=O)C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C63D97DE113D9AC6_C5209CA9855FCE5F_6039_UN""","""COC(=O)C(OCC(C1=CSC=C1C(OC)=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C6D4023A86099128_AF4F01DE9EFB3ECE_6039_UN""","""COC(=O)C(OCC(=O)C2=C1C=CC=C[N]1C=N2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""98757A8A62147BC9_7DD7C7C6791DDBFA_6039_UN""","""COC(=O)C(OCC1=C(C(=N[N]1C)C)[S](=O)(=O)Cl)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""957EFF597111F4F7_D2472917C15ECE09_6039_UN""","""COC(=O)C(OCC1=NN=C(O1)N2CCCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""044CBCACB8E6518E_E86A432F32017FCD_6039_UN""","""COC(=O)C(OCC1COC(O1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""FC975BB72F42AD01_3923B126270022BC_6039_UN""","""COC(=O)C(OCC1=NN=C(O1)N2CCOCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E7F27E2E57EB07B8_8275DB3A3A804E60_6039_UN""","""COC(=O)C(OCC1=CC=C(C=C1)C2=NC=CO2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3493CEF6035DDCBE_5E3ABAC95DABC23B_6039_UN""","""COC(=O)C(OCC1=N[N](CCC(F)(F)F)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6E0913782F73BA20_A5D4F9A1A32031DA_6039_UN""","""COC(=O)C(OCC#CC1=CC(=CC(=C1)F)C#N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""2EDEE0290431537B_9978B1CF95E84921_6039_UN""","""COC(=O)C(OCC1=CC(=N[NH]1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""5F07694731880E95_D7CDCFE87E60DFCE_6039_UN""","""COC(=O)C(OCC1=CC=CC(=C1)SCCCC)C(C)C""",21,"""39BFC05C18580BC7"""
-"""82B1174EBF172C1D_F9D26614852949D9_6039_UN""","""COC(=O)C(OCC2=CC1=C(N(C)C(=O)S1)C=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""08992E862667549F_A2D539F894F3AA97_6039_UN""","""COC(=O)C(OCC1=CC=CC(=C1)CCCOC)C(C)C""",21,"""39BFC05C18580BC7"""
-"""D007A7E2083EE2E1_F783C58F2997A9F1_6039_DP""","""COC(=O)C(OCC1=CC(=NO1)C2CCNCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""21FDF5CFEC7A87C3_D8058D1C077B3B82_6039_UN""","""COC(=O)C(OCCC(C(F)F)C1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""30AA1AF66FD120B9_48ED75ED14ECAA01_6039_UN""","""COC(=O)C(OCC1=CC=C(CNC(C)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""3F786D4D14166497_8E7DDD3F504E0F03_6039_UN""","""COC(=O)C(OCC1=NC=C(O1)C2CCOCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""F531DEE2B0DFF363_859FE0C4952C6DF4_6039_UN""","""COC(=O)C(OCCCCO[S](C(F)(F)F)(=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""B87C6C36D669490D_5DC0D5813A8FF4C1_6039_UN""","""COC(=O)C(OCC(N=[S](N(C)C)(=O)N(C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C5A0F154194D7B5A_C26299CDF0D17445_6039_UN""","""COC(=O)C(OCC2=CC1=C([N](CC)N=N1)C=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6BD46F03F8B664EB_DA948FB537AA7416_6039_UN""","""COC(=O)C(OCC1=CC=C(NC(OC)=O)C=C1)C(C)C""",21,"""39BFC05C18580BC7"""
-"""E2F4400AB9035432_F9ABF3D428FAFF15_6039_UN""","""COC(=O)C(OCC1=CN=C(C(OC)=O)C=C1C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""70689BFE2D08D374_B76F26656DEA4458_6039_UN""","""COC(=O)C(OCC1=N[N](C=C1C(OCC)=O)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""6061A41A86B6D992_8A71117BBC928491_6039_UN""","""COC(=O)C(OCCC1=NOC2=C1C=CC(=C2)F)C(C)C""",21,"""39BFC05C18580BC7"""
-"""7AEFB802EFE6DE23_D1E557682ABC258D_6039_UN""","""COC(=O)C(OCC(=O)N2CC1=C(C=CC=C1)C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""AB87C4F53F737910_4532422031AF3ABD_6039_UN""","""COC(=O)C(OCC2=CC1=C(N(C)C(=O)O1)C=C2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""98E9011F8B607170_DAC57ECF4B2C62C8_6039_UN""","""COC(=O)C(OCC1=CC(=NC(=N1)CC2CC2)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""078BDDE0EB504B37_E1FAE8AAC9F9AC51_6039_UN""","""COC(=O)C(OCC1=CC(=NC(=N1)C2CCC2)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""FFC283C2CB8DD7A7_AC4DBC48158AE6CD_6039_UN""","""COC(=O)C(OCC1=CC(=NC(=N1)C(F)(F)F)C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""1E08EE91E12D45E3_832764343AC88453_6039_UN""","""COC(=O)C(OCC1=CC=N[N]1C2CCCCC2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""73BC940C93899F66_CB3A7DD39F375A8C_6039_UN""","""COC(=O)C(OCC(C1CCN(C(C)=O)CC1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""869E431F6EDB8A16_DC1F5069417851EE_6039_UN""","""COC(=O)C(OCC2CC1(CCOCC1)C(=O)O2)C(C)C""",21,"""39BFC05C18580BC7"""
-"""B16610BF2CC5E54F_2C13E3BFE9BD4220_6039_UN""","""COC(=O)C(OCC1=C(C(=N[N]1C)C)[S](=O)(=O)N)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C6C86D393C33DD5D_9C87C05B7805E6A4_6039_UN""","""COC(=O)C(OCC(C(CC(OCC)=O)(C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
-"""DEC6B20997CC569A_0662827D482344D9_6039_UN""","""COC(=O)C(OCC1=C(C(OCC)=O)C=N[N]1C)C(C)C""",21,"""39BFC05C18580BC7"""
-"""C5FCE53A56C712ED_899EAE3FBE2117C8_6039_UN""","""COC(=O)C(OCC[N]1N=C(C(OC)=O)C=C1C)C(C)C""",21,"""39BFC05C18580BC7"""
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-"""16FEBBC44601FC26_3F45DF8422CE722A_6039_UN""","""C[C@@H](OCC(C1=CC(=C(OC)C=C1)OC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
-"""D2363256128A7DB1_E30D155959E20700_6039_UN""","""C[C@@H](OCC(NC1=NN=C(CC(C)C)S1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
-"""E8CD67ABB4BC16C6_FD35AA78E71DC84D_6039_UN""","""C[C@@H](OCC(C1=CC=C(CNC(C)=O)O1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
-"""79A7778DF40354A1_2D163F5CE24DF680_6039_UN""","""C[C@@H](OCC(C1=C(C)[N](C(=C1)C)CC=C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
-"""C46686214DF78106_79AC60421AD66342_6039_UN""","""C[C@@H](OCC(C1=C(C)[NH]C2=C1C=CC=C2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
-"""D26598EDA5B506F3_B2204DDEE866EB2B_6039_UN""","""C[C@@H](OCC(C1=C(C=C(OC)C=C1)OC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
-"""75A16063E8CA0F78_46C2803E8FC991E7_6039_UN""","""C[C@@H](OCC(=O)NNC(=O)C1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
-"""ED1BD3914E116FFE_E6C3293569EAA376_6039_UN""","""C[C@@H](OCC(C1=CC=C(CCCC)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
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-"""1B0A8CD70A4DA570_D58B745FC4C0C598_6039_UN""","""C[C@@H](OCC1=CC=CC(=C1)SC(N(C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
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-"""51929A63153D86CC_FAAA01ABDFC7A487_6039_UN""","""C[C@@H](OCC1=CC(=C(C=C1)[N](=O)=O)OCC)C2CCCC2""",21,"""B570B1CB70EF998E"""
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-"""54CD84575C819614_E885EE146AF35230_6039_UN""","""C[C@@H](OCC1=NC(=CS1)C2=CC=C(C)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
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-"""988228029B791E16_978A0D878AFBE321_6039_UN""","""C[C@@H](OCC(C1=NC=C(C(F)(F)F)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
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-"""27574B71C32D11FE_3148CF128FCBE744_6039_UN""","""C[C@@H](OCC1=C(OC(O1)=O)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
-"""1D543849636A1CE1_0292F1A81D4BF464_6039_UN""","""C[C@@H](OCCC2NC(=O)C1=C(C=CC=C1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
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-"""23E0AA0607A13035_881FAB5AD4EB8B67_6039_UN""","""C[C@@H](OCC(C1=C([N](CCC)C(=C1)C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
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-"""665F0F8D1AFA44CB_26E4EAA0CB74E840_6039_UN""","""C[C@@H](OCC(N(C)CC1=CC=C(C=C1)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
-"""2D38B448CA46BF3C_DC6DBC183433B4BB_6039_UN""","""C[C@@H](OCCCC1=CC=CC(=C1)C(F)(F)F)C2CCCC2""",21,"""B570B1CB70EF998E"""
-"""441750EF5AB70827_35366F4D02840FC8_6039_UN""","""C[C@@H](OCC(C(=C1C=CN(C)C=C1)C#N)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
-"""427206FFAA9C3881_801DFD80B431857B_6039_UN""","""C[C@@H](OCC(C1=C[N](C)C2=C1C=CC=C2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
-"""44474B7833BE5646_A51934FB638D1545_6039_UN""","""C[C@@H](OCCOC1=CC2=C(C=C1)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
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-"""79AAFB7406A80768_C0408D5679559853_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C([S](N)(=O)=O)C=CC=C2)=O""",21,"""5EF32745EFF65DC8"""
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-"""13E7509423A33802_F4D8633E233D1941_6039_UN""","""O(C[C@H]1CCCO1)CC2=NN=C(O2)C3=CC(=CC=C3)C#N""",21,"""5EF32745EFF65DC8"""
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-"""B4B6C5D432C470D9_4E4523F4877E6A20_6039_UN""","""O(C[C@H]1CCCO1)CCCCN(C)CC2=CC=C(C=C2)F""",21,"""5EF32745EFF65DC8"""
-"""FC7A1B4831556FBE_5CDE0C0FF56C1EC6_6039_UN""","""O(C[C@H]1CCCO1)CC3=NC2=C(C=CC(=C2)C(F)(F)F)O3""",21,"""5EF32745EFF65DC8"""
-"""6307087A8B7EE63B_CB9DC5106D3E70CC_6039_UN""","""O(C[C@H]1CCCO1)CC(NCC(C)(C)N2CCOCC2)=O""",21,"""5EF32745EFF65DC8"""
-"""9863C31BD24EC71E_98D4688FDDF60847_6039_UN""","""O(C[C@H]1CCCO1)CC2=COC(=N2)C3=C(F)C=CC=C3F""",21,"""5EF32745EFF65DC8"""
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-"""CB0B8EB03EB5D165_B28776C6C8E0554E_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NC(=O)OCC2=CC=CC=C2""",21,"""5EF32745EFF65DC8"""
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-"""5EF56F824C768D94_AED488D213563063_6039_UN""","""O(C[C@H]1CCCO1)CC(N2CCCCC2C(OCC)=O)=O""",21,"""5EF32745EFF65DC8"""
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-"""C2CB87F179D2A6CB_9A444073C5719292_6039_UN""","""O(C[C@H]1CCCO1)CC(NC(C)C2=CC(=C(C=C2)C)C)=O""",21,"""5EF32745EFF65DC8"""
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-"""667B577CD3BC457B_FD6F75609A0804EC_6039_UN""","""O(C[C@H]1CCCO1)CC2=C3C(=C(C)N=C2)OC(OC3)(C)C""",21,"""5EF32745EFF65DC8"""
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-"""381CCAB5CE80944D_597C00E499258B7A_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC3=C(C=C2)[NH]C(=N3)C)=O""",21,"""5EF32745EFF65DC8"""
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-"""69A02F49B315218C_C310E36C2D1DDCC4_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NNC(=O)CC2=CC=CC=C2""",21,"""5EF32745EFF65DC8"""
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-"""63D8702147780E13_C2C03722BF59F0F7_6039_UN""","""O(C[C@H]1CCCO1)CC2=C(C)OC(=N2)C3=C(C=CC=C3)C""",21,"""5EF32745EFF65DC8"""
-"""3235F6487860164C_8198ADF58D3ABF92_6039_UN""","""O(C[C@H]1CCCO1)CC2=C(C)OC(=N2)C3=CC=C(C=C3)F""",21,"""5EF32745EFF65DC8"""
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-"""FEC5F78C52614D0F_40389155FF46FDEC_6039_UN""","""CCOC2CCC(OCCCCOC1CCCCC1)CC2""",21,"""A0551505E85900C7"""
-"""C6C00CA6F4C1424B_CC24F112031B06AB_6039_UN""","""CCOC2CCC(OCC1=CC(=C(OC)C=C1)C#N)CC2""",21,"""A0551505E85900C7"""
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-"""5DD70256A93A2D2F_5ACB47790599B5D0_6039_UN""","""CCOC3CCC(OCCC1=NOC2=C1C=CC=C2)CC3""",21,"""A0551505E85900C7"""
-"""0E3D1621649FCD55_E92559055C627136_6039_UN""","""CCOC3CCC(OCC1=NC2=C(N=C1)C=CC=C2)CC3""",21,"""A0551505E85900C7"""
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-"""F6554445CB62AE6A_55DDB9F7B9C2DC67_6039_UN""","""CCOC3CCC(OCCC1CCC2=C1C=CC=C2)CC3""",21,"""A0551505E85900C7"""
-"""3092EDECEDF21762_19D74D7159178EEE_6039_UN""","""CCOC1CCC(OCCCC(CC(OCC)=O)=O)CC1""",21,"""A0551505E85900C7"""
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-"""4B402C1F5B2A19AC_CD3958BA15A77B69_6039_UN""","""CCOC2CCC(OCC(OC)C1=CC=C(C=C1)F)CC2""",21,"""A0551505E85900C7"""
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-"""488167128E684880_CFF457683B8E1007_6039_UN""","""CCOC1CCC(OCC(N(CC)CC(F)(F)F)=O)CC1""",21,"""A0551505E85900C7"""
-"""83D0EC7526A566BE_DA32EE38CED2A128_6039_UN""","""CCOC2CCC(OCC(NC1=C(C)C=CC=N1)=O)CC2""",21,"""A0551505E85900C7"""
-"""DA2FD5ECDDD62237_796C809063265785_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1F)[N](=O)=O)CC2""",21,"""A0551505E85900C7"""
-"""6733C72855B7C218_B4FB5BE03209E8BE_6039_UN""","""CCOC2CCC(OCC1=CC(=NO1)C(OCC)=O)CC2""",21,"""A0551505E85900C7"""
-"""C95DD9828FD142E1_72DD2B1427E8A0F4_6039_UN""","""CCOC3CCC(OCC1=CC2=C(C=C1)C=CN=C2)CC3""",21,"""A0551505E85900C7"""
-"""96E2F8C697542B5D_A8681CAC63E642F6_6039_UN""","""CCOC3CCC(OCC2=C1CCOCC1=CC=C2)CC3""",21,"""A0551505E85900C7"""
-"""CA81E507936D8A54_09A332442E9400EC_6039_UN""","""CCOC2CCC(OCC(NC1CCN(C)CC1)=O)CC2""",21,"""A0551505E85900C7"""
-"""8796524B599A8767_46B16F4719760697_6039_UN""","""CCOC2CCC(OCC1=CC(=C(C)C=C1)[N](=O)=O)CC2""",21,"""A0551505E85900C7"""
-"""CF06C539329EFBE6_CA0C9E5CBCFD1249_6039_UN""","""CCOC3CCC(OCC1CC2(CO1)CCCCC2)CC3""",21,"""A0551505E85900C7"""
-"""57E7A55D8D422A9C_4161431852C4BCBE_6039_UN""","""CCOC3CCC(OCC1CC2(CO1)CCOCC2)CC3""",21,"""A0551505E85900C7"""
-"""079C7CDD0F7BEFDB_C12AF00C2B7F88B8_6039_UN""","""CCOC3CCC(OCC1=CC2=C(C=C1)N=CC=N2)CC3""",21,"""A0551505E85900C7"""
-"""33AA24F5A8164569_75748261355156EF_6039_UN""","""CCOC2CCC(OCC1=CN=C(C(OCC)=O)S1)CC2""",21,"""A0551505E85900C7"""
-"""543E131102BDD49B_E172DCF4B90F0554_6039_UN""","""CCOC3CCC(OCC2CCC1(CCOCC1)O2)CC3""",21,"""A0551505E85900C7"""
-"""67459362FE55CD89_AC752D18F60A30A8_6039_DP""","""CCOC3CCC(OCC2OCC1(CCNCC1)C2)CC3""",21,"""A0551505E85900C7"""
-"""C42D7724DDC6AFE3_4F5C12D6D1137E65_6039_UN""","""CCOC3CCC(OCC2COC1(CCCCC1)O2)CC3""",21,"""A0551505E85900C7"""
-"""D2CF53E927523C62_01FD58E5F804EE34_6039_UN""","""CCOC2CCC(OCC(N1CC(C)(C)OCC1)=O)CC2""",21,"""A0551505E85900C7"""
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-"""708F59975A61EC90_273FC81E158DFC32_6039_UN""","""CCOC3CCC(OCC1=CC2=C(C=C1)C=CC=N2)CC3""",21,"""A0551505E85900C7"""
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-"""C30CBF3267454DB0_FB207E012511F991_6039_UN""","""CCOC3CCC(OCC1=NN=C2[N]1CCOCC2)CC3""",21,"""A0551505E85900C7"""
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-"""2F493DC89069F867_2563FCA96AACA329_6039_UN""","""CCOC2CCC(OCC(C1=CC=C(SC)C=C1)=O)CC2""",21,"""A0551505E85900C7"""
-"""D016A0B558AA222D_F0EC71F55D0AE23B_6039_UN""","""CCOC2CCC(OCC1=CN=C(C(OC)=O)C=N1)CC2""",21,"""A0551505E85900C7"""
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-"""BC2EBC8F731AE1D0_B428810BC376114C_6039_UN""","""CCOC2CCC(OCCCC(=O)N1CCCCC1)CC2""",21,"""A0551505E85900C7"""
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-"""457AC4628564A4FF_78FB7993EB40B912_6039_UN""","""CCOC2CCC(OCCC1=CC(=C(C(=C1)F)F)F)CC2""",21,"""A0551505E85900C7"""
-"""8FE11EB76E6C30F9_C987F8F1B63D762A_6039_UN""","""CCOC2CCC(OCC1=NC=CC(=C1)[S](F)(=O)=O)CC2""",21,"""A0551505E85900C7"""
-"""9BC16D1E39853124_9E8D748BBD0E5BAD_6039_UN""","""CCOC2CCC(OCC1=CN=C(C(F)(F)F)C=C1)CC2""",21,"""A0551505E85900C7"""
-"""F71ABBB656D2D7D5_6C9EA16B12DD9102_6039_UN""","""CCOC2CCC(OCC1=CC(=NC=C1)C(F)(F)F)CC2""",21,"""A0551505E85900C7"""
-"""5AE48F61F89736C7_D2882CA094482F9F_6039_UN""","""CCOC2CCC(OCC(=O)C1=CC=C(C=C1)C#C)CC2""",21,"""A0551505E85900C7"""
-"""8121C9F75CFFA65A_E2ED06CF5DE593AB_6039_UN""","""CCOC2CCC(OCC1=CC=C(OC(C)C)C=C1)CC2""",21,"""A0551505E85900C7"""
-"""33CFD67A59D46AF2_5D5B26EA1114D7B6_6039_UN""","""CCOC2CCC(OCC1=CC(=C(C(O)=O)C=C1)F)CC2""",21,"""A0551505E85900C7"""
-"""C9453D8B759CE6C4_EE696C0FA95ED089_6039_UN""","""CCOC2CCC(OCC1=C(NC(C)=O)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
-"""0078D7041346233F_0609C5D50C364AA1_6039_UN""","""CCOC3CCC(OCC2CN1CC(CCC1=O)O2)CC3""",21,"""A0551505E85900C7"""
-"""8FB48F75CF5D10EB_4FFEDF7AF6577069_6039_UN""","""CCOC3CCC(OCC1=NN=C(O1)N2CCCC2)CC3""",21,"""A0551505E85900C7"""
-"""FD3EA70208D621A4_03BC5926B82453E9_6039_UN""","""CCOC3CCC(OCC1=NOC2=C1CCCCC2)CC3""",21,"""A0551505E85900C7"""
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-"""E764BEBC1296D9C6_FE39E4A4FDB0B6DC_6039_UN""","""CCOC2CCC(OCC1=NOC(=C1)C(OCC)=O)CC2""",21,"""A0551505E85900C7"""
-"""084D28D204469D7B_32F34651738ED591_6039_UN""","""CCOC1CCC(OC[C@@H](C(C)(C)C)N[S](=O)(=O)C)CC1""",21,"""A0551505E85900C7"""
-"""BE36EC8B8420DECF_8D20F6170EA89E02_6039_UN""","""CCOC3CCC(OCC(=O)C1=CN=C2[N]1C=CS2)CC3""",21,"""A0551505E85900C7"""
-"""F4B968DC7336B185_CC71CED6AC0763F4_6039_UN""","""CCOC2CCC(OCCCOC1=CC(=O)CCC1)CC2""",21,"""A0551505E85900C7"""
-"""2DA1233150EFFFDC_7D082AE24919B5D4_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1)SCCC)CC2""",21,"""A0551505E85900C7"""
-"""14DEEC83DCB34EF6_E77D970E838A111F_6039_UN""","""CCOC2CCC(OCCCC1=C(F)C=CC=C1F)CC2""",21,"""A0551505E85900C7"""
-"""0451C4CBC5D085D3_2BBF48B50A8CB03F_6039_UN""","""CCOC3CCC(OCC1=NOC(=C1)C2CCCC2)CC3""",21,"""A0551505E85900C7"""
-"""5DC1BD953E912EFF_BA6C9948807D8F26_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=N1)C(C)(F)F)CC2""",21,"""A0551505E85900C7"""
-"""9A9DE7BA034D65DC_313F615BEDBA00D4_6039_UN""","""CCOC2CCC(OCC(C1=CC(=CC(=C1)F)F)=O)CC2""",21,"""A0551505E85900C7"""
-"""E4B219684EAD8DF2_8C05B5E35F902439_6039_UN""","""CCOC2CCC(OCC1=CC=C(C(CC)C)C=C1)CC2""",21,"""A0551505E85900C7"""
-"""ABD5EDB2F136968C_80C408B58D3FE176_6039_UN""","""CCOC3CCC(OCC1=CC=CC2=C1OC(=N2)C)CC3""",21,"""A0551505E85900C7"""
-"""9D62AC54B7BBBC48_5A7A9E7C3F9F0800_6039_UN""","""CCOC1CCC(OCC(NC(N=[S](C)(=O)C)=O)=O)CC1""",21,"""A0551505E85900C7"""
-"""ED4721E0E9282677_64D1656096E0E3A2_6039_UN""","""CCOC2CCC(OCC1=C(C(F)(F)F)N=CC=N1)CC2""",21,"""A0551505E85900C7"""
-"""40DC86BC450E8C81_3F250200AF3C571F_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1)[S](C)(=N)=O)CC2""",21,"""A0551505E85900C7"""
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-"""2738B95E48CE5830_0EFFA7162C52D5BA_6039_UN""","""CCOC2CCC(OCCC1(C(O)=O)CCOCC1)CC2""",21,"""A0551505E85900C7"""
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-"""E73E18849E99EB81_2802D826379A8D96_6039_UN""","""CCOC2CCC(OCC[S](=O)(=O)C1=CC=CC=C1)CC2""",21,"""A0551505E85900C7"""
-"""21766F00878FF736_23EEC392010A46A0_6039_UN""","""CCOC2CCC(OCC1=CN=C(OC)C=C1OC)CC2""",21,"""A0551505E85900C7"""
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-"""96021408D29FD0E2_E71F267B7F64037F_6039_UN""","""CCOC2CCC(OCC1=NC(=C(C=C1)[N](=O)=O)C)CC2""",21,"""A0551505E85900C7"""
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-"""2FB80BFEE7AE39D6_DEB6B2FAD37006FD_6039_UN""","""CCOC3CCC(OCC2=C[N]1C=CC=C(F)C1=N2)CC3""",21,"""A0551505E85900C7"""
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-"""E8A22CA46585E18F_CBD2250AF1F3C556_6039_UN""","""CCOC3CCC(OCCN1CCN(CC1)C2CC2)CC3""",21,"""A0551505E85900C7"""
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-"""875724E3A06F7F38_CDFBE2B384D97B59_6039_UN""","""CCOC2CCC(OCC1=C(SC(F)F)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
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-"""286BAAFA2498EFE1_6C900770A5680C0F_6039_UN""","""CCOC1CCC(OCCCCC(N[S](C)(=O)=O)=O)CC1""",21,"""A0551505E85900C7"""
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-"""BBF4F8825F1D52B8_9B5CAB58D5F8F701_6039_UN""","""CCOC1CCC(OCCCN(CC)CC(F)(F)F)CC1""",21,"""A0551505E85900C7"""
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-"""094179751A0197E1_7D21CA1FFEDB71B2_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2OCCO2""",21,"""03DB9D4F40711A25"""
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-"""C1DC484CE27E351B_E54861925BF2A7A1_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC(NC)=O""",21,"""03DB9D4F40711A25"""
-"""8287BB834596F796_B8AF65D63E4E2FF1_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCN=C=O""",21,"""03DB9D4F40711A25"""
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-"""03760D21844D9EB1_61A3C143D93CC017_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(=O)C2CC2""",21,"""03DB9D4F40711A25"""
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-"""04995C44792663C9_FB0454F07C0127F2_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCC(C)=O""",21,"""03DB9D4F40711A25"""
-"""DEC993EB5654BC70_39B330B931106E27_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NOC=N2""",21,"""03DB9D4F40711A25"""
-"""7B0555D6AD2203FC_63B527C922D1D12E_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC(C)(C)C""",21,"""03DB9D4F40711A25"""
-"""C780C1829EE50915_D69809EEE8CC6EFA_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CSC=N2""",21,"""03DB9D4F40711A25"""
-"""D677B8F8BAB491CA_4C96CA869BE5E8B7_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NN=N[NH]2""",21,"""03DB9D4F40711A25"""
-"""A27DDD72A0FE0031_4B0134F05F491CB1_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)C[CH]=[C]2C[CH2]C2""",21,"""03DB9D4F40711A25"""
-"""5DF09BC15B232EC5_472468DA19DE01C9_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(N(C)C)=O""",21,"""03DB9D4F40711A25"""
-"""9768689B5ED15E11_493FC05289EA0A74_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC#CCOC""",21,"""03DB9D4F40711A25"""
-"""81AB787E4F5D4ECC_FDFAD83A998468F5_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC(Cl)(Cl)Cl""",21,"""03DB9D4F40711A25"""
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-"""06F7BA6049B029FC_CD91AAD130627DF5_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=C[NH]C=N2""",21,"""03DB9D4F40711A25"""
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-"""E794FECC488516D3_02A34100FE921FB2_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCC(C)C""",21,"""03DB9D4F40711A25"""
-"""7E1309D6B3ABB6D6_E22EFCC1194E129C_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCOCCN""",21,"""03DB9D4F40711A25"""
-"""45F70EE53048167C_4AF0269C12071B5F_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC(NO)=O""",21,"""03DB9D4F40711A25"""
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-"""3891CF5DCC4C6B4D_9AB1BBE6626B6397_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC2CNC2""",21,"""03DB9D4F40711A25"""
-"""AE17D2DFED49CBC5_974B7AA6AD2D1871_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCCCF""",21,"""03DB9D4F40711A25"""
-"""C7072B5D428CA6CF_C96C9FA300B20689_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCSC(C)C""",21,"""03DB9D4F40711A25"""
-"""42556477F0F7E391_84D4750BDC09623C_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=C[NH]N=N2""",21,"""03DB9D4F40711A25"""
-"""F0A5C805E7C01B37_0F55778AE1E850A8_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(OCC)=N""",21,"""03DB9D4F40711A25"""
-"""BB0DEE16F8B4F408_D5093F89D5DA6AEB_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CC=N[NH]2""",21,"""03DB9D4F40711A25"""
-"""033530BEBE59AE59_9BD95BF1BB630139_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(C(C)=O)=O""",21,"""03DB9D4F40711A25"""
-"""784B9AD066B6F547_83F94328D754D2D3_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CN=NS2""",21,"""03DB9D4F40711A25"""
-"""B6A54D5CD402611E_B5D3440AB00B1792_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC[S](F)(=O)=O""",21,"""03DB9D4F40711A25"""
-"""58D11CB77735B599_3DA8B46F72D9DC2B_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)C[C@H]2CCCO2""",21,"""03DB9D4F40711A25"""
-"""674577B5ACBEE6FD_EEF970F93FFF7193_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC[Si](C)(C)C""",21,"""03DB9D4F40711A25"""
-"""57B4EE312BB9569D_53E8403BF7B52D46_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(NCC)=O""",21,"""03DB9D4F40711A25"""
-"""251B19FF02AB5BDA_F462061C83339858_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCOCC=C""",21,"""03DB9D4F40711A25"""
-"""2C364603DF34B150_70327C7C022A10F1_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CSC=C2""",21,"""03DB9D4F40711A25"""
-"""D8F150B80E9B9F7C_65F464757BF62A13_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=COC=C2""",21,"""03DB9D4F40711A25"""
-"""E7E6B0587550306E_199D9601E05AF3E2_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC#CC(O)=O""",21,"""03DB9D4F40711A25"""
-"""CD00BA84985AF5E5_F2C00DC57F074252_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NC=C[NH]2""",21,"""03DB9D4F40711A25"""
-"""2FAAC91F3F28B3A4_40A2A36B8E55154A_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CSN=N2""",21,"""03DB9D4F40711A25"""
-"""88B555BF351E0954_3085C89D00A146A5_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NON=C2""",21,"""03DB9D4F40711A25"""
-"""132CCE143868FB49_60AFAE823ACA721E_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NOC=C2""",21,"""03DB9D4F40711A25"""
-"""EDF6AAE6514DDB46_4F658EBDFB847BAB_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCCC=C""",21,"""03DB9D4F40711A25"""
-"""2AD75C1B875BD77A_9E69D852E382C332_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NSN=C2""",21,"""03DB9D4F40711A25"""
-"""C272528930834AA5_E195EBF0D0188E72_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CC=NO2""",21,"""03DB9D4F40711A25"""
-"""E0FD7126F45056DB_F2C889AFFF774CF9_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CON=C2""",21,"""03DB9D4F40711A25"""
-"""685794E03E0B2DD7_A445B8DA4B1E0C39_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2COCO2""",21,"""03DB9D4F40711A25"""
-"""3965B06356FD229E_32F3F15E15786A40_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCSC(C)=O""",21,"""03DB9D4F40711A25"""
-"""740F6CADA3D0785B_C8637AD9581B8E7F_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(CC)OC""",21,"""03DB9D4F40711A25"""
-"""6B5BE14D03AEC246_9E6684C62D423241_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NN=CO2""",21,"""03DB9D4F40711A25"""
-"""BF343173A9B6D49F_323C2B1F9022D36E_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC(F)(F)Cl""",21,"""03DB9D4F40711A25"""
-"""E0EF617393CCF61C_15921E22C0505386_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC[S](O)(=O)=O""",21,"""03DB9D4F40711A25"""
-"""07F369977856E661_E779D5FF09C39303_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCOC2CC2""",21,"""03DB9D4F40711A25"""
-"""AE1801479B8CEC19_2E9B32FD25A625C0_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CN=CS2""",21,"""03DB9D4F40711A25"""
-"""7C7FC9E6FE58D847_D0EDD68339ADAE24_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CC=NS2""",21,"""03DB9D4F40711A25"""
-"""40DC7C7EE6F0B981_175A277029F9BAD3_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2CC(=O)O2""",21,"""03DB9D4F40711A25"""
-"""637F625E5933D051_2AE37E46B4BE6D68_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCOC(C)=O""",21,"""03DB9D4F40711A25"""
-"""019384E4B7CC24FF_3CA7FC345CCE7303_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCOCC#C""",21,"""03DB9D4F40711A25"""
-"""6665C4FCFCDD8C55_808C8D2BE25C0B1C_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(CC)(F)F""",21,"""03DB9D4F40711A25"""
-"""D54ECC8E67A76B61_EB0D93005B511BBB_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)C[C@H]2CCCN2""",21,"""03DB9D4F40711A25"""
-"""24B65ADE178E1C72_380E1C401330C7D2_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2OC2(C)C""",21,"""03DB9D4F40711A25"""
-"""AD655BB771DAD859_FC7F49D61616CECB_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(C=CO)=O""",21,"""03DB9D4F40711A25"""
-"""B9CDD2748520228D_DE74B961661932FF_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CSN=C2""",21,"""03DB9D4F40711A25"""
-"""A39B6053383C0092_39A4ACD388C73D65_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NCCO2""",21,"""03DB9D4F40711A25"""
-"""5FF59E2582DDF513_A51C32B62A9E8C07_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NN=CS2""",21,"""03DB9D4F40711A25"""
-"""9D3B5643CC691EBA_D4A9E3F1796C2857_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCC2CC2""",21,"""03DB9D4F40711A25"""
-"""D15E95C38213A1B6_8AD8C46AA6C9A7D9_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(C(F)F)=O""",21,"""03DB9D4F40711A25"""
-"""D3863C10933CA76C_A5D59E9E9C6AF9D1_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NOCC2""",21,"""03DB9D4F40711A25"""
-"""0930F070FBB36926_9486FD85D21236A3_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(OCC)=O""",21,"""03DB9D4F40711A25"""
-"""7FC5E4BAA3A6BB88_C7FEEA66B5697EA3_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC[S](N)(=O)=O""",21,"""03DB9D4F40711A25"""
-"""ACA0EF0A544062B1_E1FAEC96943E4D1A_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCCC#N""",21,"""03DB9D4F40711A25"""
-"""B28DAD71DD92E7FD_1EAB2E637D83D09F_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC=CC=C""",21,"""03DB9D4F40711A25"""
-"""D03F0D1C7C030948_C9F7ED6704785404_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCNC(C)=O""",21,"""03DB9D4F40711A25"""
-"""C9B4DEA2F90D1483_84A5D30205CB99B5_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC[S](=O)(=O)Cl""",21,"""03DB9D4F40711A25"""
-"""DF285598337DDC65_CA558CEF8B2284D8_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCCCC""",21,"""03DB9D4F40711A25"""
-"""028B6B4E16CB3445_DB111185DA48A8C8_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC(CC)C""",21,"""03DB9D4F40711A25"""
-"""0CA1A1C15630655E_EC70FEAF788EBE08_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCC(C)=C""",21,"""03DB9D4F40711A25"""
-"""8408DDBE8A7EB5E5_535B8BC7B88FC6C1_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(=C)CC#N""",21,"""03DB9D4F40711A25"""
-"""D94ECE218E93ED51_227718D4F2B58BC4_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCC(F)F""",21,"""03DB9D4F40711A25"""
-"""B804940BB0F178D7_87644F108C7706A8_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC=C(C)C""",21,"""03DB9D4F40711A25"""
-"""459802514D2863A6_39ED2A33C57DCD70_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC=C(C)C#N""",21,"""03DB9D4F40711A25"""
-"""EF2A4751AC29D953_A04464C8FAA2C80C_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(NCO)=O""",21,"""03DB9D4F40711A25"""
-"""5EA45EE2BBB397FD_ED41D6B3252E46C8_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCOC(F)F""",21,"""03DB9D4F40711A25"""
-"""6446C8A660BF7BD7_ED2331AB4D5EBB7A_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC2(C)CC2""",21,"""03DB9D4F40711A25"""
-"""F2A00F38152C0974_8FE955B143DF2CFC_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC#CC2CC2""",21,"""03DB9D4F40711A25"""
-"""68DFC2B76B6B8E61_4EF0900097170ACE_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC2COC2""",21,"""03DB9D4F40711A25"""
-"""AA6356530F0EEEE7_C2EA41B905CA9BB6_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCC(N)=O""",21,"""03DB9D4F40711A25"""
-"""3D49ECF6725339D5_E6C7331AD192F7C7_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC(C)(F)F""",21,"""03DB9D4F40711A25"""
-"""6A645E34FD84E523_6198288E6630D934_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC2(C)N=N2""",21,"""03DB9D4F40711A25"""
-"""33FB8E8C5D7DAAB9_518D4FEBC6EE82F2_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2CCCN2""",21,"""03DB9D4F40711A25"""
-"""1FD7F9163DF85B07_42CFE653E35E3AD2_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC([C@@H](C)N)=O""",21,"""03DB9D4F40711A25"""
-"""53C968983CBDD6AB_6B28AF174A2BFAC5_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCN2CCC2""",21,"""03DB9D4F40711A25"""
-"""717529627C7CE19D_A4605321D48B653D_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=N[NH]C=C2""",21,"""03DB9D4F40711A25"""
-"""0BF2F01BA136CE61_7BEDFC7051E21150_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC(C)(C)F""",21,"""03DB9D4F40711A25"""
-"""1C924D9C0B8AAFEF_B93954B83A3841F3_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(C(C)C)N""",21,"""03DB9D4F40711A25"""
-"""F2363E0EC7D38B53_35A47FA327519209_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCN=[N]#N""",21,"""03DB9D4F40711A25"""
-"""53F150948C5B6D79_01807A337D4CB33A_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC[N+](C)(C)C""",21,"""03DB9D4F40711A25"""
-"""B38A207C4386BF9E_67302BC6E907C21D_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCCCO""",21,"""03DB9D4F40711A25"""
-"""A672710F8BF9A72E_154717565E33B815_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCOCCC""",21,"""03DB9D4F40711A25"""
-"""EF84EF98567C60D5_7F06E5E48643CDE8_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NC=CS2""",21,"""03DB9D4F40711A25"""
-"""9B279DB7A0270CB5_1EB84FE7F954ECA0_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NSC=C2""",21,"""03DB9D4F40711A25"""
-"""198A50511EA0EF47_A221ECAEBEEDBBB4_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCCC#C""",21,"""03DB9D4F40711A25"""
-"""783C9FAA95DD3FB1_251E5273D5C4A375_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(C)N(C)C""",21,"""03DB9D4F40711A25"""
-"""2B25780BE7F921AC_E749EB68E700788A_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCC2CO2""",21,"""03DB9D4F40711A25"""
-"""135001613C9CE779_7B308352F51228DB_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC2CCC2""",21,"""03DB9D4F40711A25"""
-"""CF4F635E958095F7_08E72D12E3B2EE38_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCNC2CC2""",21,"""03DB9D4F40711A25"""
-"""FFDB1FCEE94C4900_1CAF381F6FB9FDC9_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCN(CC)C""",21,"""03DB9D4F40711A25"""
-"""C12F3D17D06943DB_A9E2A8EA0A2A35CC_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2OC2CC""",21,"""03DB9D4F40711A25"""
-"""14AB3BAEEA5332D6_55DA3D77AEEB7A3B_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCC=CC""",21,"""03DB9D4F40711A25"""
-"""E340102A2FEF058D_88816DA5C3E89D41_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=N[NH]C=N2""",21,"""03DB9D4F40711A25"""
-"""AF1527C6214C7971_2400021D0B3F7AC6_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=CN=CO2""",21,"""03DB9D4F40711A25"""
-"""14B3AF8B635A59EA_B5FFC13E9A2EAC3C_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(=O)C(Cl)Cl""",21,"""03DB9D4F40711A25"""
-"""327F29A059FF7AD6_F78288330FCF3487_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC([C@H](C)N)=O""",21,"""03DB9D4F40711A25"""
-"""C9B4DEA2F90D1483_78AA4BDFD18D46DC_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC[S](Cl)(=O)=O""",21,"""03DB9D4F40711A25"""
-"""28A3EB91EA7AAA99_1082177152A2C179_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCSCC""",21,"""03DB9D4F40711A25"""
-"""CC22FC6C9F2E4E5E_E9496A1F16449A78_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C(N)=O)C=C2""",21,"""5B3D336A683DE175"""
-"""C8886427494B02D3_54224AFA2ADC8A24_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(F)C=CC(=C2)C#N""",21,"""5B3D336A683DE175"""
-"""2154FBF3B60997D7_63B1E96BDED7CA53_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N2C(C=C(C)O2)=O)=O""",21,"""5B3D336A683DE175"""
-"""26A6007FA6FE58EB_8A016E19CD9D7275_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NC2=CC(=NO2)C)=O""",21,"""5B3D336A683DE175"""
-"""56F77A5FF8288678_4D3B128B11803CBE_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NC2=NN=C(C)S2)=O""",21,"""5B3D336A683DE175"""
-"""87D02E0AAB008DDC_18DD2592C806019D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(OCC)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""F40C6A6B06991C36_EF21F63012DCF2B3_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCCCCCCC""",21,"""5B3D336A683DE175"""
-"""165D1DF38B5C4223_574A3F26D6C80A80_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=CC=C(F)C=C2)=O""",21,"""5B3D336A683DE175"""
-"""5D73AB61FF028621_CD4F3B4D4421EA00_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(OC)C=CC(=C2)C""",21,"""5B3D336A683DE175"""
-"""9942217CC8952F99_9AED47DED8EFBD32_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC(=O)NCC=C""",21,"""5B3D336A683DE175"""
-"""C33E8804836C0453_A2CEA55D079F6F6B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=CC=C(C)C=C2)=O""",21,"""5B3D336A683DE175"""
-"""F9D3779229C4F23E_160A1C236D1C8C3D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NC2=NOC(=C2)C)=O""",21,"""5B3D336A683DE175"""
-"""A67D72AEF7269307_CAE1DBD25505F92D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC(=O)NC2CCCC2""",21,"""5B3D336A683DE175"""
-"""521E9D470912233F_4576D10245840048_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N(CCC)CCC)=O""",21,"""5B3D336A683DE175"""
-"""16C5C07BB4D45B82_2B8A778079015589_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C(O)=O)C=C2""",21,"""5B3D336A683DE175"""
-"""9B38CE63964C70D7_C95B319A2A53C10B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N(C(C)C)C(C)C)=O""",21,"""5B3D336A683DE175"""
-"""9CA61363D20D26A8_F85E1AAA01F6FC57_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C[N]3C(=N2)C=CC=C3""",21,"""5B3D336A683DE175"""
-"""FBD7B0B04E9686F9_EB8E7030169DA0C5_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C(C)[NH]C(=C2)C)=O""",21,"""5B3D336A683DE175"""
-"""FFBDDC1923E213B4_AD9A08FA87F2ED06_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCSC2=CC=C(C)C=C2""",21,"""5B3D336A683DE175"""
-"""DBEFF79D6E6BD542_D8916CCA7EBA4821_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC(=O)NC2CC2""",21,"""5B3D336A683DE175"""
-"""A678A53FC233C185_7EC207284ADB972E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(C=CC=C2)O3""",21,"""5B3D336A683DE175"""
-"""AAE8F0596CB52E45_162EE97CCBC7F230_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC[S](CCC(N)=O)(=O)=O""",21,"""5B3D336A683DE175"""
-"""189759C9822200CE_6AA3A1DB432A0BB7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCSC2=CC=C(F)C=C2""",21,"""5B3D336A683DE175"""
-"""27CABE25AD147291_2B2B63983C3C190C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCC(N(CC)CC)=O""",21,"""5B3D336A683DE175"""
-"""14DD1028A10DAFCD_9FC793CE5ECFEB5C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCCC(OCC)=O""",21,"""5B3D336A683DE175"""
-"""38D74F7BD4045C10_E6E1E89D2F82F0BE_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N2CC(C)OCC2)=O""",21,"""5B3D336A683DE175"""
-"""4C222A948A1AAB41_AF8E7927DAD01EDD_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NC2=NC(=CS2)C)=O""",21,"""5B3D336A683DE175"""
-"""109E62E3282F2302_BBADF74D1F84FCA3_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(F)C=C(C=C2)C#N""",21,"""5B3D336A683DE175"""
-"""6270330B7095BFC2_EB5CE05CE85DD06E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(C=CC=C2)[NH]3""",21,"""5B3D336A683DE175"""
-"""0F766CC8542222C5_44140FA4ACBA62CE_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=NO2)CC(C)C""",21,"""5B3D336A683DE175"""
-"""A97DE1D4D2B4237F_051210B33A5BEF6A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C=C(C)C=C2C)C""",21,"""5B3D336A683DE175"""
-"""48FD7DA759DFCC6E_6F31849E109039AF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=NO2)CCCC""",21,"""5B3D336A683DE175"""
-"""3708D01AB0320CB5_38E6A38FC29B3E78_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(OC)=O)C=CO2""",21,"""5B3D336A683DE175"""
-"""969ADCA6334AB2B5_A4623B3F7C766732_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N(C)C(C)(C)C#N)=O""",21,"""5B3D336A683DE175"""
-"""AA38722DA8AF5E57_994E851E81410793_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NCCC(OC)=O)=O""",21,"""5B3D336A683DE175"""
-"""DA8D48E1B07FE6D8_2A0BAE5358FED933_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3COC2(CCCC2)O3""",21,"""5B3D336A683DE175"""
-"""31BFEF76CEF44038_F76905E05D1F4DFF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCOC2CCCCC2""",21,"""5B3D336A683DE175"""
-"""5CC436549B83F84F_C839C195771A1C27_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C(C(C)(C)C)O2""",21,"""5B3D336A683DE175"""
-"""6E1F577F5EAD9752_07329CDB0FF28BDE_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(OC)=O)OC=C2""",21,"""5B3D336A683DE175"""
-"""34E5479AD1FA1A64_9F26E4B396A8492E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC=C(C(C)(C)C)O2""",21,"""5B3D336A683DE175"""
-"""837CF2EB8308C0A7_44A10753F37C5751_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=CC=CC(=C2)C)=O""",21,"""5B3D336A683DE175"""
-"""7304D79AF6105AD3_917B9689F2085E76_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CSC(=N2)CCCC""",21,"""5B3D336A683DE175"""
-"""471F0F2DEE128707_073623A3C68E5AED_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NCC2CCOC2""",21,"""5B3D336A683DE175"""
-"""0D4144FE4F375DE1_C00D39C1F86B9AA7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N(C)C2=NC=CS2)=O""",21,"""5B3D336A683DE175"""
-"""9F0B5D008EDC9ADD_BE1DF033F8098D99_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NCCC(C)(C)C)=O""",21,"""5B3D336A683DE175"""
-"""93500DC1983C45F2_BCA1440975D9876E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(N(C)C)C=C2""",21,"""5B3D336A683DE175"""
-"""7DBC7A4D83A04CCE_4367E53EAA2A3960_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC(=N2)CCCC""",21,"""5B3D336A683DE175"""
-"""05370B6809CB349D_CD0CACED911E39B7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=NO2)C(OC)=O""",21,"""5B3D336A683DE175"""
-"""9744A649A4865566_AC4C9A999E1BF2A2_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC[N]2C=C([N](=O)=O)C=N2""",21,"""5B3D336A683DE175"""
-"""4272E8FD3E598714_C4907A1AA26B53D5_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=NO2)CCOC""",21,"""5B3D336A683DE175"""
-"""C9B7388EBF8052EC_B42D4ACB448B6350_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2CCOCC2""",21,"""5B3D336A683DE175"""
-"""54F76EA68EE52D24_463ED98C9A03806A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC3=C(C=C2)OCC3""",21,"""5B3D336A683DE175"""
-"""1EBB7A74BF816A8A_CE1C319598DC1326_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC3=C2CCCC3""",21,"""5B3D336A683DE175"""
-"""9A81936A8F82819F_DC5AFF7BCB7444FA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC(NCC(OC)=O)=O""",21,"""5B3D336A683DE175"""
-"""DCDA6F38441F4A07_96CB328587AAF048_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(OC)=O)SC=C2""",21,"""5B3D336A683DE175"""
-"""9909740D6243D0F3_F691000A3ABF44C2_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC[N]2N=C([N](=O)=O)C=C2""",21,"""5B3D336A683DE175"""
-"""87967FC21E5687FD_21EF7375A71FCF8C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCC[N]2N=CC=C2""",21,"""5B3D336A683DE175"""
-"""E5ECD2FC8769F52E_9C75D80A05975C06_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C(OC)=O)NC(=O)C""",21,"""5B3D336A683DE175"""
-"""35BE45C9004BF991_493334205B4BDA96_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NNC(=O)C2CC2""",21,"""5B3D336A683DE175"""
-"""DB872046699D5306_7C19C7B412F4965E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C[N](N=C2C)C)=O""",21,"""5B3D336A683DE175"""
-"""CB58C3AAF1FE86D8_DA362F643FC36FAD_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2=CC=NC=C2""",21,"""5B3D336A683DE175"""
-"""DE34E91323946EFD_FC359655926E225B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2=CC=C(CC)C=C2""",21,"""5B3D336A683DE175"""
-"""669982FF83FE7530_B2563556E7D805C6_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC3=C(C=C2)CCC3""",21,"""5B3D336A683DE175"""
-"""E819C5518BBCB901_C41660011E241A4B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOCC2CCCCO2""",21,"""5B3D336A683DE175"""
-"""757167131AEB40DE_E2EE775D8D13C352_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2OCCN(C(C)C)C2""",21,"""5B3D336A683DE175"""
-"""53AEFC1E62FAC863_FFA31D522F580A02_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C[N](C)N=C2[N](=O)=O""",21,"""5B3D336A683DE175"""
-"""CB528C1078521AA6_C1A2952F7FB1358E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCOC2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""42B94B0070D9CE05_5F421A73FE86EBFD_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2)N(C)C""",21,"""5B3D336A683DE175"""
-"""9C7FECFFC038E422_4E886EC3217C7143_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC2CCCCCC2""",21,"""5B3D336A683DE175"""
-"""C7856DB537A3E80C_34DEC2A8FA974E90_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(N=C[N]2C)[N](=O)=O""",21,"""5B3D336A683DE175"""
-"""36FBB7C814E35D7A_5DD26CE4E4D4D0EE_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(C=CC=C2)S3""",21,"""5B3D336A683DE175"""
-"""DA585051D43B7459_034C2408A6421130_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN(C)C2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""7E65395CC4BCFF16_7E28BE056EAC379F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=N2)OCC""",21,"""5B3D336A683DE175"""
-"""E181E22BA157662D_4A97D88C944DE2A8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=NO2)C(OC)C""",21,"""5B3D336A683DE175"""
-"""325D8C254016D0DC_4760480EB9D045EF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC[P](OCC)(=O)OCC""",21,"""5B3D336A683DE175"""
-"""68DCD105F416595C_60C3CB8414CA2FFB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2ON=C(C(OC)=O)C2""",21,"""5B3D336A683DE175"""
-"""AC09F28A5F05A153_1215444A15FAB795_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=CS2)C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""128BF7ECBC805179_926DC3B717573E55_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(N=CC=C2)[NH]3""",21,"""5B3D336A683DE175"""
-"""2A9143EEFC3F47C3_9EF70064EC60E94D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC[N]2C=C(C(O)=O)C=N2""",21,"""5B3D336A683DE175"""
-"""1F19CEDDCD4A56CB_EF8AFCFDD4C9B400_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCNC(C(F)(F)F)=O""",21,"""5B3D336A683DE175"""
-"""7A02511AA19FF07C_79BBB85AFC93AEBC_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCNC(=O)C2CCCC2""",21,"""5B3D336A683DE175"""
-"""C48980BF313A2F38_E47F2B63551ED088_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC3=NSN=C23""",21,"""5B3D336A683DE175"""
-"""B673DBD8DD08D853_745F835ADE48A8FE_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2=CC(=C(F)C=C2)F""",21,"""5B3D336A683DE175"""
-"""9B59A5985BDB4E8F_5B3B6E22521060F3_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC#CC2=CC=C(F)C=C2""",21,"""5B3D336A683DE175"""
-"""3B3392C7EAC2F011_F9B4A5B4378E1F28_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2)COC""",21,"""5B3D336A683DE175"""
-"""0FD75BA91ABA23E2_FF3DC74DABD08B99_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2)C(O)=O""",21,"""5B3D336A683DE175"""
-"""83806AA8C7EB57B5_D7744B4AA629C3F6_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2CCSC2=O""",21,"""5B3D336A683DE175"""
-"""D7891B124FD32F19_CBBB1E12B9A66093_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C=C(F)C=C2)C#N""",21,"""5B3D336A683DE175"""
-"""5D2D57C8C558E5C4_820F61EE7BF59B27_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCC[N]2C=CN=C2""",21,"""5B3D336A683DE175"""
-"""B36A792A09BEAF5D_3DAAE3DD3D04154E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCOC(NC(N)=O)=O""",21,"""5B3D336A683DE175"""
-"""A434AAA3AA6DFD0C_D671A19078C27CC2_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCC[N]2C=CN=C2C""",21,"""5B3D336A683DE175"""
-"""0A8A7CB7156DC7C1_E743A4F1D8F784E1_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=NO2)C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""DFA040CBD5E895AF_8E5DF08441E8EB7C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC(N(C)CCC#N)=O""",21,"""5B3D336A683DE175"""
-"""6E14CEE656C0351E_9577DD68CA432F14_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N(CCCC)CC)=O""",21,"""5B3D336A683DE175"""
-"""5C58C3A0814A0255_269099B211E90CF6_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC(=O)N2CCCCC2""",21,"""5B3D336A683DE175"""
-"""B481BF95BBEB766E_241908CBFEDC216D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(OC)C=CC(=C2)F""",21,"""5B3D336A683DE175"""
-"""9819316A501BD99B_DC702AE2DC277C81_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC(=O)N2CCOCC2""",21,"""5B3D336A683DE175"""
-"""CFD4460836A9FECE_29CA45D566138A33_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=CC2=C(C=CC=C2)O3""",21,"""5B3D336A683DE175"""
-"""7B0703C506D34F59_5B91D9BA2869B899_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N(CC)CCC#N)=O""",21,"""5B3D336A683DE175"""
-"""CAAB3988AFC797FD_C24F27EE925C80DD_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=CS2)C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""A1C270F2620CE893_2FC8A5FB497ACC59_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC=C(OCC)C=C2""",21,"""5B3D336A683DE175"""
-"""66D6A50DAF8AD394_8D3AC0475D85DBC7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2CC(CC(C)C2)C""",21,"""5B3D336A683DE175"""
-"""49EA2A5CFEAB50BD_744AE2789C7170F6_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C(N=C(C)O2)C)=O""",21,"""5B3D336A683DE175"""
-"""4AC412F2E6A7EDDA_5F5D310BC62C782F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2=NC=CN=C2""",21,"""5B3D336A683DE175"""
-"""4DE2E179017013B5_1EB0D7AA16595AB0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2=CN=CC=C2""",21,"""5B3D336A683DE175"""
-"""9F6E0F69DF15DEF6_4EE3BFA7F4575BC8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=N2)N(C)C""",21,"""5B3D336A683DE175"""
-"""5992E6C5C9ACCD8A_E337921BBDB62D84_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C(C)[N]2C3CC3""",21,"""5B3D336A683DE175"""
-"""0644792036029FB0_712628F0F9429D9D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=CC2=C(C=CC=C2)S3""",21,"""5B3D336A683DE175"""
-"""9645BBC3E008BAB5_4878783CCC57C7D8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2CC3CCC(C2)O3""",21,"""5B3D336A683DE175"""
-"""F1081D48639D7553_4BD9C11E0FA7673C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CSC(=N2)C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""ECC97076A12FBD5D_4485DF2C88F58268_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC(=N2)C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""BB1E3C65A8DC9A30_327D8385C7E9D504_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=N2)C(C)C""",21,"""5B3D336A683DE175"""
-"""14E8DFC97C3A9F5E_5979DFA36ACF4EA4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2F)C#N""",21,"""5B3D336A683DE175"""
-"""35A2B2484183D2BE_DA100D671B62BBDD_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C([N]2CCC)C""",21,"""5B3D336A683DE175"""
-"""34C37D03DBA5521F_0CEDF6F4E3E0B39A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C(C(C)C)[N]2C""",21,"""5B3D336A683DE175"""
-"""87FD13A9A1723173_7A396867EE94A801_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=CC(=N2)OC)C""",21,"""5B3D336A683DE175"""
-"""1891F52243AE0145_F26866831E30A2CF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N2CCN(C)CC2)=O""",21,"""5B3D336A683DE175"""
-"""7DE3B85229745624_F9978874FAE494B1_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCC2=CC=CC(=C2)C""",21,"""5B3D336A683DE175"""
-"""EDB31D58FEABB23D_78CDACC87E746116_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=NC=C2)N(C)C""",21,"""5B3D336A683DE175"""
-"""C27EC4E2B5779134_E78BB548DCC7C1EA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=CC(=C2)OC)C""",21,"""5B3D336A683DE175"""
-"""F55090E1E5F691A3_8BCADE8C0E04713D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NCCCN(C)C)=O""",21,"""5B3D336A683DE175"""
-"""D6F972574779A7F1_11A9341D794A2078_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC=C([N]2C)[N](=O)=O""",21,"""5B3D336A683DE175"""
-"""E26759CBC65F448D_8D22A1FFA02BDEBF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(N=CC=C2)S3""",21,"""5B3D336A683DE175"""
-"""E657BAEE381DADE9_0B892B26057A5CC5_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(CCC)C=C2""",21,"""5B3D336A683DE175"""
-"""6B82B798ABAD6864_B65C645A9279BC47_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCC2=CC=C(C)C=C2""",21,"""5B3D336A683DE175"""
-"""D88E92C15DA72CD9_5AAADB7770E840C0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C(F)F)C=C2""",21,"""5B3D336A683DE175"""
-"""839E43480FC18E9C_57553945DAEA38C2_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NCC2=CC=CO2""",21,"""5B3D336A683DE175"""
-"""514D35EBF9042635_8DA8441F016816DB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCOC2CCCCO2""",21,"""5B3D336A683DE175"""
-"""D6692F62FB17E430_A1FC6A78A40703B3_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""D0CE008E90F69A91_9976F617C5117ACD_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)N(CC=C)CC=C""",21,"""5B3D336A683DE175"""
-"""C2A2311CFE8D0D18_5E7DCB77F6A2B081_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=N[N]2C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""4E6EC03AAB9ACE50_719382AD96FB6F4C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=N[N]2CC3CC3""",21,"""5B3D336A683DE175"""
-"""A962E7B6045694A5_6A1129B5C8BB85FA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2)[N](=O)=O""",21,"""5B3D336A683DE175"""
-"""EC33AF682127DB0A_7F642C8726EE1F6A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C([N](=O)=O)C=C2""",21,"""5B3D336A683DE175"""
-"""97313C3E94C58D03_A6FD809235174C01_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C[N](C)N=C2C(F)F""",21,"""5B3D336A683DE175"""
-"""3CAE34DEA0AEAD37_6059F28AC2C530DA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCC2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""CD2D4C64D5D179D2_03AC2EDDA6C5E056_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N(CC)CC(=C)C)=O""",21,"""5B3D336A683DE175"""
-"""D8A69A6D73C321DF_631BB003692795AD_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C)C=C(C=C2)C#N""",21,"""5B3D336A683DE175"""
-"""59779BC0E3D3F5D2_DB91D3D5B501E053_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2C#N)F""",21,"""5B3D336A683DE175"""
-"""8F225E62089C0719_A5CB89384DE56686_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(F)(F)F)[NH]N=C2""",21,"""5B3D336A683DE175"""
-"""35969B8667D354F3_50FAF5E932BAC743_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2CC[S](CC2)(=O)=O""",21,"""5B3D336A683DE175"""
-"""043D46130CEFFA59_5B9036954DEFD577_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C([S](C)(=O)=O)S2""",21,"""5B3D336A683DE175"""
-"""A6ABDE507B4A4D30_DBA6B9A278D53C37_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N2CCCC2(C)C)=O""",21,"""5B3D336A683DE175"""
-"""7FF4EB5BF47E895C_9FA0C8F601508443_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2(CCC2)C#N""",21,"""5B3D336A683DE175"""
-"""39540EB6F35C8397_2EF7C7763902E0D1_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CCC2(CCCC2)O3""",21,"""5B3D336A683DE175"""
-"""E297CD6842F82800_72FE7BCD2FC733A4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(CCC(OCC)=O)=O""",21,"""5B3D336A683DE175"""
-"""A72903803B6402B0_86C45784890D1DCA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCC[S](CC)(=O)=O""",21,"""5B3D336A683DE175"""
-"""55C959F2A974A438_EC8DB2F7BD1F6339_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)C2CC3CCC2C3""",21,"""5B3D336A683DE175"""
-"""9C04F0D8E2BCEFD5_B2BBB96AC07D3264_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCN2CCOCC2""",21,"""5B3D336A683DE175"""
-"""66BB9677C6CCB403_0512E9ABF64B06C1_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=C(C=C2)C#N)F""",21,"""5B3D336A683DE175"""
-"""E5BC1B20B2108DE6_7CD62FDB7610BB32_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCC2(C)OCCO2""",21,"""5B3D336A683DE175"""
-"""20FAEB6A5F80CF13_EE7E0B7020388C79_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CCC2(CC2)C(=O)O3""",21,"""5B3D336A683DE175"""
-"""851F890C1B34A8A0_0C6FFC3620197821_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2=C(CC)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""BF3F58026BB12E54_36CFF2DCE5C9ADA2_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CC2=C(C=CC=C2)O3""",21,"""5B3D336A683DE175"""
-"""69FEC77AC44E774E_CCF5ACDEF4B4DB72_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C3[N]2CCCC3""",21,"""5B3D336A683DE175"""
-"""D10DAEDCDD2C8F95_4BD237380003E144_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)C2CCCCCC2""",21,"""5B3D336A683DE175"""
-"""55EE1C23D223CCDB_C91ACA78C7BF8C2A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC(=C2)C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""ACC5DA1EB96F9151_3F0D32913337FF1F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N2CCC(C)CC2)=O""",21,"""5B3D336A683DE175"""
-"""319B09723BA3A8F7_89978C736AB70287_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(N=C(OC)N=C2)C""",21,"""5B3D336A683DE175"""
-"""1AEAE6187BED0F93_537C385979E298B2_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC=N[N]2C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""E4497B531D372CEA_6D30B3060CDD57BA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2N(C(C)C)CCCC2""",21,"""5B3D336A683DE175"""
-"""09B0083E0544F062_1CBC62EDBF473137_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCC2CCOCC2""",21,"""5B3D336A683DE175"""
-"""D3E8D3E52EED0432_8AAC3B593C56DD63_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCC2=CC(=NO2)CC""",21,"""5B3D336A683DE175"""
-"""85AFD6552BB4DAC3_9E21EB4A7F87B546_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=CN=CC(=C2)F)=O""",21,"""5B3D336A683DE175"""
-"""832D467461F53F59_EAAC4B19E6951E69_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C(C(OC)=O)(C)C)=O""",21,"""5B3D336A683DE175"""
-"""23237565E4465DBE_053BD781DBE35EE7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(OC)=O)C=NO2""",21,"""5B3D336A683DE175"""
-"""9E39D4204CB35835_2EA5A7F9A6865901_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C3[N]2CCOC3""",21,"""5B3D336A683DE175"""
-"""2B8FEDED8D0D7C98_2E909F662EBFE98D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(OC)C2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""AE99F402DEBEF2D4_AAB6A21581AD215E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=NC=CC(=C2)C)=O""",21,"""5B3D336A683DE175"""
-"""8A4BB355A0AA983A_0C565FCDDDB5AE1D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(COC)C=C2""",21,"""5B3D336A683DE175"""
-"""304C1800ABE7A0BE_FB6E09FE27C11752_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=N[NH]C(=N2)C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""B70D26F35946F07A_B76CCADC40538079_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC(=N2)CCOC""",21,"""5B3D336A683DE175"""
-"""FA97DE10F51551D0_3635179AB9834036_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=CC2=NON=C2C=C3""",21,"""5B3D336A683DE175"""
-"""29FE0ACF0C96CDF9_3BEA37253F13E6D0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C(C)N=CC=C2)=O""",21,"""5B3D336A683DE175"""
-"""7B08560B623955FF_71888D8FF73F7499_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=N[N]2CC(F)F""",21,"""5B3D336A683DE175"""
-"""EED26CC724F51713_58B97586DC7EC2C0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCSCC2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""7AF61DF14CADF18C_04B3FC532F65BA4C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CSC(=C2)C(OC)=O""",21,"""5B3D336A683DE175"""
-"""7215659774BC1F56_5FB755DCE74FAFEB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(CC(C)(C)C2CC2)=O""",21,"""5B3D336A683DE175"""
-"""6BA07CCF24903709_44229BB1DBBB4149_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)C2CC[S](=O)(=O)C2""",21,"""5B3D336A683DE175"""
-"""1A0E6D73A7947716_D7786EB66FEC52BB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NCC2CCCO2""",21,"""5B3D336A683DE175"""
-"""0A5FF19625ABD24B_D7EF00E4800F9920_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)N2CCCCCC2""",21,"""5B3D336A683DE175"""
-"""9DEAE5D9BD539B7F_AF600BBC96888672_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N2CCCC(C)C2)=O""",21,"""5B3D336A683DE175"""
-"""E2466AF0C79522F4_1ED5FFEC342ED5F4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N2CCCCC2C)=O""",21,"""5B3D336A683DE175"""
-"""64BB539B9A777828_944C49F2F4BA2D27_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2)C(C)=O""",21,"""5B3D336A683DE175"""
-"""3A964163AB27BF3E_552BDB3903CEB850_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(O)=O)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""8B775D1458073008_6EA7C27BD121DCF7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=CO2)C(OC)=O""",21,"""5B3D336A683DE175"""
-"""1C533670D95AD235_8FA223F937298D23_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NCCCCCC)=O""",21,"""5B3D336A683DE175"""
-"""942A01DD5FCD969F_5266E67A7F762E87_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NCCCOCC)=O""",21,"""5B3D336A683DE175"""
-"""D9EDA66518816AC9_FC2B3D8BE0A877AA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC[S](=O)C2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""0E9C7C793524EA96_9EBDD6612290B874_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NNC(C(C)C)=O)=O""",21,"""5B3D336A683DE175"""
-"""1E84B017E5FC8FD1_2D14242B0FBB370D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC=N[N]2CC(C)C""",21,"""5B3D336A683DE175"""
-"""686A66C23D74AFEA_0D478B034E8A3F5A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCC2=C(C)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""FB78A1892684BD9F_FFA567B84E50E66C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C(F)C=NC=C2)=O""",21,"""5B3D336A683DE175"""
-"""812B1E8D46633625_4BB5C3A8C40B1F2E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=CO2)C(OC)=O""",21,"""5B3D336A683DE175"""
-"""FF00E433AB481FB1_63A2A67DB22EDB4E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=CS2)C(OC)=O""",21,"""5B3D336A683DE175"""
-"""DFA65A4A7DD6EE8C_46D8987FF4E5C779_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=C(OC)C=C2)C""",21,"""5B3D336A683DE175"""
-"""ABB694456589D76E_A818DED866A83AAF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)N2CCNC(=O)C2""",21,"""5B3D336A683DE175"""
-"""4DF0E1F19537D604_A2A0EDC87D9EA332_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C([N](=O)=O)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""39718424E1AF4E29_54267CF96F048EEF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)CC2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""3D768657D7874E67_D07CB7C3A0B6B406_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(N=C(CCC)O2)C""",21,"""5B3D336A683DE175"""
-"""EB2A779910B2E447_17FCB046F1F344C0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC3=C(C=C2)COC3""",21,"""5B3D336A683DE175"""
-"""5B8E2204370DDF52_C4971B8AC5DD2115_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCC2=CC=CC(=C2)F""",21,"""5B3D336A683DE175"""
-"""02F7832E3CF027E2_3B6B431134FA010A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C(ON=C2C)C)=O""",21,"""5B3D336A683DE175"""
-"""D1D6CE0BC48F49F5_B4F273DF607F01C8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2=CC=CC(=C2F)F""",21,"""5B3D336A683DE175"""
-"""15C158C1AFA1564F_7FB531B972E8B188_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCN2CCN(C)CC2""",21,"""5B3D336A683DE175"""
-"""E10DF93E73FAFF73_FABC081508CE7EF8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCNC(NC(C)(C)C)=O""",21,"""5B3D336A683DE175"""
-"""5F40049B86BBA9AC_21E0A20D40E89F5F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=CN=CC(=C2)C)=O""",21,"""5B3D336A683DE175"""
-"""3EE147E240FCE532_A30D06ECF06EB1D1_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C(O2)C3CCC3""",21,"""5B3D336A683DE175"""
-"""D0CB2B68E8655DE7_6996150426170E98_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC(=O)C2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""E1E1ED614528E1D1_D2417122E62BA7AB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CSC3=NCCCN23""",21,"""5B3D336A683DE175"""
-"""EA6AD903BE9C8185_099D2FF4CF76FFF6_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCC[N]2N=CN=C2""",21,"""5B3D336A683DE175"""
-"""07CC9AD36E4E4290_75F92B583FA9EAF9_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C=CC(=C2)F)C#N""",21,"""5B3D336A683DE175"""
-"""3D095F7E979F5773_3A3E609C49F1CE36_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(N(C)C)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""7EBD960218EDC17E_6A9A2AEB3EEFCDB9_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C(C)=O)C=C2""",21,"""5B3D336A683DE175"""
-"""69960FDCC2A8548B_42158B12710FC77C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CSC(=N2)C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""B1EBE821B2389741_7283E7CAB908C6FE_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC2=CC=CC(=C2)F""",21,"""5B3D336A683DE175"""
-"""A018AE0EE89F2D7F_980C726B4114D566_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC[N]2N=C(C)C=C2C""",21,"""5B3D336A683DE175"""
-"""139C830CF0453D70_6CABF1A108B632F2_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=NO2)C(N)(C)C""",21,"""5B3D336A683DE175"""
-"""E37FDDE25C4F471A_95D416AEE93A2DCC_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC(=N2)C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""E50D0145CBBB3185_574F887DEF35D4D7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N(C)CC(F)(F)F)=O""",21,"""5B3D336A683DE175"""
-"""868E6717BF9A4750_A03C9DA8721BF8DF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CN=C(N(C)C)C=C2""",21,"""5B3D336A683DE175"""
-"""3BCA035525370E85_2C35AE017C8FC22C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C(OC)=O)O2""",21,"""5B3D336A683DE175"""
-"""1B221348D3AA8EEB_1F3527E328D8FD78_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2C(NC(C)C2=O)=O""",21,"""5B3D336A683DE175"""
-"""7B893DB79474BC81_6FD7B3128061D662_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C=C2)N=[N]#N""",21,"""5B3D336A683DE175"""
-"""CD34C010364B453F_E799B46766687DA1_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCC(NCC(C)C)=O""",21,"""5B3D336A683DE175"""
-"""335675F128689E04_9A35632B98BCAD7D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CSC(=N2)C(OC)C""",21,"""5B3D336A683DE175"""
-"""17DF75892ADC2C2E_0A8021D0285504F1_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CN(C2CC2)C(=O)O3""",21,"""5B3D336A683DE175"""
-"""072A51C08EE086E7_F8C253361F9ED655_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2(CCCCC2)C#N""",21,"""5B3D336A683DE175"""
-"""8FB1CF60935700D5_0A63E684C02B63BB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCCCCC(O)=O""",21,"""5B3D336A683DE175"""
-"""43527E314167244C_49E1C97E365760BB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2CC(OC(C)C2)C""",21,"""5B3D336A683DE175"""
-"""C67BC0C281249834_0DC6E26C9CA28B6F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C=C2)CC#N""",21,"""5B3D336A683DE175"""
-"""0DAC4EAC2047D1E1_77DD63DC99B63120_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C(C(F)(F)F)S2""",21,"""5B3D336A683DE175"""
-"""FFE6BD52D3447F42_541B6C5B549A7BF5_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2CC(C)CC(C2)C""",21,"""5B3D336A683DE175"""
-"""FA3D4C755E9E4882_655495F48F184F6E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2=C(F)C=CC=C2F""",21,"""5B3D336A683DE175"""
-"""91A8A5D24938F17E_C05F300E594C6980_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=N[N](CC)N=C2)=O""",21,"""5B3D336A683DE175"""
-"""AA2E5E44A55B42F9_42250808111102F0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=N[N](C(C)(C)C)N=N2""",21,"""5B3D336A683DE175"""
-"""208E155135ACD90A_E9FB2B188DDE71BC_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2NC(=O)C=CC2=O""",21,"""5B3D336A683DE175"""
-"""2B3A76C6F47A2F0C_1A2889E063BA1156_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2(C(OC)=O)CC2)=O""",21,"""5B3D336A683DE175"""
-"""7010BAF8999543BB_5475AD80495C097D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2C(CN(C)C2=O)=O""",21,"""5B3D336A683DE175"""
-"""7F0D39E09AA41D58_7C1149D5326C9F6F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=N[N]2CCCCC2=C3""",21,"""5B3D336A683DE175"""
-"""EBA54B9A20123169_AEAC10537E595A15_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2CN=C(C(C)(C)C)O2""",21,"""5B3D336A683DE175"""
-"""B122F16BDF0387FF_75D6808E647D238C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C[N](C(C)(C)C)N=C2""",21,"""5B3D336A683DE175"""
-"""6F9636694C4D975F_3B0D3AB015AE412A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC3=C(C=C2)C=N[NH]3""",21,"""5B3D336A683DE175"""
-"""771C705726CECDBF_518E0EDF223329C3_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCSC2=CC=CC(=C2)F""",21,"""5B3D336A683DE175"""
-"""17CF6461080838E4_AF74AE8A05249EF5_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOCC2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""88141A22269C2859_4F82ED8EEBFF1138_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC[P](N(C)C)(=O)N(C)C""",21,"""5B3D336A683DE175"""
-"""E904472CD835B049_6D5E11C333972CC3_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N=[S](N(C)C)(=O)C)=O""",21,"""5B3D336A683DE175"""
-"""A90556912761AB31_ED91A3B9F946116B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCSC2=CC=CC(=C2)C""",21,"""5B3D336A683DE175"""
-"""B37CC86319B268CC_32A65B8286F08383_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=N[N]2C)C3CC3""",21,"""5B3D336A683DE175"""
-"""37E850177330E8CC_1ABBA22F944F0A62_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=COC(=C2)[S](N)(=O)=O""",21,"""5B3D336A683DE175"""
-"""CFF1B269504E9D9F_729192FC07D73DDA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(OC)C2CCCCC2""",21,"""5B3D336A683DE175"""
-"""6B1555AF28A01AE1_EB1CA1D3F01BD7DD_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=C(C=N2)C)OC""",21,"""5B3D336A683DE175"""
-"""0834C3D5C9C8EC24_2B38CA569DB4F056_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=NO2)C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""0A2097F8E933CE8D_2A0AAADA6FE5D8B8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2)C(C)C""",21,"""5B3D336A683DE175"""
-"""B44BFC42ABB206A6_2DE1A030FDCB8D20_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=COC(=C2)[S](C)(=O)=O""",21,"""5B3D336A683DE175"""
-"""520A4E2446C7E284_A3CD672ED6715293_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC#CC2=NC=CC=C2""",21,"""5B3D336A683DE175"""
-"""6B5DEF56AB3FABE8_E3E181FF6FEED4EA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=CC=C2)N=[N]#N""",21,"""5B3D336A683DE175"""
-"""86BA2D10C68925F5_ED9A03581D943C35_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=NO2)C3CCC3""",21,"""5B3D336A683DE175"""
-"""36472292DDC5B006_E3716E4C6A16B7EF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=C(C)C=C2)C#N""",21,"""5B3D336A683DE175"""
-"""B994B4E2B7831D48_11B387020C42A6CF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(N=C(C)C=C2C)C""",21,"""5B3D336A683DE175"""
-"""AB52B60450F98685_7515BB7639AC12B0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2C)OC""",21,"""5B3D336A683DE175"""
-"""9986E9CEB349D5D9_63C22D8811B3B92B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=NO2)CC3CC3""",21,"""5B3D336A683DE175"""
-"""49D4AF2CF2DD1445_CD9052C0F8414AF6_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C(C)(C)C)O2""",21,"""5B3D336A683DE175"""
-"""EFE231DC0BE0EF4E_162CA6E31A9FDD65_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C=CC=C2)N=[N]#N""",21,"""5B3D336A683DE175"""
-"""01D7BE7D9919603C_25E0B8FBCC274561_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(OC)=O)C=CS2""",21,"""5B3D336A683DE175"""
-"""E79BCDE109B2BDC3_109D16D63A4C40C1_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2=NC=CC=C2""",21,"""5B3D336A683DE175"""
-"""4D284F880BEC2B67_FD914DC535C6E417_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CC2(CCCC2)CO3""",21,"""5B3D336A683DE175"""
-"""C8EA4DB9B86CE0D6_3128015CCC4363AA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C(F)C=CC=C2)=O""",21,"""5B3D336A683DE175"""
-"""8E82513783A32FA3_CA705248F002EE61_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=CS2)C(OC)=O""",21,"""5B3D336A683DE175"""
-"""DC6D8E0F0D36C8C6_494E895DED6D02B3_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(CCOC2)O3""",21,"""5B3D336A683DE175"""
-"""B79AE259D5DA4338_40D826EB65F8A90C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=CO2)C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""FF3189379D60AC9C_BFFF3FB3512F3D7F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(CCCC2)O3""",21,"""5B3D336A683DE175"""
-"""29D96C6EFE9D9F53_D77546435AE99C6C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C([N](=O)=O)N=CC=C2""",21,"""5B3D336A683DE175"""
-"""C434D82DF774745E_92F7E81DF29BE229_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC(=N2)C3CCC3""",21,"""5B3D336A683DE175"""
-"""AE9774D1AA9142AF_EBBB71F43429A651_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC=C[N]2CC(F)F""",21,"""5B3D336A683DE175"""
-"""82E4357419248CB7_9E7832761A57D368_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CCC2(CCC2)CO3""",21,"""5B3D336A683DE175"""
-"""E3862FF57A40C498_AE42BD2525B6A850_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CN=C(N=C2)C3CC3""",21,"""5B3D336A683DE175"""
-"""62B66B2542496393_53409B9938224B11_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=COC(=N2)C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""636EFB8258AFB33F_1E423E842E0BD372_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2=NC=CC=N2""",21,"""5B3D336A683DE175"""
-"""5EC53E02B7E128CC_613ED08792062BEA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=C(OC)C=C2)F""",21,"""5B3D336A683DE175"""
-"""734BB1D2B344A6D0_58D269868F0E3476_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC3=C(C=C2)[NH]C=N3""",21,"""5B3D336A683DE175"""
-"""B20F5B01C5C73857_5979DBD0B72F8713_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC2=CC=C(F)C=C2""",21,"""5B3D336A683DE175"""
-"""6C2800B103CCE2BF_E5A4993AF1AF4F73_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=CC=CC(=C2)F)=O""",21,"""5B3D336A683DE175"""
-"""64BA21FCBAAA88FD_DD82E0A6BAEE5FFB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=COC(=N2)C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""A9418AC5A000178C_ABB9B06836CE9B40_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CC2(CNC2)C(O3)=O""",21,"""5B3D336A683DE175"""
-"""1AE58D3305DA2B89_9FEACBBA85904A80_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCSC2=C(F)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""421F43A70562FD9B_E9C58FF48CDC58DC_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2CCC(C(F)(F)F)O2""",21,"""5B3D336A683DE175"""
-"""E435010F369DD5F0_E6347EBC81FD4016_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=CC(=C2)C#N)F""",21,"""5B3D336A683DE175"""
-"""005D5A8031E074A2_E5AD654A574DD309_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2CCCCC2""",21,"""5B3D336A683DE175"""
-"""8E7052F1A0BD23CF_304E7E94755F1546_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC2=C(F)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""75769B744A13AF3C_B4E31F5A55A5A790_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC2=CC=CC(=C2)C""",21,"""5B3D336A683DE175"""
-"""D0382B9B375EF581_49E53B1F133EE718_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(SCC)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""22AFEED31E474E30_986990D592F85834_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=CO2)C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""A1A49FFBC24FAA08_CBBCD9BFD94654C8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C[N](C(C)C)N=C2C""",21,"""5B3D336A683DE175"""
-"""0DD41071E8D61030_EEE30008BC5B5257_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CCCC2(CCC2)O3""",21,"""5B3D336A683DE175"""
-"""0ED0061A444412D8_FEB24CE88141E447_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC3=C2COCC3""",21,"""5B3D336A683DE175"""
-"""47F0B27A7209C1AA_621B553C6C58FE19_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(B(O)O)C=C2""",21,"""5B3D336A683DE175"""
-"""44CCBDED3C0C9051_75EB5E0EAEBFBB68_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3OCC2(CCNC2)C3""",21,"""5B3D336A683DE175"""
-"""C8578A55D01CC2C0_7FF51F4116FA0F82_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=N[N]2C3CCC3""",21,"""5B3D336A683DE175"""
-"""966FC8B7980F0CCF_4924D5B277AA9B19_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(C)C)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""FC80CF39A2CDC06E_996D293F06661DF7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)C2=CC=CNC2=O""",21,"""5B3D336A683DE175"""
-"""696E26767222A3E3_1C71167220831A45_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C(N=C(C)S2)C)=O""",21,"""5B3D336A683DE175"""
-"""BD778BD5C462C77E_97FC84F0A1200AB6_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCC2(CCC2)C#N""",21,"""5B3D336A683DE175"""
-"""B8AEE94359E6A6EC_2DCE32457F31B691_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(ON=C2C)C3CC3""",21,"""5B3D336A683DE175"""
-"""52B7A42986D54ECA_230902D48ACEB35F_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2OC(CC23CNC3)=O""",21,"""5B3D336A683DE175"""
-"""A5362A4DB0D31578_33D30B089B098BC0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2OC(=O)CC23CCC3""",21,"""5B3D336A683DE175"""
-"""244C6D1E57ACC783_FCBE07066843F2CF_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2(C(O)=O)CCOC2""",21,"""5B3D336A683DE175"""
-"""ECBB814499485DD2_BE5003AEB83DF478_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(CC(OCC)=O)(F)F""",21,"""5B3D336A683DE175"""
-"""8823CB023A3ECCA9_1E34A8ABCBB7B900_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(CCC)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""439D020FB12CB347_D0E86F0EC9D1EAE7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2CCC(F)(CC2)F""",21,"""5B3D336A683DE175"""
-"""987F43585674C454_E7E1954A3E278FDC_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NC2=NN=CC=C2""",21,"""5B3D336A683DE175"""
-"""FE47E61D8CAF4B0F_89D803B428C65F11_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=N[NH]C3=C2COCC3""",21,"""5B3D336A683DE175"""
-"""621B648928DA03E7_8461EC6720200A92_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(F)F)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""B5C05E1CCDB93293_C015052091809472_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CSC(=N2)COCC""",21,"""5B3D336A683DE175"""
-"""BD29FECAB045F1AC_7654BB023BC46C64_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=C2C=CC=CC2=NO3""",21,"""5B3D336A683DE175"""
-"""D9186921010CDA59_1CD93CEC966F3681_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC3=C(C=C2)[NH]N=C3""",21,"""5B3D336A683DE175"""
-"""46175D2393099039_43B9BE2D4B9E5AD4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC23OCC(C)(CO2)CO3""",21,"""5B3D336A683DE175"""
-"""5ACDC37F2F4D9498_7005C07CE42FA65D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C([N](C)N=N2)C(F)F""",21,"""5B3D336A683DE175"""
-"""1CC88F9C7F87CD46_1DD1875E0C10E588_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=NC=C2)OCC""",21,"""5B3D336A683DE175"""
-"""3828EB1A5043EAD0_CA4FEAFAE3EF2744_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=NO2)C3CNC3""",21,"""5B3D336A683DE175"""
-"""6D1EC0F1549EC7E9_1DD1ED1A4627AC03_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC[S](CCC(O)=O)(=O)=O""",21,"""5B3D336A683DE175"""
-"""6C2F697055DE2B0C_C36B9C39EB1F2DE1_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=N[NH]C3=C2C=CC=C3""",21,"""5B3D336A683DE175"""
-"""312D98AA95825E20_52BF4D0C5630B9E4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCO[S](C(F)(F)F)(=O)=O""",21,"""5B3D336A683DE175"""
-"""7CEF0CDBEBEB0BF3_17D899C2D8093970_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=C2SC=CC2=CC=C3""",21,"""5B3D336A683DE175"""
-"""37B0C91BF7B44A3A_E2256E87BA36C23A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC3=NC=N[N]23""",21,"""5B3D336A683DE175"""
-"""354683AB96CA84BF_F0007533FE8F2F42_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2CCC(F)(F)C(N2)=O""",21,"""5B3D336A683DE175"""
-"""D40B510C2FA4EB39_ED353613C70F2723_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C[N]3C2=NC=C3""",21,"""5B3D336A683DE175"""
-"""EA6E3AABDF14B4D8_4F35561C8CA83EFE_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CC2COCCC2O3""",21,"""5B3D336A683DE175"""
-"""3CF9718DC4E84585_36BD35110070B54F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)CCC2CCCC2""",21,"""5B3D336A683DE175"""
-"""38F51DFD018E80BF_9E604403E619A3C4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C(C)SC(=C2)C)=O""",21,"""5B3D336A683DE175"""
-"""C1FE90D5693933CB_2E1F6EA10813F94A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC[S](CCOC)(=O)=O""",21,"""5B3D336A683DE175"""
-"""74766F84EF5391BD_55867F48C9C3254D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CSC(=N2)NC(C)=O""",21,"""5B3D336A683DE175"""
-"""CB43F1E85A55047F_A0364C1DF6AB94BF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=N[N]2C3CCC3""",21,"""5B3D336A683DE175"""
-"""D068A7C695DA71DF_9EE040206DA2B77F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC(=N2)CC(C)C""",21,"""5B3D336A683DE175"""
-"""77BE51666DFADDFE_295425F230348942_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC2=C(C)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""50B704EE1BECBF09_82D841DD409ADDBB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=N[N]2CCCC""",21,"""5B3D336A683DE175"""
-"""A8B4096B8440B112_B5B84D030F65AF06_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C(C(F)(F)F)O2""",21,"""5B3D336A683DE175"""
-"""14D679A3D537A22C_49FE94AB07BA6686_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=C(F)C=C2)C#N""",21,"""5B3D336A683DE175"""
-"""90367095ECA27922_6604A6C4A5A52574_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C([S](C)(=O)=O)SC=C2""",21,"""5B3D336A683DE175"""
-"""DFA9719F4876F0E0_1B93CEED2C6A4F8F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C([S](C)(=O)=O)O2""",21,"""5B3D336A683DE175"""
-"""1BF8A7FF323E5808_43B3880D59D5F04B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NSC3=C2C=CC=C3""",21,"""5B3D336A683DE175"""
-"""73DFB6ECCD340318_27E79311F22287E8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(OC=N2)C3CCC3""",21,"""5B3D336A683DE175"""
-"""AA472D6EAB003D3C_144D0AC5321FC884_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC2(CCOC2)C#N""",21,"""5B3D336A683DE175"""
-"""C35917F4C879B789_8587A0C2C76131D3_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2C3CCN(C2)CC3""",21,"""5B3D336A683DE175"""
-"""CF8BE50EEAB8F37C_F79E8A4BEB9EAFA0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=CC2=NC=N[N]2C=C3""",21,"""5B3D336A683DE175"""
-"""E9AA87E7D254DE19_53885BB33DC65FD4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=NO2)C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""C62174D2084627DB_B3D573A122DCB2F6_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2NC(=O)CC23CCC3""",21,"""5B3D336A683DE175"""
-"""72EE5601718355BB_267A1E2C6755736D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(CCCC2)[NH]3""",21,"""5B3D336A683DE175"""
-"""CF63C46621940A54_BA04EAC5D9647BCB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2CCCC(O2)C3CC3""",21,"""5B3D336A683DE175"""
-"""06C738FED30664B7_517FEA8C902EA0DD_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(CCCC2)S3""",21,"""5B3D336A683DE175"""
-"""F26ABA2A91740DBE_F1CB6036DD4E6952_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=CC2=NSN=C2C=C3""",21,"""5B3D336A683DE175"""
-"""5722B2611B407EE8_A58F356B30F24D6C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=CC=C2)C3CC3""",21,"""5B3D336A683DE175"""
-"""20FBEC2F50D8000E_814688F892941DC8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(OC)C2CCCOC2""",21,"""5B3D336A683DE175"""
-"""727AD62136D72F4A_EA763FC8DB61DDC8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=N2)CCC""",21,"""5B3D336A683DE175"""
-"""60892ABFD7987F14_EA259AB689BBF049_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CN=C(OC)C=C2C""",21,"""5B3D336A683DE175"""
-"""A03C2BE9136DE643_42335FF0E7D9BB9B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC3=NC=C[N]23""",21,"""5B3D336A683DE175"""
-"""73FA14E5419A1D92_9C1309F8BDF307A8_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)C[C@@H]2O[C@H]2C3=CC=CC=C3""",21,"""5B3D336A683DE175"""
-"""BBA2C57CD1207734_12EB9B3A5023EB52_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=CC(=NC=C2)F)=O""",21,"""5B3D336A683DE175"""
-"""0804E9EB8CBCF109_9AF1E7E093327D32_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2=CC=CC(=C2)OC""",21,"""5B3D336A683DE175"""
-"""ED71096C3FB36E12_2D6BD820A2087EF8_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC2=CC=C(O)C=C2""",21,"""5B3D336A683DE175"""
-"""C78B270DBEF874D8_082F6B27CE9F736D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3[N]2C=CN=C2CCC3""",21,"""5B3D336A683DE175"""
-"""B1D07D3598F2B09A_9AA45523C7611D87_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2ON=C(C(C)(C)C)C2""",21,"""5B3D336A683DE175"""
-"""26D080E42E334795_3E702E6A0D490245_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CCC2(CCOC2)O3""",21,"""5B3D336A683DE175"""
-"""3FF498437B5F94DD_6468FAFBE5B9FA58_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=N[N](C(=C2)C)C)=O""",21,"""5B3D336A683DE175"""
-"""9A76350E9CC4AA51_432C0D92BDF576D0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(COCC2)S3""",21,"""5B3D336A683DE175"""
-"""D4AC8BE309BF29CF_FBC5B17E52184B57_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2CC(C)(C)NC2=O""",21,"""5B3D336A683DE175"""
-"""899AA411EA4F8DA5_6663E4D42FF1A187_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2=C(OC)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""EEBA47855D945157_9359460E3B81E507_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N(C)C2CCCC2)=O""",21,"""5B3D336A683DE175"""
-"""2D5BF62E7C5912C0_8DF0E8E2A0921E1A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C=CC(=C2)OC)F""",21,"""5B3D336A683DE175"""
-"""5FD3550792EAF74A_DD1E1707486DC091_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC=C(C(O)=O)C=C2""",21,"""5B3D336A683DE175"""
-"""D3A973D93B9B6166_257F484F8E45B985_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2C(C)(C)C2(C)C)=O""",21,"""5B3D336A683DE175"""
-"""A5ACC88D73877FD6_D58D2F12CD209E20_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=CC=C2)CC=C""",21,"""5B3D336A683DE175"""
-"""DB2AA5D217703F86_753518E0D4E7D1DF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C=CC(=C2F)C)F""",21,"""5B3D336A683DE175"""
-"""0678D18CF76A5F7F_12425168A3AD9B15_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(C)C)ON=C2C""",21,"""5B3D336A683DE175"""
-"""17EEAF0772B28207_8D63B2F75A64AA9B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCO[Si](C(C)(C)C)(C)C""",21,"""5B3D336A683DE175"""
-"""C4E6237E9E1D1758_3CD57D03B285EB21_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC[S](C(C)(C)C)(=O)=O""",21,"""5B3D336A683DE175"""
-"""61089BB2D50E8AA8_8E2CB2B128C94DA0_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(OC)C=CC=C2F""",21,"""5B3D336A683DE175"""
-"""155D4D0DB454C52E_2EE1C08E8759CFFD_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C[N](CC)N=C2)=O""",21,"""5B3D336A683DE175"""
-"""A1A0C6381ACABAD7_A4C49D64A30E1E5D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC[P](OC)(=O)OC""",21,"""5B3D336A683DE175"""
-"""DA331A788DB47D61_AD120E0D24AAD6D0_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CC2(CCN2)C(O3)=O""",21,"""5B3D336A683DE175"""
-"""CB8ECA306B6D0320_2203261853F9A260_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(F)(F)F)OC=N2""",21,"""5B3D336A683DE175"""
-"""4D8594854DF43BC1_75FBA19B0DB8AB54_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=CC(=N[N]2C)C)=O""",21,"""5B3D336A683DE175"""
-"""624405F7A5128383_B163B63600B7335D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)C2=CNC(C=C2)=O""",21,"""5B3D336A683DE175"""
-"""C05B1C7E1C4077AB_BA705CB7E25CA295_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C=C(OC)C=C2)F""",21,"""5B3D336A683DE175"""
-"""98AA96C94D133E7E_1E095F79EB1DCA82_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2=C(C=C(C)C=C2)C""",21,"""5B3D336A683DE175"""
-"""4D35950579EE7BEA_7E6588130AE04AAE_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=NO2)C(C)(F)F""",21,"""5B3D336A683DE175"""
-"""50AE876ABD06655B_129362EA03754623_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CC2CCCCC2O3""",21,"""5B3D336A683DE175"""
-"""10ADBC697A4D56E9_6F04C1DFA02E9C47_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CON=C2C(C)(C)C""",21,"""5B3D336A683DE175"""
-"""695DD293501BA6F4_666C80AAFF5DBB7A_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=C(C2CNC2)OC=N3""",21,"""5B3D336A683DE175"""
-"""19CFA06C2115B322_C04E6B9CED59F1F5_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCN2CCOCCC2""",21,"""5B3D336A683DE175"""
-"""CD089E5007EDB460_4645762DFD0AD88A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3COC2=CSC=C2O3""",21,"""5B3D336A683DE175"""
-"""171219938B8D514A_54C04A9A06ADDE35_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C=CC=C2)CC=C""",21,"""5B3D336A683DE175"""
-"""14C4FA81040BB8BA_AFFB3FF4C56F88DC_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CON=C2C3CCC3""",21,"""5B3D336A683DE175"""
-"""78642BD25642862F_9F14EBC40E11FEF2_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC=CC2=CC=CC=C2""",21,"""5B3D336A683DE175"""
-"""58606EB6208955F0_8936CBC5084FC7EA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCN[S](=O)(=O)C2CC2""",21,"""5B3D336A683DE175"""
-"""0C720548C2DBE700_D239058E6207A1D3_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C[N](C(C)(C)C)N=N2""",21,"""5B3D336A683DE175"""
-"""31D0B643CBD2AC2A_D7895A3A1F1097E4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C(C)C=CC=C2)=O""",21,"""5B3D336A683DE175"""
-"""BBCBD1DF1F037048_D65CCFA38246D6F7_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CC2(CCNCC2)O3""",21,"""5B3D336A683DE175"""
-"""8184907AEE8BA692_29CC6572050D32BB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2(C(F)(F)F)CCC2""",21,"""5B3D336A683DE175"""
-"""3E59AB1065A621D0_9680A4647D83F011_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CSC=C2C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""08E5F81A123E11E4_907AE306219E03E6_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2C(C)(COCC2)C""",21,"""5B3D336A683DE175"""
-"""8BA3B4D8E7A426F8_85EA9F018E1BE499_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C([S](C)(=O)=O)C=CS2""",21,"""5B3D336A683DE175"""
-"""50F9DF7FF12F9738_3557D0DF6269E491_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(OC)C=CC(=N2)C""",21,"""5B3D336A683DE175"""
-"""35969B8667D354F3_DCE1EAA586AB2E78_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2CC[S](=O)(=O)CC2""",21,"""5B3D336A683DE175"""
-"""BBCE0501E500BF7F_C47BB95E580E5B51_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NSC(=C2)C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""353254422DEFB708_6AC04E6A400D0874_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(N=C(OC)C=C2)C""",21,"""5B3D336A683DE175"""
-"""7B8314FBF7932BE7_596D2EA5D9487C25_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CSC(=C2)C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""A69B28EF3BBE9AD1_DEFFDB054657C66A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCCCC2OCCO2""",21,"""5B3D336A683DE175"""
-"""EBD44CD608F73BDB_E9D35BC15F50818B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CC2(CC2)[S](=O)(=O)N3""",21,"""5B3D336A683DE175"""
-"""B618EAB3AD64DC05_542E6E02333ED371_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC3=C(C=C2)N=N[NH]3""",21,"""5B3D336A683DE175"""
-"""ACBC8F8A221779FC_8E9EE344E8F56EA1_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC3=CC=N[N]23""",21,"""5B3D336A683DE175"""
-"""E19CFC880D4E396D_817A8327E717B5C4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(COC)C=CC=C2""",21,"""5B3D336A683DE175"""
-"""EA790465C029C81F_7AE940F47276FADF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCC2=C(C)C=CN=C2""",21,"""5B3D336A683DE175"""
-"""DDA8160FC77F753E_A939232E233FF95E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(C(OC)=O)CO2""",21,"""5B3D336A683DE175"""
-"""A4507F679A88AC19_26E182B70B909730_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=CC=C2)CC#N""",21,"""5B3D336A683DE175"""
-"""ED3FD98F5F8A5B6F_9B31A9AFAC73C839_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=CS2)C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""97F43E1AFD549DF5_AB28E2F7E9FEADD2_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=N[N](C)C=C2[N](=O)=O""",21,"""5B3D336A683DE175"""
-"""DA9802BC00BCC290_B08E6EC24E30B456_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=NO2)C3CNC3""",21,"""5B3D336A683DE175"""
-"""EAA37286F16B28A1_D54A602BCF6787C6_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC3=C(C=C2)C=CO3""",21,"""5B3D336A683DE175"""
-"""5CC6F94B0DE530EB_12E45E365FA2670C_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N2CCNCC2C)=O""",21,"""5B3D336A683DE175"""
-"""065DE33316DD57F0_03D37FE130C110BF_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NC2CCNCC2)=O""",21,"""5B3D336A683DE175"""
-"""56ABBFE2E4C635F5_ECB72E04F473596C_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2(CCNCC2)C#N""",21,"""5B3D336A683DE175"""
-"""4D892DE4DA9F3CF6_54713B7C876874AC_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C3C=CC=N[N]23""",21,"""5B3D336A683DE175"""
-"""3EF27F48E4726597_6D7A6E165FBC9076_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=CC2=C(CNC2)C=C3""",21,"""5B3D336A683DE175"""
-"""C0DF2F9BD5A45E4C_75375948EF5A46CF_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NCC(C(OC)=O)O2""",21,"""5B3D336A683DE175"""
-"""072624EA49B0D63C_1E57F8F1540A5A57_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCNC(=O)N2CCCC2""",21,"""5B3D336A683DE175"""
-"""7730515E97C4D34A_0EB6E503F71DA4B1_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC(=C2)CC(C)C""",21,"""5B3D336A683DE175"""
-"""5C7BA5E556E011E2_BDF9774671DBB5BB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=N[NH]C(=C2)C(OC)=O""",21,"""5B3D336A683DE175"""
-"""B2EE9891311F437E_B55650A9FC5D8716_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(N2CC(C)NCC2)=O""",21,"""5B3D336A683DE175"""
-"""DC2A211E70C8A46E_61D48A94F6DBEA8D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=CC2=C(C=CC=N2)S3""",21,"""5B3D336A683DE175"""
-"""B8FFAEEA36086C27_E8475D163868EFE9_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=NC(=C2)C)OC""",21,"""5B3D336A683DE175"""
-"""E21B66BF9E5D7484_AC1FD185ACC04FA2_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2CNCC3(O2)CCC3""",21,"""5B3D336A683DE175"""
-"""9A2670ADC73EAD09_A600EBF2C711951F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=NC(=N2)OC)C""",21,"""5B3D336A683DE175"""
-"""96FFDFDA52BD39E0_83744990C402FFF7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCN2CCCO[P]2(N)=O""",21,"""5B3D336A683DE175"""
-"""0820344A578D377A_4413454829BF72CC_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=N[NH]C3=C2CNCC3""",21,"""5B3D336A683DE175"""
-"""2D73F10FD4A10113_837B86997145618E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C3C(=N[NH]2)CCCC3""",21,"""5B3D336A683DE175"""
-"""925091D5ED6024F9_39C9195CDED2148E_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2=C([N](N=C2C)C)C""",21,"""5B3D336A683DE175"""
-"""AD8EF3BD4B3A1D8D_8CF05A7F8C07DBD7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(OC)=O)SN=C2""",21,"""5B3D336A683DE175"""
-"""CCE8D711B378FA86_8ABAE0B31BAFBDD5_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(F)F)C=NC=C2""",21,"""5B3D336A683DE175"""
-"""9A2A099F0EE4FC86_0674279A108CABC7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(F)(F)F)SC=C2""",21,"""5B3D336A683DE175"""
-"""D3A33D1CCA14FCB5_9FA26F9728C59D6D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2(C(F)(F)F)CC2)=O""",21,"""5B3D336A683DE175"""
-"""60DA7181777D4D15_AF6891CBF7D07ACB_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2CNC3(CO2)CCC3""",21,"""5B3D336A683DE175"""
-"""FC95256E05877E2D_EB1B33931EEE1F73_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(C)(C)C)OC=N2""",21,"""5B3D336A683DE175"""
-"""8CE178F0F05E51F1_EB14109186FC128B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOCCOCCOC""",21,"""5B3D336A683DE175"""
-"""F77B2C3A0B99AAFC_23DCA5F7EE4F8C48_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C(C(F)(F)Cl)S2""",21,"""5B3D336A683DE175"""
-"""9B7F8BF724A41EBF_01CDEEB873AC26FB_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC(C(OCC)=O)(F)F""",21,"""5B3D336A683DE175"""
-"""CF1DEB2BB5D8F5D0_6D19D6EFDE2139E7_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(SN=C2OC)OC""",21,"""5B3D336A683DE175"""
-"""1E2104D904469573_627B89BF8F8906F3_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NOC(=C2)CC3CC3""",21,"""5B3D336A683DE175"""
-"""CF3195E232AB5FE6_23BC66248F453430_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC3=C(C=C2)OCO3""",21,"""5B3D336A683DE175"""
-"""5427F62D6FAD62D2_48350269586091CA_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC(=C[NH]2)C(F)(F)F""",21,"""5B3D336A683DE175"""
-"""AF4D4AA6D4D8F8C1_313489A5A155CC65_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NO[C@@H]3CCCC[C@H]23""",21,"""5B3D336A683DE175"""
-"""1274769D9053135C_BC3D0AD8ED5D847F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=NC(=N2)COC""",21,"""5B3D336A683DE175"""
-"""963A886A084163B8_2828169B5C537690_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC3CC2CCC(N2)C3""",21,"""5B3D336A683DE175"""
-"""FE52D5072267443C_883600BFC7CB1221_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2)C(N)=O""",21,"""5B3D336A683DE175"""
-"""978CF86B43FF9106_4D5EA72837702A5A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C(OC)=O)S2""",21,"""5B3D336A683DE175"""
-"""88123F6454A25737_558E703EA15E154A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NCCCC(O)=O)=O""",21,"""5B3D336A683DE175"""
-"""554EEEAB9BAE8CE1_3DCEA443EF245F2C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(=O)NCC2=CC=CS2""",21,"""5B3D336A683DE175"""
-"""0AB75A53B37316DA_77827CF43026D8E4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC3=NON=C23""",21,"""5B3D336A683DE175"""
-"""FC7B1DC37014AEE3_676A7DAA51E36AC4_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=C[N]2C=CC=NC2=N3""",21,"""5B3D336A683DE175"""
-"""933AC2FF0B7BD186_F8F8036A9D450E41_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC2CCCCC2C""",21,"""5B3D336A683DE175"""
-"""F6E70D6DBEEFA44C_2A46A39F6F21A0EB_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=CC2=C(C=C[NH]2)C=C3""",21,"""5B3D336A683DE175"""
-"""B0A29E1CB4E1EEA9_AD3C8D790DDAEE3C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C(=NO2)C)[N](=O)=O""",21,"""5B3D336A683DE175"""
-"""5345133BA95075E8_4B34E6E338766F67_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOC2=CC=C(C)C=C2""",21,"""5B3D336A683DE175"""
-"""47B167AA576AF5A2_40B6574CF18D727C_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCOCC(C(F)F)(F)F""",21,"""5B3D336A683DE175"""
-"""CF5A5FA3DBD7D200_A65220578EC19914_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NC(NCCC)=O)=O""",21,"""5B3D336A683DE175"""
-"""BC9916CF5CA5FE49_0041461D443105C2_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C([N]2C)C3CC3""",21,"""5B3D336A683DE175"""
-"""1D3C59022AA8B346_572B0BDDB150314D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NN=C(S2)C3CCC3""",21,"""5B3D336A683DE175"""
-"""F6D80DBF54028026_9C1EA2ADF4DB3B6F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=CC(=C2)C(F)F""",21,"""5B3D336A683DE175"""
-"""823BFA31E20AC2D8_2554E8571A5E193A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=C(C=C2)C)OC""",21,"""5B3D336A683DE175"""
-"""EEF06ABA24779CFA_3D63D837F267ED65_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=C(C=CC=C2)C3CC3""",21,"""5B3D336A683DE175"""
-"""4498BEAA2BDE0BE1_27B8814F35002078_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3CC2(CCC2)C(=O)O3""",21,"""5B3D336A683DE175"""
-"""03C8A9751768AEBE_1F36C782075E8293_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(NCC(C(C)C)=O)=O""",21,"""5B3D336A683DE175"""
-"""CC30974E0982995E_9A2D9F010295A5F9_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NC2=C(C=CC=N2)O3""",21,"""5B3D336A683DE175"""
-"""596ADEA0DB6A3815_270BA0D10D1F8C22_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCC2=CC=C(C=C2)C#N""",21,"""5B3D336A683DE175"""
-"""7453B0824815EB62_7506891EFA1FF99B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=C(C=C2)C#N)C""",21,"""5B3D336A683DE175"""
-"""51F9BE4F44A9744A_1C4F0FA63659D184_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CCCN2C(=O)CNC2=O""",21,"""5B3D336A683DE175"""
-"""1A5F90376462D0C9_6C907B35950D987D_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C=C2)C3CC3""",21,"""5B3D336A683DE175"""
-"""F3AE8E772E2E1191_46C781014198B67F_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=NC=N[N]2CC(F)F""",21,"""5B3D336A683DE175"""
-"""74751EE8534F642A_0EAB60889A6A698B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC(=C(OC)N=C2)C""",21,"""5B3D336A683DE175"""
-"""6D5917255D003E51_A055DE0FA682F2ED_6039_DP""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC3=NN=C(C2CNC2)S3""",21,"""5B3D336A683DE175"""
-"""AE04EEA1D614C9B5_7F8DB8EF40AD3E3B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC(C2=C(C)[N](N=C2)C)=O""",21,"""5B3D336A683DE175"""
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-"""FA156D2BA3FC2169_8B55377F9CC15908_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC1CCSC1=O)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""A68C111F016A0797_618B9FE807EC8FB0_6039_UN""","""CC(C)(C)[N]1C=C(COCCCOC(NC(N)=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
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-"""1DB06D2F02AA30A7_D27C8CB17B007182_6039_UN""","""CC(C)(C)[N]1C=C(COCCC(N(C)CCC#N)=O)N=N1""",21,"""071C4F5F52D57B8B"""
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-"""0443CDA53E32FD80_591AABB4E10BC419_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(OC)=O)C=NO1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""48551BC36A73722B_7284DBCC9C6EC3FF_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NN=C2[N]1CCOC2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""07412F73D6CF04B8_72B1E35314577373_6039_UN""","""CC(C)(C)[N]2C=C(COCC(OC)C1=CC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""7CDC409FCA0D30E3_049809B3E696583E_6039_UN""","""CC(C)(C)[N]2C=C(COCCSCC1=CC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""4DC78FCBF0740567_58928066158D20B2_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CSC(=C1)C(OC)=O)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""B649417CF89F98A7_8B5912835504C845_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NCC1CCCO1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""6BAAFACCFB957ABE_8BCE7CD1BAE703DE_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)N1CCCCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""37624D25BB4192CD_F3417789AC601C8C_6039_UN""","""CC(C)(C)[N]2C=C(COCC(N1CCCC(C)C1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""C3C9DCA8EF99C744_C86D35C7CE52B7D9_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=C1)C(C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
-"""E0CCF8462273323F_090AA70C392622AE_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(O)=O)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""424F414A14BD82DC_3286BE4EEBC94609_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=CO1)C(OC)=O)N=N2""",21,"""071C4F5F52D57B8B"""
-"""23F9DAD7DD40D720_D3835FCC0DC117DD_6039_UN""","""CC(C)(C)[N]1C=C(COCC(NCCCCCC)=O)N=N1""",21,"""071C4F5F52D57B8B"""
-"""57F5E3D40945FE06_0E479A4F459EB479_6039_UN""","""CC(C)(C)[N]1C=C(COCC(NCCCOCC)=O)N=N1""",21,"""071C4F5F52D57B8B"""
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-"""2A3ED654D1530B72_0854D1B573B49383_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1C(CN(C)C1=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""F052DD5C691C8599_29F7FCBB5E95B972_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C[N](C(C)(C)C)N=C1)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""35ACFA945DB077D2_762BD6EF550D4246_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=C1)C(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
-"""41545A48B4857F30_71C0DC05C72317DE_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=COC(=C1)[S](C)(=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""7CCF73B88DE84859_BF50127950FE2D11_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=C(C)C=C1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
-"""D5FC85578D1D49BB_4D92FB3736AA3C31_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(N=C(C)C=C1C)C)N=N2""",21,"""071C4F5F52D57B8B"""
-"""CD5664DC22DFFBEF_2934C7430344884E_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=C1C)OC)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""46A3C45D0839F393_91B12EF5C2A9D008_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(C(C)(C)C)O1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""632445BE5CB49754_4A0DDAD62077479B_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C=CC=C1)N=[N]#N)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""3F8F56DA9B82CC4D_4CBC6AE300A4DA3F_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC1=NC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""C780CA9CD4445E2D_A1B031F00F2E7EE9_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CC1(CCCC1)CO2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""52DCC9E1D7D14826_6D097D69F6ABF954_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=C(F)C=CC=C1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
-"""D30CFFF32D7193E7_96512E7DCAEA749F_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=CS1)C(OC)=O)N=N2""",21,"""071C4F5F52D57B8B"""
-"""88A2228568B7D31F_156FF568D785984D_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(CCOC1)O2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""DF5731F71A8879D6_1CF95ADE5F1033F2_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=CO1)C(F)(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
-"""EB2BA3DDCEF23444_E3DE43866BC7A781_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(CCCC1)O2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""E30199CB0B189099_8B543A7660010692_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C([N](=O)=O)N=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""B6D5C4A00E9FF282_CED69428C87378D7_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NOC(=N1)C2CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""8B795B031F1A0997_B79A0DC10EC13CAF_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC=C[N]1CC(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
-"""4C9E30D33E9359C4_C2594E4320BF4996_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CCC1(CCC1)CO2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""40BD966F792B41AD_F263C1101F5E32AE_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CN=C(N=C1)C2CC2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""2506BD9113CDCE02_0F61E7AC02CAD1EF_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=COC(=N1)C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
-"""CB41D9F36BD8AB8F_426342B114E3498C_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC1=NC=CC=N1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""B6BEE8BC1847BCFD_3D1FACB2A8EEB114_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=C(OC)C=C1)F)N=N2""",21,"""071C4F5F52D57B8B"""
-"""A19274727A557C4C_04F315B3B5E6AE88_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC2=C(C=C1)[NH]C=N2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""4B6E5F87CB1F6909_0558A7E58DC71DED_6039_UN""","""CC(C)(C)[N]2C=C(COCCOC1=CC=C(F)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""8F99FFE4FDE45EAB_B985E50FCB47D58D_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=CC=CC(=C1)F)=O)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""8FC515B49EBD2997_723E129432FB63B4_6039_UN""","""CC(C)(C)[N]1C=C(COCCC[S](CCOC)(=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
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-"""564DD8FFD832C71A_7A5B62195DBDE993_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(CCCC1)[NH]2)N=N3""",21,"""071C4F5F52D57B8B"""
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-"""66EA521B0B493F24_1E1223C5DD312165_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC=CC2=NC=C[N]12)N=N3""",21,"""071C4F5F52D57B8B"""
-"""C0B3C836569711BA_C03275CD871B9D56_6039_UN""","""CC(C)(C)[N]3C=C(COC[C@@H]1O[C@H]1C2=CC=CC=C2)N=N3""",21,"""071C4F5F52D57B8B"""
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-"""915CC701F9ED3033_A7E4CD4B68F0D1A9_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1CC(C)(C)NC1=O)N=N2""",21,"""071C4F5F52D57B8B"""
-"""13F7BF93DFD09DDA_3A4298E115193B79_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1=C(OC)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""F4A3E129149C966A_CF783A3B01697FF9_6039_UN""","""CC(C)(C)[N]2C=C(COCC(N(C)C1CCCC1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""4C75F3D2AD2DB611_795E347AB4AD237B_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1C(C)(C)C1(C)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
-"""E79D1DB36F58E03F_89AC5327F7C804DE_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=CC=C1)CC=C)N=N2""",21,"""071C4F5F52D57B8B"""
-"""163377467FF53256_291464D5EE0F4B21_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C=CC(=C1F)C)F)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""6FC65258272F0515_60F40136886D71DF_6039_UN""","""CC(C)(C)[N]1C=C(COCCC[S](C(C)(C)C)(=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
-"""429EA2C6A51969AD_D20DCE841221D75E_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(OC)C=CC=C1F)N=N2""",21,"""071C4F5F52D57B8B"""
-"""F53A46DA07794820_72C0BCBBBDB15503_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=C[N](CC)N=C1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""D47AF02F4E4C202E_427684C46EE2C0A9_6039_UN""","""CC(C)(C)[N]2C=C(COCCNC(=O)N1CCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""B4D31FF1262BAE02_B466212302807517_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=NC(=C1)C)OC)N=N2""",21,"""071C4F5F52D57B8B"""
-"""B3C377F88204364A_F03EADB09628D55C_6039_DP""","""CC(C)(C)[N]3C=C(COCC1CNCC2(O1)CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
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-"""3069CFAB8D3012BE_1832397D1357E832_6039_DP""","""CC(C)(C)[N]3C=C(COCC1=N[NH]C2=C1CNCC2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""C9B7013AC61A3469_DF5AFAAC4BADFB70_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=C2C(=N[NH]1)CCCC2)N=N3""",21,"""071C4F5F52D57B8B"""
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-"""209710FBA713BC7D_D69B9C862147272B_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(F)F)C=NC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
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-"""5E76F93F5F00B52A_C38313A2122D0793_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1(C(F)(F)F)CC1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
-"""D7D51855A1C78AEC_F349EDFECD38E035_6039_DP""","""CC(C)(C)[N]3C=C(COCC1CNC2(CO1)CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
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-"""62B6234079962726_B7356CA4BC148875_6039_UN""","""CC(C)(C)[N]1C=C(COCCOCCOCCOC)N=N1""",21,"""071C4F5F52D57B8B"""
-"""91E7387452FDF044_7FFDD9C2D4A716B6_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NN=C(C(F)(F)Cl)S1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""11E328D6062A274E_5DEC928D4944BC05_6039_UN""","""CC(C)(C)[N]1C=C(COCCC(C(OCC)=O)(F)F)N=N1""",21,"""071C4F5F52D57B8B"""
-"""60693818B5921D00_3138AADAE4C9A319_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(SN=C1OC)OC)N=N2""",21,"""071C4F5F52D57B8B"""
-"""1840181374BF1E9E_3E5AF58AB5619C0D_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NOC(=C1)CC2CC2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""DA27F52BAFD92BE5_7F9D1A11B5ADAECE_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC2=C(C=C1)OCO2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""18C8A5A514E2C3C7_14147E5C62880B34_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(=C[NH]1)C(F)(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
-"""09003F0493E6407E_6D15F5909BBD569B_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NO[C@@H]2CCCC[C@H]12)N=N3""",21,"""071C4F5F52D57B8B"""
-"""C22ECB9824E22774_E01C76EDD7B51E81_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=NC(=N1)COC)N=N2""",21,"""071C4F5F52D57B8B"""
-"""B8AAFE38392D81CF_74096AAE66BBEC6E_6039_DP""","""CC(C)(C)[N]3C=C(COCCC2CC1CCC(N1)C2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""A9E92463C1A1AF3E_D4177C8AFD2388DF_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=C1)C(N)=O)N=N2""",21,"""071C4F5F52D57B8B"""
-"""4A1136749BCA69A1_117FDB1D0D98B0A4_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(C(OC)=O)S1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""F20C99F733A9E08F_09AF0C0B9BB68FB4_6039_UN""","""CC(C)(C)[N]1C=C(COCC(NCCCC(O)=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
-"""AA549C154943E24B_61EFD876D5CCC5D2_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NCC1=CC=CS1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""33D2D8CDC127CFC1_2BA300C10ACE421A_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC=CC2=NON=C12)N=N3""",21,"""071C4F5F52D57B8B"""
-"""CFBEE2058C3020CE_3B4B019F6B0BF03A_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=C[N]1C=CC=NC1=N2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""59B201A89057F296_A4D97F5FA7AD94BF_6039_UN""","""CC(C)(C)[N]2C=C(COCCOC1CCCCC1C)N=N2""",21,"""071C4F5F52D57B8B"""
-"""FAA0DA3A6E35AA3C_7667DFAA55C93A15_6039_DP""","""CC(C)(C)[N]3C=C(COCC2=CC1=C(C=C[NH]1)C=C2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""B4066E9B600E97D4_F11DF14C373274C2_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(=NO1)C)[N](=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
-"""E5BE2927C2A190D0_17159AD6029EF599_6039_UN""","""CC(C)(C)[N]2C=C(COCCOC1=CC=C(C)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
-"""88375474788C64E9_1C972B79CB65E882_6039_UN""","""CC(C)(C)[N]1C=C(COCCOCC(C(F)F)(F)F)N=N1""",21,"""071C4F5F52D57B8B"""
-"""BD3A4D50076B6C05_FA735C62B42903EA_6039_UN""","""CC(C)(C)[N]1C=C(COCC(NC(NCCC)=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
-"""9AA0415DE476C5F1_5C603A287ED99F3C_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NN=C([N]1C)C2CC2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""2B3C50A2196C1A49_0B0A77E88BB8ABB3_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NN=C(S1)C2CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""2056DDF804805A50_C03FDE98CE33A191_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=C1)C(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
-"""973E881EB80F1C0E_7975946220B683C4_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=C(C=C1)C)OC)N=N2""",21,"""071C4F5F52D57B8B"""
-"""50B310367F337FA6_6142A402C88F779B_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=C(C=CC=C1)C2CC2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""DA2720490A4166C3_7B99FD7A0FE8BA86_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CC1(CCC1)C(=O)O2)N=N3""",21,"""071C4F5F52D57B8B"""
-"""9FBA242E772AEF51_4317BBB73DB6186D_6039_UN""","""CC(C)(C)[N]1C=C(COCC(NCC(C(C)C)=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
-"""55A11A1B203EBD30_C60CE334387D3F07_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(C=CC=N1)O2)N=N3""",21,"""071C4F5F52D57B8B"""
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-"""67716D7B245C1983_FFC138DE8754E87E_6039_UN""","""O(CC1CCC(F)CC1)CC3=C(C)N=C2C=CC=CC2=N3""",21,"""520A53A4D10B1B78"""
-"""083E35AA1F104317_8C39CBDA3C0768B2_6039_UN""","""O(CC1CCC(F)CC1)CC2=CN=C(S2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""D42C647A7EF36486_EC2BD041BA2918DF_6039_UN""","""O(CC1CCC(F)CC1)CC(N(C)C2CC[S](=O)(=O)C2)=O""",21,"""520A53A4D10B1B78"""
-"""43B2BD3B960A1F07_6C1516D62AF83D35_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CC=C(C(C)C)C=C2)=O""",21,"""520A53A4D10B1B78"""
-"""B062772C227E1550_D966073D5C118711_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C(C#N)C2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
-"""C480ABF98AC21885_E9C556AD8E1183CE_6039_UN""","""O(CC1CCC(F)CC1)CCOC2=CC=C([N](=O)=O)C=C2""",21,"""520A53A4D10B1B78"""
-"""7943AF4301F68E6A_C0B01C34AD0FD7DD_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2=CC(=CC(=C2)F)F)=O""",21,"""520A53A4D10B1B78"""
-"""2A885781DDB4C524_39781916432BE56E_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2=CC3=C(C=C2)OCC3""",21,"""520A53A4D10B1B78"""
-"""DBC3309165BFD8C6_B30EDBD7AFB4AEAE_6039_UN""","""O(CC1CCC(F)CC1)CCCOCCC2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
-"""2F25F057EA10D595_7B82512B67ECF2C6_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=C[N](C)C(=C2)C(=O)N)=O""",21,"""520A53A4D10B1B78"""
-"""4234D62E7C791111_F7FF131BA8A01483_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NC2=NN=C(O2)C3CC3""",21,"""520A53A4D10B1B78"""
-"""622D21602E728EB4_580C882B11072E48_6039_UN""","""O(CC1CCC(F)CC1)CC2=CSC(=N2)C3CCCCC3""",21,"""520A53A4D10B1B78"""
-"""DAF731A575DAEA04_E4311D8EEFA47025_6039_UN""","""O(CC1CCC(F)CC1)CC2=CSC(=N2)C3=CC=C(C)O3""",21,"""520A53A4D10B1B78"""
-"""48F154A3E9755619_D0E1EA8E22467F3E_6039_UN""","""O(CC1CCC(F)CC1)CC2=CSC(=N2)CC(N(C)C)=O""",21,"""520A53A4D10B1B78"""
-"""92042D83F9B70736_8D53CBD81254CDCD_6039_UN""","""O(CC1CCC(F)CC1)CC(NCC2=CC=CC(=C2)F)=O""",21,"""520A53A4D10B1B78"""
-"""9AD4C99092E212AA_101D4586A4109BCA_6039_UN""","""O(CC1CCC(F)CC1)CC(N(C)CC2CCCCC2)=O""",21,"""520A53A4D10B1B78"""
-"""83CCF60ACFD1F427_3B7F945AE7CC2F57_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NCCC2CCCCC2""",21,"""520A53A4D10B1B78"""
-"""CEFB41A33BD94A33_9C8B3E21BAFADCD9_6039_UN""","""O(CC1CCC(F)CC1)CC(NCC2=CC=C(CC)S2)=O""",21,"""520A53A4D10B1B78"""
-"""4AD80AB69D76B96E_C30E711F10314D49_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NC3=NC2=C(CCC2)S3""",21,"""520A53A4D10B1B78"""
-"""F829C38521758935_BD7C3E2121AC50BA_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)N(C2CC2)C3CCCC3""",21,"""520A53A4D10B1B78"""
-"""6E1AABC7EDCA9E79_FD3083F0F3E73580_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2=CC=N[N]2CCC)=O""",21,"""520A53A4D10B1B78"""
-"""4D0A90D8B7D7D7C5_49C081379BD38BDB_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NCC2CC[S](=O)(=O)C2""",21,"""520A53A4D10B1B78"""
-"""7DD7A35011B8BC1A_E10B39B0D35EB031_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=CC(=C2)C(N(C)C)=O""",21,"""520A53A4D10B1B78"""
-"""C2595975B810BD96_575F755F20553AC6_6039_UN""","""O(CC1CCC(F)CC1)CC3=NC2=C(C=N[N]2C)C(N3)=O""",21,"""520A53A4D10B1B78"""
-"""35B2DDBA0C8BEB61_C576ADBF43167239_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2=NC(=C(S2)C)CC)=O""",21,"""520A53A4D10B1B78"""
-"""4F1C4089E5AF4BA5_E532C0B78B1FCC2D_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C([S](N(C)C)(=O)=O)O2""",21,"""520A53A4D10B1B78"""
-"""80C270D6D47697CA_89E66F982CF73644_6039_UN""","""O(CC1CCC(F)CC1)CC2=N[N](C=C2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""D9810349E7350236_8BFCA6402616CD0A_6039_UN""","""O(CC1CCC(F)CC1)CCC2=CC=C([S](N)(=O)=O)C=C2""",21,"""520A53A4D10B1B78"""
-"""7F4A5D6F106CE4A5_9F7794D3E68B9516_6039_UN""","""O(CC1CCC(F)CC1)CC(NCCOCCC(C)C)=O""",21,"""520A53A4D10B1B78"""
-"""BB2B7CDC2C657D4A_328C790C86328140_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2=CC3=C(C=C2)CCC3""",21,"""520A53A4D10B1B78"""
-"""EDA1977B3C32C00E_B0AFB5E4D5682EFC_6039_UN""","""O(CC1CCC(F)CC1)CCOC(=O)NC2=CN=CC=C2""",21,"""520A53A4D10B1B78"""
-"""2C5B4C51DFD11531_413A8BD53361B25E_6039_UN""","""O(CC1CCC(F)CC1)CCCN(CCCC)CCCC""",21,"""520A53A4D10B1B78"""
-"""41BD487DF51A4828_786EE53FA467CFB2_6039_UN""","""O(CC1CCC(F)CC1)CC(NCC2=C(ON=C2C)C)=O""",21,"""520A53A4D10B1B78"""
-"""C026ADB1208B6AA6_1710ADEFEE6ECB8C_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CC(=CO2)C(OC)=O)=O""",21,"""520A53A4D10B1B78"""
-"""7DC607AA4EF5AEDA_F17F2EAE770851BC_6039_UN""","""O(CC1CCC(F)CC1)CC3=NN=C(C2=C(C)C=CO2)O3""",21,"""520A53A4D10B1B78"""
-"""D3CE2DD2F5CC2432_B3BBD1763040EDBA_6039_UN""","""O(CC1CCC(F)CC1)CC2=CN=C(C=C2)[N]3C=NC=C3""",21,"""520A53A4D10B1B78"""
-"""0020FC0D2B2FC302_8A92B0307BC90E30_6039_UN""","""O(CC1CCC(F)CC1)CC2=C[N](N=N2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""FA80F4FC715EDB20_6E144AC59A27C1BD_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C)OC(=N2)C3=CSC=C3""",21,"""520A53A4D10B1B78"""
-"""E37E0D2B59F5EFBA_DD33662A7EC54B68_6039_UN""","""O(CC1CCC(F)CC1)CCC2=CC3=C(C=C2)C=CC=C3""",21,"""520A53A4D10B1B78"""
-"""6A79CDBF26CCFF5D_F8EB3F3F68936F65_6039_UN""","""O(CC1CCC(F)CC1)CC2SC(=NC2)N3CCOCC3""",21,"""520A53A4D10B1B78"""
-"""DF414E394D15F966_EC456EB49EB51A05_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=C(C)OC(=C2)C(=O)O)=O""",21,"""520A53A4D10B1B78"""
-"""C5D500CC94CC9F62_8D46909266CFB730_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NCC(=O)C2=CC=CS2""",21,"""520A53A4D10B1B78"""
-"""0CFC7A4FF7E1CA16_FAD9E6E605F22E5E_6039_UN""","""O(CC1CCC(F)CC1)CCCOC2=CC=C(C=C2)C#N""",21,"""520A53A4D10B1B78"""
-"""711339AD25E927AC_CD70CBF323FEC04A_6039_UN""","""O(CC1CCC(F)CC1)CC(NCC2=CC=CC(=C2)C)=O""",21,"""520A53A4D10B1B78"""
-"""9FA39D09357B9CAD_EA000B990E356B9F_6039_UN""","""O(CC1CCC(F)CC1)CC2=NOC(=N2)CCC(OC)=O""",21,"""520A53A4D10B1B78"""
-"""FF33FA508862B011_E036BCEDD95DD75A_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=NC3=C2C=CC=C3)C""",21,"""520A53A4D10B1B78"""
-"""7FE40E24CC5E2D69_16EFF388A35D7301_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2=C(C(=C(C)S2)C)C)=O""",21,"""520A53A4D10B1B78"""
-"""66B36B87B0E0DDDC_CDEE5F1019FC5DFD_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CC(=C(C)C=C2F)F)=O""",21,"""520A53A4D10B1B78"""
-"""319B307259DE7C08_A62DC7B914584DC8_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)N2CCN(CC2)CC#C""",21,"""520A53A4D10B1B78"""
-"""8026F006130353FD_1B27BCE711468F5E_6039_UN""","""O(CC1CCC(F)CC1)CCN[S](C2=C[N](C)N=C2)(=O)=O""",21,"""520A53A4D10B1B78"""
-"""CD18CC7EC33F971C_BE27E025CA5D93D5_6039_UN""","""O(CC1CCC(F)CC1)CCC=CC2=CC=CC(=C2)OC""",21,"""520A53A4D10B1B78"""
-"""512E7962D0ADAF75_A67C2F2E6FED343D_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C=CC(=C2)OC)[N](=O)=O""",21,"""520A53A4D10B1B78"""
-"""E0B917E80396EF72_FBEF859CF76CB430_6039_UN""","""O(CC1CCC(F)CC1)CCOCC2=CC=C(OC)C=C2""",21,"""520A53A4D10B1B78"""
-"""91BCCB48D427BBD3_B5881E0854BE625F_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C)OC(=N2)C3=CC=CO3""",21,"""520A53A4D10B1B78"""
-"""7DF34190B194EB9E_E9DE0C61FED97047_6039_UN""","""O(CC1CCC(F)CC1)CCOC2=CC=C(C=C2)CC#N""",21,"""520A53A4D10B1B78"""
-"""9E83ED03E382D41A_6A86F1DAB70F8679_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CC(=C(C(=C2)C)F)C)=O""",21,"""520A53A4D10B1B78"""
-"""A8397A51AD6E3478_F72456D66079ABD1_6039_UN""","""O(CC1CCC(F)CC1)CC2=NOC(=N2)C3=C(C)N=CS3""",21,"""520A53A4D10B1B78"""
-"""B05A7297F0AFF45A_DAAAF564D72E38DD_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=C(C(OC)=O)C=C2)F""",21,"""520A53A4D10B1B78"""
-"""D4FAC2A5DA426333_2725B68A738AB33E_6039_UN""","""O(CC1CCC(F)CC1)CCN2C3=C(CCC2)C=CC=C3""",21,"""520A53A4D10B1B78"""
-"""1B21471F47D8C366_4B44B4517EC39580_6039_UN""","""O(CC1CCC(F)CC1)CCCOC2=CC(=CC=C2)C#N""",21,"""520A53A4D10B1B78"""
-"""3A831B1A2BE1EE26_24B7C63F1503BD76_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2=NN=C(C(C)C)S2)=O""",21,"""520A53A4D10B1B78"""
-"""786D4971A331CA19_76EBE90DB88E7DEF_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2=CSC3=C2C=CC=C3""",21,"""520A53A4D10B1B78"""
-"""E9A37D80F2575AD7_B4A929668CF02F89_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=CC(=C2)[N](=O)=O)OC""",21,"""520A53A4D10B1B78"""
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-"""3A6233C4BD4A1ED6_7702F9AE938E266A_6039_UN""","""O(CC1CCC(F)CC1)CCCC2=NN=C(C(F)(F)F)O2""",21,"""520A53A4D10B1B78"""
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-"""2EDBB9FE66F89CA4_3A6CF6483D77EF88_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NC2(CCCCC2)C#N""",21,"""520A53A4D10B1B78"""
-"""4AF3CD3A8F5A101F_784EF4F4173DFE1C_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2=CC=C(SC)C=C2)=O""",21,"""520A53A4D10B1B78"""
-"""5769E207021A866D_562573815C58C58C_6039_UN""","""O(CC1CCC(F)CC1)CC2=NN=C(O2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""017BC76D8A48F345_71BE5EB357471954_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC(=NO2)C3=NC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""DE803C8AE690B7B4_6368B1436A48F2D6_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2=C[NH]C3=C2C=CC=C3""",21,"""520A53A4D10B1B78"""
-"""9490BB0B4CC58E10_27CB0DB02806FC46_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(CC(OC)=O)C=CC=C2""",21,"""520A53A4D10B1B78"""
-"""6E7625A511159F41_30C10CF29457CB67_6039_DP""","""O(CC1CCC(F)CC1)CC2=CC(=CC(=C2)C(F)(F)F)N""",21,"""520A53A4D10B1B78"""
-"""E940A520AFE25E2F_7D2F920150C0C7A0_6039_UN""","""O(CC1CCC(F)CC1)CCC2=NC3=C([N]2C)C=CC=C3""",21,"""520A53A4D10B1B78"""
-"""655299C05B4E3F02_3F77313D6705ADEE_6039_UN""","""O(CC1CCC(F)CC1)CCN2C=C([N](=O)=O)C=CC2=O""",21,"""520A53A4D10B1B78"""
-"""1F8B3716E5DD2024_8E87A4E8EC44EED8_6039_UN""","""O(CC1CCC(F)CC1)CC(N2CCCCC2C(N)=O)=O""",21,"""520A53A4D10B1B78"""
-"""8030935333C34261_844A0DADAFD970FD_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=C(OC)C=C2)[N](=O)=O""",21,"""520A53A4D10B1B78"""
-"""0277B9C26C7F516E_91CED736A62EB522_6039_UN""","""O(CC1CCC(F)CC1)CC3=NN2C(C=C(C)N=C2S3)=O""",21,"""520A53A4D10B1B78"""
-"""285DD27497B99013_BB1FC1484AA85623_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2CCN(CC)CC2)=O""",21,"""520A53A4D10B1B78"""
-"""95F63E3C9C5F7211_80A48BCD0637563D_6039_UN""","""O(CC1CCC(F)CC1)CC(N(C2CCCCC2C)C)=O""",21,"""520A53A4D10B1B78"""
-"""BE5BB3BDDC9D6111_C0898EC857364B90_6039_UN""","""O(CC1CCC(F)CC1)CC(N(C(C)C2CC2)C3CC3)=O""",21,"""520A53A4D10B1B78"""
-"""46DA805A550182E2_37E637B43FCCFDB2_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=CC3=C2OCOC3)F""",21,"""520A53A4D10B1B78"""
-"""49DE25D795F38B6C_BFD4C5F003898AAB_6039_UN""","""O(CC1CCC(F)CC1)CCCOC2=CC(=CC(=C2)C)C""",21,"""520A53A4D10B1B78"""
-"""4EACEE82383C99C8_DC8C66C8AA5D988A_6039_UN""","""O(CC1CCC(F)CC1)CC(N(C(CC)C)C(C)CC)=O""",21,"""520A53A4D10B1B78"""
-"""678634BCA676B58A_EE9B5F76DCAD1D27_6039_UN""","""O(CC1CCC(F)CC1)CCC2=CC=C(C=C2)[S](=O)(=O)Cl""",21,"""520A53A4D10B1B78"""
-"""5657F598909D8381_B7D3F0F7B8C5C2B5_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)N3CCC2=C(C=CS2)C3""",21,"""520A53A4D10B1B78"""
-"""CA8F6B7FAFE43E8A_B0D35BC9A8BCB6AE_6039_UN""","""O(CC1CCC(F)CC1)CC3=C[N]2C=CC=CC2=C3C#N""",21,"""520A53A4D10B1B78"""
-"""90E8D24D50534291_9EF76EF67C1C5678_6039_UN""","""O(CC1CCC(F)CC1)CC3=NC2=C(C=CC=C2)C(=O)O3""",21,"""520A53A4D10B1B78"""
-"""B9D1F20DBFC3D5F0_A73435370CFC9BF2_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C)OC(=N2)C3=CC=CS3""",21,"""520A53A4D10B1B78"""
-"""DD213A1C91E29F4A_790EC60860E3883C_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2=CC3=C(C=C2)COC3""",21,"""520A53A4D10B1B78"""
-"""E75B0DCEF340559F_A35B90C2F8967A38_6039_UN""","""O(CC1CCC(F)CC1)CC(N(CC(NCCC)=O)C)=O""",21,"""520A53A4D10B1B78"""
-"""CF86FEBC0A884B6F_9809993C62F39085_6039_UN""","""O(CC1CCC(F)CC1)CC2=NOC(=N2)C3CCCCC3""",21,"""520A53A4D10B1B78"""
-"""C9BF5764C67D3735_DE06B178203E3304_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NC2=CC(=CC=C2)C#C""",21,"""520A53A4D10B1B78"""
-"""3D5DA649BD01051E_45BFCE691152C284_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C=CC=C2)N3CCCC3""",21,"""520A53A4D10B1B78"""
-"""7C6E45AE0566E15C_83D3611AE80B580F_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C)C=CC3=C2C=CC=C3""",21,"""520A53A4D10B1B78"""
-"""B4A80FA757692540_FE230C9DD96DD38E_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(CC)OC(=C2)C(=O)OC""",21,"""520A53A4D10B1B78"""
-"""829A63B3FDEA9CD9_79DC057F93A251B6_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C(OC)=O)C=C(C=C2)F""",21,"""520A53A4D10B1B78"""
-"""45CC0E575CF74383_54B1A5359D21C204_6039_UN""","""O(CC1CCC(F)CC1)CC2=N[N](C=N2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""28010382EBD1F01C_DA42712BF39F5136_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2=C[NH]C3=C2C=CC=N3""",21,"""520A53A4D10B1B78"""
-"""3B54257A5176686A_714A15748C38CD97_6039_UN""","""O(CC1CCC(F)CC1)CC3=NC2=C(N=C(OC)C=C2)[NH]3""",21,"""520A53A4D10B1B78"""
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-"""F16576927432E7B9_CF764DEFA97CF4AE_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NC2CCCCCCC2""",21,"""520A53A4D10B1B78"""
-"""763226457AEFCB34_72C03D35499E73EF_6039_UN""","""O(CC1CCC(F)CC1)CC(NCC2=CC=C(C)C=C2)=O""",21,"""520A53A4D10B1B78"""
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-"""C6B1C04CD4885610_375CF5BF2CD299C3_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2=C(C=CC(=C2)F)F)=O""",21,"""520A53A4D10B1B78"""
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-"""17AFE9C57CDA9531_304FCEB4E6721841_6039_UN""","""O(CC1CCC(F)CC1)CC3=NN=C(C2CC2)[N]3C4CC4""",21,"""520A53A4D10B1B78"""
-"""1908BF35197EA12D_35286B529B218D9B_6039_UN""","""O(CC1CCC(F)CC1)CC2=NN=C(S2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
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-"""F066E421AFA58BD1_F30BC4BEA630CDFC_6039_UN""","""O(CC1CCC(F)CC1)CCC2=C(C(OC)=O)C=CC=C2""",21,"""520A53A4D10B1B78"""
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-"""BD65A03E4BBCA0CD_5C9DED91B816A968_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(C(C)(C)C#N)C=C2""",21,"""520A53A4D10B1B78"""
-"""C165B1FFAA587EDC_A4BC404E5BCD03FC_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2=CC(=C(F)C=C2)F)=O""",21,"""520A53A4D10B1B78"""
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-"""25E73997FD024BE5_E721B348A4868B21_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=NO2)C3=C[N](C)N=C3""",21,"""520A53A4D10B1B78"""
-"""508E73CE186B6740_D71382BEDFFB1C7A_6039_UN""","""O(CC1CCC(F)CC1)CCCN2CCN(C(C)C)CC2""",21,"""520A53A4D10B1B78"""
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-"""406CDE732EC3A8AB_53863F86E22C61F1_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(C=C2)C3=CC=CS3""",21,"""520A53A4D10B1B78"""
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-"""C735388139176094_9FC4FD22CDAA43F2_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC=C[N]2C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""6F563B2FFC8A7745_AFBEA9BED9B9F735_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC(=CS2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""E7F02A339B34C0BA_C429E0D649B6D630_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC(=CS2)C3CCCCC3""",21,"""520A53A4D10B1B78"""
-"""2A3F239EB2511160_ED1DBAB27151F2C9_6039_UN""","""O(CC1CCC(F)CC1)CCCC3=NC2=C(C=CC=C2)[NH]3""",21,"""520A53A4D10B1B78"""
-"""7FDA2329B1B9C5D0_D5C82C2D381AA9C1_6039_UN""","""O(CC1CCC(F)CC1)CCCC2=N[N](C)C=C2C(=O)O""",21,"""520A53A4D10B1B78"""
-"""111818AC313CEAED_34A227D14537ADBB_6039_UN""","""O(CC1CCC(F)CC1)CC2=NN=N[N]2C3CCOCC3""",21,"""520A53A4D10B1B78"""
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-"""2485113A4A9FEC9D_73D3EE4E6A269FD3_6039_UN""","""O(CC1CCC(F)CC1)CC[S](=O)(=O)CC2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
-"""09A8923BF0AABBFD_608A69631F9B4F52_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2(CC2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""1036ED0D4FFEFB74_11B15A1F2984F53C_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC(=N[NH]2)C3=NC=NC=C3""",21,"""520A53A4D10B1B78"""
-"""ED499BE5F0F6E43E_B54833F11F8B8E36_6039_UN""","""O(CC1CCC(F)CC1)CCCB2OC(C)(C)C(O2)(C)C""",21,"""520A53A4D10B1B78"""
-"""CBE5EFC90A926EC8_DFD0DAFCAF99AF48_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CC=C(CCC)C=C2)=O""",21,"""520A53A4D10B1B78"""
-"""BACDABB599D43907_6764853AA5F76760_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(C(CC)(C)C)C=C2""",21,"""520A53A4D10B1B78"""
-"""5928416D3F1E158C_86707ABF763B4164_6039_UN""","""O(CC1CCC(F)CC1)CC3=CC2=C(OC(F)(F)O2)C=C3""",21,"""520A53A4D10B1B78"""
-"""CAE74003EA8F93B8_A5E0699F30F2160E_6039_UN""","""O(CC1CCC(F)CC1)CC(C(CC)(CC)C(=O)OC)=O""",21,"""520A53A4D10B1B78"""
-"""970B4F9B53BF3DF1_9D7F7EECD7C4AA8C_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=CC(=C2)OCC(C)C""",21,"""520A53A4D10B1B78"""
-"""746C6D9CB89316BC_DA19F1450E367665_6039_UN""","""O(CC1CCC(F)CC1)CCC(C2=CC=C(OC)C=C2)=O""",21,"""520A53A4D10B1B78"""
-"""4C56B874A6610C28_A980BDF4202968F9_6039_UN""","""O(CC1CCC(F)CC1)CC(N[C@H](C(OC)=O)C(C)C)=O""",21,"""520A53A4D10B1B78"""
-"""9E32E2F101D56F36_8542FB71E469E436_6039_UN""","""O(CC1CCC(F)CC1)CC2=CN=N[N]2C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""4F3E1C0B64664523_E832CC7241A8E28E_6039_UN""","""O(CC1CCC(F)CC1)CC2=N[NH]C(=C2C(OCC)=O)C""",21,"""520A53A4D10B1B78"""
-"""6DD63B548B2A5E58_0BC2FA0CC1A05941_6039_UN""","""O(CC1CCC(F)CC1)CC2=NOC(=C2C(OCC)=O)C""",21,"""520A53A4D10B1B78"""
-"""8F41C630A4B3EB05_BE017913245126E2_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C=CC(=C2)C)OC(F)F""",21,"""520A53A4D10B1B78"""
-"""A09AD26764794EC8_772BFDA4D5130E36_6039_UN""","""O(CC1CCC(F)CC1)CC(OC(C)C)C2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
-"""6FC38EFC7FDE3F5C_8168394088B50555_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(CC)N=C(C=C2)C(C)C""",21,"""520A53A4D10B1B78"""
-"""8ACB18ED4DA20B93_665DFFE499489F02_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NCCC2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
-"""D9B0B35B7956E7F9_A31104B42132CD8F_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2=C(OC)C=CC=C2)=O""",21,"""520A53A4D10B1B78"""
-"""79700D2D2CCA2487_3B791DF14185BB85_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C([S](CC)(=O)=O)C=C2""",21,"""520A53A4D10B1B78"""
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-"""F48815B195D4E85B_B4186A26FC6339A3_6039_UN""","""O(CC1CCC(F)CC1)CC2=C([N](=O)=O)C=CC=C2C#N""",21,"""520A53A4D10B1B78"""
-"""E718AD1E06424A61_E1769A8B63EF0C47_6039_UN""","""O(CC1CCC(F)CC1)CC2=NN=N[N]2C3CCCCC3""",21,"""520A53A4D10B1B78"""
-"""FB29FCA3C9D94DDD_1B29E244029A022A_6039_UN""","""O(CC1CCC(F)CC1)CCN3N=C2C=CC=CN2C3=O""",21,"""520A53A4D10B1B78"""
-"""1355F7917370E934_6A2E463ABFE2C6C5_6039_UN""","""O(CC1CCC(F)CC1)CC3=CC2=C([N](N=C2C)C)N=C3""",21,"""520A53A4D10B1B78"""
-"""BE48A84C41051D05_324EF68D254CA5EE_6039_UN""","""O(CC1CCC(F)CC1)CC3=C2N=CC=CC2=C(F)C=C3""",21,"""520A53A4D10B1B78"""
-"""ABFF47770F5773B9_A45EF90909393F9E_6039_UN""","""O(CC1CCC(F)CC1)CCCOC2=C(C)C=CC=C2C""",21,"""520A53A4D10B1B78"""
-"""3D8A5BF6E8FA4401_348133E8C7EE7D3D_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=C(OCC)C=CC=C2)=O""",21,"""520A53A4D10B1B78"""
-"""1BAC777B47D4AEF2_D071FC3E386E40FB_6039_UN""","""O(CC1CCC(F)CC1)CCCOC2=CC(=C(C)C=C2)C""",21,"""520A53A4D10B1B78"""
-"""9F806A2C32179D97_81AE9AB38AF67CC3_6039_UN""","""O(CC1CCC(F)CC1)CC(N(C)CC2=C[N](N=C2)C)=O""",21,"""520A53A4D10B1B78"""
-"""BEB0592B59EF263C_4868150A60D5890A_6039_UN""","""O(CC1CCC(F)CC1)CC(N(C(C)C)CC(F)(F)F)=O""",21,"""520A53A4D10B1B78"""
-"""8C3923BF93F871E2_6EBD472ED6E4A65D_6039_UN""","""O(CC1CCC(F)CC1)CC(NC(CCCCCC)C)=O""",21,"""520A53A4D10B1B78"""
-"""AFC0202C8C40B614_57623DF72887E957_6039_UN""","""O(CC1CCC(F)CC1)CC2=CN=C(C(OCC)=O)C=C2""",21,"""520A53A4D10B1B78"""
-"""9042BB59C2655F2B_D28C1E590D3B3624_6039_UN""","""O(CC1CCC(F)CC1)CC(C(C)(C)C2=CC=CC=C2)=O""",21,"""520A53A4D10B1B78"""
-"""D7BD5C386A009F53_EC5C4D6FB0D1FD94_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(OC)C=C(C=C2)[N](=O)=O""",21,"""520A53A4D10B1B78"""
-"""2B69EE9809A30661_66B154D80B60AC9C_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(C=C2)N3CCCC3""",21,"""520A53A4D10B1B78"""
-"""FBE0495D3DA296D1_F484E447E316EAFC_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CC=C(C(OC)=O)O2)=O""",21,"""520A53A4D10B1B78"""
-"""999CC3A81CE9FE60_D75723DFB1D55F5A_6039_UN""","""O(CC1CCC(F)CC1)CC(C(C2=NC(=CS2)C)C#N)=O""",21,"""520A53A4D10B1B78"""
-"""CCD48342CCBFEED6_F24DE839433CB3F7_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC3=C(C=C2)OC(C)(C)C3""",21,"""520A53A4D10B1B78"""
-"""182CFBB8EFC15C46_8B7E48D6D0AB2070_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NC2=NC(=NO2)C3CC3""",21,"""520A53A4D10B1B78"""
-"""F2CFC016CF55975C_3579AC3CBE32514E_6039_UN""","""O(CC1CCC(F)CC1)CCC(NC2=C(F)C=CC=C2)=O""",21,"""520A53A4D10B1B78"""
-"""EEB8780064C0A214_B348969C06F382F8_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(C=C2)[N]3C=CC=N3""",21,"""520A53A4D10B1B78"""
-"""1F1485F016C81359_B44434E2E1921E75_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC(=NO2)C3=NC=NC=C3""",21,"""520A53A4D10B1B78"""
-"""8040C8D065043465_EA348E2509705E49_6039_UN""","""O(CC1CCC(F)CC1)CC2=CSC(=N2)C3=NC=CC=N3""",21,"""520A53A4D10B1B78"""
-"""63694CB9AC039ABF_4A9499BE8443EA9A_6039_UN""","""O(CC1CCC(F)CC1)CC(N(C(C)C)C2CCCC2)=O""",21,"""520A53A4D10B1B78"""
-"""EDCBAFEBF2ADB4D1_E7F42369FF430916_6039_UN""","""O(CC1CCC(F)CC1)CC(NCC(NC(C)(C)C)=O)=O""",21,"""520A53A4D10B1B78"""
-"""6BC8A4056ACF8005_D57973735BD54DF5_6039_UN""","""O(CC1CCC(F)CC1)CCCCCCCCCC(O)=O""",21,"""520A53A4D10B1B78"""
-"""363C929C3BF4EDC2_EF648160AAD3D73C_6039_UN""","""O(CC1CCC(F)CC1)CCC(C2=C(C=C(F)C=C2)F)=O""",21,"""520A53A4D10B1B78"""
-"""651085E8DAA19162_FC75F37481B1827F_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C(=C(F)C(=C2F)F)F)F""",21,"""520A53A4D10B1B78"""
-"""765EE6806C541611_9D76C409B702DA89_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC=C(C(OCC)=O)C=C2""",21,"""520A53A4D10B1B78"""
-"""04DDA2E94628F11B_0E2A050F1F2A21D6_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CC(=C(C=C2F)F)C)=O""",21,"""520A53A4D10B1B78"""
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-"""C85644D58655317F_ADBBC32999C02A51_6039_UN""","""O(CC1CCC(F)CC1)CC3CCC2(CCOCC2)CO3""",21,"""520A53A4D10B1B78"""
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-"""57B7037B4AE2BA1D_6723F981DE922986_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(OC)C=CC(=C2)C(=O)C""",21,"""520A53A4D10B1B78"""
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-"""B8A7D888297F2024_BDEF22875A696AFE_6039_UN""","""O(CC1CCC(F)CC1)CCC3C2CC4CC(C2)CC3C4""",21,"""520A53A4D10B1B78"""
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-"""26C372C0BA5813A5_B52C10084B6B5F05_6039_UN""","""O(CC1CCC(F)CC1)CCC2=CC=CC(=C2)C(F)(F)F""",21,"""520A53A4D10B1B78"""
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-"""2956383FFDDA20F1_2E281C86741C8819_6039_UN""","""O(CC1CCC(F)CC1)CC3=NC2=C(C=CC(=C2)OC)[NH]3""",21,"""520A53A4D10B1B78"""
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-"""62BEC44660536A8F_0FFDAF40F04742E6_6039_UN""","""O(CC1CCC(F)CC1)CC3CCC2(CCCCCC2)O3""",21,"""520A53A4D10B1B78"""
-"""81DC43A06818AFC5_38350A112ECC1AD7_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)CCCC2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
-"""523F6381B1B5982F_ADCE4A3AA5F40187_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=C(OC)C=C2)C(=O)C""",21,"""520A53A4D10B1B78"""
-"""1AA70C595881274F_28D8676D49DB18CF_6039_UN""","""O(CC1CCC(F)CC1)C[C@@H]2CCC[C@@H](C(OCC)=O)O2""",21,"""520A53A4D10B1B78"""
-"""2208EB94F01D6EA0_098A39596659CD28_6039_DP""","""O(CC1CCC(F)CC1)CC3CCC2(CCNCC2)CO3""",21,"""520A53A4D10B1B78"""
-"""12557A3100BB210E_CDE488ED90389C8F_6039_UN""","""O(CC1CCC(F)CC1)CC2=N[N](C=C2)C3CCCCC3""",21,"""520A53A4D10B1B78"""
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-"""E27C3ABB73DF4BAC_656C1F1CCAE2B4E0_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CSC(=N2)C(C)(C)C)=O""",21,"""520A53A4D10B1B78"""
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-"""167EEBFB2DD947B0_20CC9ADBF57E4414_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=C(C=C2)[N](=O)=O)OC""",21,"""520A53A4D10B1B78"""
-"""12DA2696F62F5739_B4B73872A20A9658_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(N[S](C)(=O)=O)C=C2""",21,"""520A53A4D10B1B78"""
-"""B5F171DEA33A59E3_3F4C3BCF912123AF_6039_UN""","""O(CC1CCC(F)CC1)CC2=NN=N[N]2C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""962121D093D02125_9694268142F601A6_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC=C(S2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
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-"""30A8AC439853984C_08D2CB13FF195C49_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)N2CCOCC2C3CC3""",21,"""520A53A4D10B1B78"""
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-"""7166DED970045379_B00093DC2EA19B44_6039_UN""","""O(CC1CCC(F)CC1)CCOC2=C(C(C)=O)C=CC=C2""",21,"""520A53A4D10B1B78"""
-"""1EF77FDA6737F082_DB792A0231B97E49_6039_UN""","""O(CC1CCC(F)CC1)CC=NNC(=O)C2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
-"""377665C92DBC13DA_73725918B5ED956F_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2=CC=CC(=C2)OC)=O""",21,"""520A53A4D10B1B78"""
-"""EFAAB27726B91001_3ED20983B49D7F40_6039_UN""","""O(CC1CCC(F)CC1)CCC(=O)NC2=C(C=CS2)C#N""",21,"""520A53A4D10B1B78"""
-"""480ACA0B1ECC6188_6C6C3EB55C4A22E5_6039_UN""","""O(CC1CCC(F)CC1)CC(N(CCCC)C(C)CC)=O""",21,"""520A53A4D10B1B78"""
-"""9DA3754388660904_AFF6055564DB303E_6039_UN""","""O(CC1CCC(F)CC1)CC(NCCCC(OCC)=O)=O""",21,"""520A53A4D10B1B78"""
-"""19E5DF30802CECE7_AAE7B403032B5580_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(C=C2)[N]3C=NC=C3""",21,"""520A53A4D10B1B78"""
-"""2E3D5784B0AC48ED_DAD2A436E56C38C6_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(OC(F)(F)F)C=C2""",21,"""520A53A4D10B1B78"""
-"""1FCE071FBA599859_19083CE7440FF697_6039_UN""","""O(CC1CCC(F)CC1)CCCOC2=C(C=CC(=C2)C)C""",21,"""520A53A4D10B1B78"""
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-"""6B7F7E5EBD0656FD_C3FCB3720AEEDDDF_6039_UN""","""O(CC1CCC(F)CC1)CC2=NN=C(O2)C3CCOCC3""",21,"""520A53A4D10B1B78"""
-"""265D78DFB3279D9F_0BE1F7C40130FB7B_6039_UN""","""O(CC1CCC(F)CC1)CCC(C(F)F)N2CCOCC2""",21,"""520A53A4D10B1B78"""
-"""3CFE5A8B54153DB9_7828C5E77C9127F2_6039_UN""","""O(CC1CCC(F)CC1)CC(N(CCOC)CCOC)=O""",21,"""520A53A4D10B1B78"""
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-"""13AF149B7273E78A_305C80EFD0C7F95E_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(C=C2)C3CCCC3""",21,"""520A53A4D10B1B78"""
-"""37908017848E66F7_44AEEAFB507EEA8B_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC(=NS2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""973ED1B08CCFF582_99E8C543251762B8_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=CC(=C2)OC(C)=O)C""",21,"""520A53A4D10B1B78"""
-"""85A34FAA4A57483C_2E601566D9EF4AF2_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=CC=C2)OCC3CC3""",21,"""520A53A4D10B1B78"""
-"""508FF95C13EDBA4A_B0BF5757012AE064_6039_UN""","""O(CC1CCC(F)CC1)CC3=NC2=C(CCCC2)C(=O)N3""",21,"""520A53A4D10B1B78"""
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-"""7ECEF5F7D522BA1D_6C0EEF6F1A6CECAF_6039_UN""","""O(CC1CCC(F)CC1)CC3=NC2=C(CC(C)(CC2)C)S3""",21,"""520A53A4D10B1B78"""
-"""5796F7688D8031F5_5D9CD4CD43DB6A2E_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2=CN=C3N=CC=C[N]23""",21,"""520A53A4D10B1B78"""
-"""ED6A1BA92068E543_543DB3A764F729B6_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=C[N](C)N=C2C(F)F)=O""",21,"""520A53A4D10B1B78"""
-"""A8C8C6B639DAFC3D_FFC911606ED7E7AA_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C3=CC2=C(C=CC=C2)S3""",21,"""520A53A4D10B1B78"""
-"""79F81EBB28CEE007_EB2D01620CB79BF6_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2=CN=C3[N]2C=CC=C3""",21,"""520A53A4D10B1B78"""
-"""0AD33AD2C14D9C3E_933E9DCC91DDB4F3_6039_UN""","""O(CC1CCC(F)CC1)CC2=NN=C([N]2C)C3=CC=CS3""",21,"""520A53A4D10B1B78"""
-"""03BC187D3C600A42_A24B3C061D6D9A9E_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2=CC3=C(C=C2)OCO3""",21,"""520A53A4D10B1B78"""
-"""E6409EDE0CB77EEC_072A55500D19A5CB_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=C(C(OC)=O)N=C2)F""",21,"""520A53A4D10B1B78"""
-"""FFD4ACF3058A34C0_B999420A1372FC06_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CSC(=C2)C(OC)=O)=O""",21,"""520A53A4D10B1B78"""
-"""53D5B263C068B29A_B3CB593AE26E8E78_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=CC3=C2OC(C)(C)C3""",21,"""520A53A4D10B1B78"""
-"""CD1D47B60499590D_7CA654495DD9A484_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=C(C=C2)C)C(OC)=O""",21,"""520A53A4D10B1B78"""
-"""22E28C13C4879539_4C4C4AF989FF5B23_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC=N[N]2C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""21754A4A29E2DC05_5F93EAA70E18F6C7_6039_UN""","""O(CC1CCC(F)CC1)CC3=NC2=C(C=C(OC)C=C2)S3""",21,"""520A53A4D10B1B78"""
-"""3ED2CB876FCF2B5A_CA84678855C8F90C_6039_UN""","""O(CC1CCC(F)CC1)CCC(C)OCC2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
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-"""CBB27B91CBFB3FCD_AEBED0E5DCDB552C_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=CC(=C2F)C(F)(F)F""",21,"""520A53A4D10B1B78"""
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-"""E721BC9118ACAA62_3B35BEB68BB52ECE_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C=CC(=C2)F)C(F)(F)F""",21,"""520A53A4D10B1B78"""
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-"""C2DD430ABE1A1F04_3AEC073A898FD3D0_6039_UN""","""O(CC1CCC(F)CC1)CCC2=CC=CC(=C2)NC(C)=O""",21,"""520A53A4D10B1B78"""
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-"""F1ED6BC6C769E179_C340FA9027FDBC6F_6039_UN""","""O(CC1CCC(F)CC1)CCC2=C[N](C)C3=C2C=CC=C3""",21,"""520A53A4D10B1B78"""
-"""1951296A8B3D83B7_814A603B0DA0625B_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NCCCCCN=[N]#N""",21,"""520A53A4D10B1B78"""
-"""D2A10D8EFC4B83A0_E38C3A2277FE5584_6039_UN""","""O(CC1CCC(F)CC1)CCC2CCCC(C(F)(F)F)C2""",21,"""520A53A4D10B1B78"""
-"""76E94C65FC89E386_1C66D002E6702FA8_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(C=C2)C3CC(=O)C3""",21,"""520A53A4D10B1B78"""
-"""3EA7B3432C4BC3F2_AE950F514C0CDEE0_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CSC=C2C(OC)=O)=O""",21,"""520A53A4D10B1B78"""
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-"""94D3015544048CD2_C94C2E9636E74258_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=C(C)OC(=C2)C(=O)N)=O""",21,"""520A53A4D10B1B78"""
-"""03FB02C5CCDA0309_B9F2BAEF080DDEB6_6039_UN""","""O(CC1CCC(F)CC1)CC2=NN=C(O2)N3CCCCC3""",21,"""520A53A4D10B1B78"""
-"""046C52F53977DFB5_83DFD0D7FB526F72_6039_UN""","""O(CC1CCC(F)CC1)CC2COC(O2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""2CB47033F8C993D2_529622DEEE533203_6039_UN""","""O(CC1CCC(F)CC1)CC2=NN=C(O2)N3CCOCC3""",21,"""520A53A4D10B1B78"""
-"""A72866D6B55038AB_E9C048C2F3D35EDF_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(C=C2)C3=NC=CO3""",21,"""520A53A4D10B1B78"""
-"""D260B3CA5B6B87D4_358F293194F8D284_6039_UN""","""O(CC1CCC(F)CC1)CC2=N[N](CCC(F)(F)F)C=C2""",21,"""520A53A4D10B1B78"""
-"""7113D72DAED542C5_CE616A596A732165_6039_UN""","""O(CC1CCC(F)CC1)CC#CC2=CC(=CC(=C2)F)C#N""",21,"""520A53A4D10B1B78"""
-"""2809F427F7A2CFAA_F2CD22375CBB599E_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=N[NH]2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
-"""AF94289B7E13CC55_BC785C10B733CF71_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=CC(=C2)SCCCC""",21,"""520A53A4D10B1B78"""
-"""7D114E19722D5B89_9267F5EC4C7A5966_6039_UN""","""O(CC1CCC(F)CC1)CC3=CC2=C(N(C)C(=O)S2)C=C3""",21,"""520A53A4D10B1B78"""
-"""4BF7C613634C0CB0_C960AA005DA0BA28_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=CC(=C2)CCCOC""",21,"""520A53A4D10B1B78"""
-"""E39828C6FCEEC311_9C365677E0C4B94E_6039_DP""","""O(CC1CCC(F)CC1)CC2=CC(=NO2)C3CCNCC3""",21,"""520A53A4D10B1B78"""
-"""1B5613F7854D5486_B3B01EE4CE282B3D_6039_UN""","""O(CC1CCC(F)CC1)CCC(C(F)F)C2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
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-"""DB42802068D07FB5_DCDAB59DA4B954E7_6039_UN""","""O(CC1CCC(F)CC1)CC2=N[N](C=C2C(OCC)=O)C""",21,"""520A53A4D10B1B78"""
-"""8465214A3D91C7F6_E1C4828375C1942E_6039_UN""","""O(CC1CCC(F)CC1)CCC2=NOC3=C2C=CC(=C3)F""",21,"""520A53A4D10B1B78"""
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-"""0A6554D16476892F_2E87D1D8F8FC2A02_6039_UN""","""O(CC1CCC(F)CC1)CC3=CC2=C(N(C)C(=O)O2)C=C3""",21,"""520A53A4D10B1B78"""
-"""55CE16FF7AEFFF98_B170ED37827F7277_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=NC(=N2)CC3CC3)C""",21,"""520A53A4D10B1B78"""
-"""97851634A1801A97_8A4F7B5200AABCEE_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=NC(=N2)C3CCC3)C""",21,"""520A53A4D10B1B78"""
-"""75A96893C820F358_C7F82FB0DCD9F672_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=NC(=N2)C(F)(F)F)C""",21,"""520A53A4D10B1B78"""
-"""5BFF5C16AED76D39_E892F7CCF39B94EC_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=N[N]2C3CCCCC3""",21,"""520A53A4D10B1B78"""
-"""3C0B145D3A226213_A08FEE2B56644A33_6039_UN""","""O(CC1CCC(F)CC1)CC(C2CCN(C(C)=O)CC2)=O""",21,"""520A53A4D10B1B78"""
-"""DF77AE72FE62DA97_B7AAC391882B4151_6039_UN""","""O(CC1CCC(F)CC1)CC3CC2(CCOCC2)C(=O)O3""",21,"""520A53A4D10B1B78"""
-"""AFE2DD38BAAEC93A_47A6704720EE529F_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C(=N[N]2C)C)[S](=O)(=O)N""",21,"""520A53A4D10B1B78"""
-"""BF3194BF86593DEF_F73253A3B156F61B_6039_UN""","""O(CC1CCC(F)CC1)CC(C(CC(OCC)=O)(C)C)=O""",21,"""520A53A4D10B1B78"""
-"""E9CD67084F078B05_6DD7118581705466_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C(OCC)=O)C=N[N]2C""",21,"""520A53A4D10B1B78"""
-"""7D0708588EBE71E5_E22B3DC777720777_6039_UN""","""O(CC1CCC(F)CC1)CC[N]2N=C(C(OC)=O)C=C2C""",21,"""520A53A4D10B1B78"""
-"""95B2E6784B41CCB0_1E28221689F0522A_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2CCCC3=C2C=CS3""",21,"""520A53A4D10B1B78"""
-"""5EC53A9D407B6C2A_93C84CE339D95A62_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC=C(O2)C3CCCCC3""",21,"""520A53A4D10B1B78"""
-"""2FD6D032F5EDAD77_E1F88E47285EA9B5_6039_UN""","""O(CC1CCC(F)CC1)CC2=NC3=C([N]2CC)C=CC=C3""",21,"""520A53A4D10B1B78"""
-"""B2AF4782E60BDEE1_640867704FC2AE7F_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C)C=C(C=C2)CC(=O)O""",21,"""520A53A4D10B1B78"""
-"""E7FE393EF49115FA_2162066A1A36E52F_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=NC(=N2)C3CC3C)C""",21,"""520A53A4D10B1B78"""
-"""242CA91D3AC614DB_77E32F9F2024E16B_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(CC)C=CC(=C2)[N](=O)=O""",21,"""520A53A4D10B1B78"""
-"""E0DCD056F6AE76F1_088888951F69B3AF_6039_UN""","""O(CC1CCC(F)CC1)CC(C2CCCN(C(C)=O)C2)=O""",21,"""520A53A4D10B1B78"""
-"""DDD23FA81901E15D_20CDEDB4097ED61B_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(F)C=CC3=C2N=CC=C3""",21,"""520A53A4D10B1B78"""
-"""48093B47C37DDD8B_6F9935A639792E34_6039_UN""","""O(CC1CCC(F)CC1)CC2=CSC(=N2)COC3CCC3""",21,"""520A53A4D10B1B78"""
-"""9D8D318D78827CEE_312A75EA78511B88_6039_UN""","""O(CC1CCC(F)CC1)CC3=NC2=C(C(=CC(=C2)F)F)[NH]3""",21,"""520A53A4D10B1B78"""
-"""79F81EBB28CEE007_55D551572F084694_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C2=CN=C3C=CC=C[N]23""",21,"""520A53A4D10B1B78"""
-"""1A86A48AD3D6C557_36BE5FE213A7B306_6039_UN""","""O(CC1CCC(F)CC1)CC(F)(F)C(=O)C2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
-"""51B398F83086CAD5_53EC525DD9D18BAC_6039_UN""","""O(CC1CCC(F)CC1)CC(CC2=C(OC)C=CC=C2)=O""",21,"""520A53A4D10B1B78"""
-"""D03658A15CD1D6B7_6114888B41DD1050_6039_UN""","""O(CC1CCC(F)CC1)CC2=CN=C(C=C2)[N]3C=CC=N3""",21,"""520A53A4D10B1B78"""
-"""BF2E79683FAF173F_96F7B1BC3D23227F_6039_UN""","""O(CC1CCC(F)CC1)CC(NC2(C)CC[S](=O)(=O)C2)=O""",21,"""520A53A4D10B1B78"""
-"""14C035E05B4BD89D_7F45D53A1DE22911_6039_UN""","""O(CC1CCC(F)CC1)CCC(C2=CC=C(CC)C=C2)=O""",21,"""520A53A4D10B1B78"""
-"""10857E60538C05BF_76491E537912E62D_6039_UN""","""O(CC1CCC(F)CC1)CC2=N[S](=O)(=O)C3=C2C=CC=C3""",21,"""520A53A4D10B1B78"""
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-"""0D549B4F84BF54A4_8B74EE97E6D1B0DC_6039_UN""","""O(CCOCCOCCF)CCSC1=CC(=C(C)C=C1)C""",21,"""FCDA031414BF628E"""
-"""9009ADCB9F8280E5_F94B092F65F8C1B9_6039_UN""","""O(CCOCCOCCF)CC(=O)NC(=O)C1=CC=CO1""",21,"""FCDA031414BF628E"""
-"""56C5E1C2B934E9B8_00E42D288CAAD369_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=C1)OC(C)C""",21,"""FCDA031414BF628E"""
-"""EF44C2973DC3DC7B_DACC4AC33DB02116_6039_UN""","""O(CCOCCOCCF)CC(NCC1=C(C)C=CS1)=O""",21,"""FCDA031414BF628E"""
-"""7F935C24289A6718_2042B71C7CDC739E_6039_UN""","""O(CCOCCOCCF)CC(NCC1=CC=C(C)S1)=O""",21,"""FCDA031414BF628E"""
-"""E4BF5145C960F865_B9D0F08BE837EA9F_6039_UN""","""O(CCOCCOCCF)CC(N(CC(C)C)C1CC1)=O""",21,"""FCDA031414BF628E"""
-"""F87BDE9347143537_8E91C29730D08E86_6039_UN""","""O(CCOCCOCCF)CC(N(CC)CC(C)C#N)=O""",21,"""FCDA031414BF628E"""
-"""2DAEBEE30E42407B_D4A0C539AC49D9C5_6039_UN""","""O(CCOCCOCCF)CC(=O)NCCC1=CSC=C1""",21,"""FCDA031414BF628E"""
-"""60A70E74B1FCE7E6_A1AE4CDFA6A366B5_6039_UN""","""O(CCOCCOCCF)CC(NC(C)C(=O)N(C)C)=O""",21,"""FCDA031414BF628E"""
-"""E456312A539F0BDB_48B085DD61DB117A_6039_UN""","""O(CCOCCOCCF)CCNC(OCC(F)(F)F)=O""",21,"""FCDA031414BF628E"""
-"""9EB6B024C6DE4509_290F3BF7FC74FA2C_6039_UN""","""O(CCOCCOCCF)CC1=C(C(OC)=O)C=CC=C1""",21,"""FCDA031414BF628E"""
-"""7F38C941D9BC7E82_7DC7A82946414BB9_6039_UN""","""O(CCOCCOCCF)CC1=CSC(=N1)CCC(C)C""",21,"""FCDA031414BF628E"""
-"""5FD44F1919F984FF_E2496B27FD849AD4_6039_UN""","""O(CCOCCOCCF)CC1=CSC(=N1)N(C)C(=O)C""",21,"""FCDA031414BF628E"""
-"""0501C84B92305CA0_2E6ADE16B6872D74_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(C=C1)OCCO2""",21,"""FCDA031414BF628E"""
-"""B0113A7A3C672974_C06BEE1D3DFAF45C_6039_UN""","""O(CCOCCOCCF)CC1=C(OC(C)C)C=CC=C1""",21,"""FCDA031414BF628E"""
-"""1AF60BCD3430E86E_BBEFD89C045EEDA4_6039_UN""","""O(CCOCCOCCF)CC1=NC2=C([N]1C)C=CC=C2""",21,"""FCDA031414BF628E"""
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-"""318B2117B48007AE_5C2C2DE91A92C425_6039_UN""","""O(CCOCCOCCF)CC1=CSC(=N1)C2=CSC=C2""",21,"""FCDA031414BF628E"""
-"""6515A8268832A1E3_24A782051FB56F1C_6039_UN""","""O(CCOCCOCCF)CC2=NC1=C(F)C=CC=C1[NH]2""",21,"""FCDA031414BF628E"""
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-"""AFD613C43724BE16_3707C1651A6BE88B_6039_UN""","""O(CCOCCOCCF)CCCCC[N]1C=C(C)C=N1""",21,"""FCDA031414BF628E"""
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-"""1C5D1E17A8308B87_41DF89CDAAC32FF5_6039_UN""","""O(CCOCCOCCF)CCC[N]1N=C([N](=O)=O)C=C1""",21,"""FCDA031414BF628E"""
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-"""38A7926DAA97463E_B18DF1C476C57A11_6039_UN""","""O(CCOCCOCCF)CC1=CSC(=N1)C2=COC=C2""",21,"""FCDA031414BF628E"""
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-"""0DA5670740ACBE3D_C0D42B2BDC28C971_6039_UN""","""O(CCOCCOCCF)CCC1=CC2=C(C=C1)OCC2""",21,"""FCDA031414BF628E"""
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-"""90C01B311E470607_E6403AB1DFEF16B8_6039_UN""","""O(CCOCCOCCF)CCN(CCCC)CCCC""",21,"""FCDA031414BF628E"""
-"""1B7539B0EC4BD446_F95A3DE302CFA324_6039_UN""","""O(CCOCCOCCF)CCC1=CC=C(C(O)=O)C=C1""",21,"""FCDA031414BF628E"""
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-"""32C3B0B9C525D81B_9E318530ED031686_6039_UN""","""O(CCOCCOCCF)CCCNC(=O)C1CCCC1""",21,"""FCDA031414BF628E"""
-"""36F9E1097325C5C8_5F77FB7DECB55CDD_6039_UN""","""O(CCOCCOCCF)CCN[S](CCCOC)(=O)=O""",21,"""FCDA031414BF628E"""
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-"""493D025107A9AE2B_93AFAD38CBDDA205_6039_UN""","""O(CCOCCOCCF)CC(C1=CC(=CS1)C(O)=O)=O""",21,"""FCDA031414BF628E"""
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-"""6C66716D5F8A0A5A_6E25E2B2436E1BFF_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)C(SCC)C""",21,"""FCDA031414BF628E"""
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-"""E2F8D4612403B8D1_299F2E72D614822B_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)C2=CC=CO2""",21,"""FCDA031414BF628E"""
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-"""72337F17611E95A3_58EBD4F9EA7C8F08_6039_UN""","""O(CCOCCOCCF)CC1=CSC(=N1)C2CCCC2""",21,"""FCDA031414BF628E"""
-"""8A63929180139BFB_DFB664BDD5A85E7A_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)C2CCCC2""",21,"""FCDA031414BF628E"""
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-"""3D26FBAAACA4D543_1517419FF5203980_6039_UN""","""O(CCOCCOCCF)CC1=CSC(=N1)C(OCC)=O""",21,"""FCDA031414BF628E"""
-"""BF5BD8FE7E64115F_638DD74199B6F7A6_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)C2=CC=CS2""",21,"""FCDA031414BF628E"""
-"""57612C3B1B854E7A_C20F22256BEF018D_6039_UN""","""O(CCOCCOCCF)CC(=O)NC(C1CC1)C2CC2""",21,"""FCDA031414BF628E"""
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-"""F237D4A8F9C25B15_7105CFCB22E65B11_6039_UN""","""O(CCOCCOCCF)CC(NC(C)(C#N)C1CC1)=O""",21,"""FCDA031414BF628E"""
-"""812CAF073A88EC66_D4284C952E8016FB_6039_UN""","""O(CCOCCOCCF)CC2=NC1=C(C=CC(=C1)F)O2""",21,"""FCDA031414BF628E"""
-"""856CE4AF99A151F2_B78E690A127A70FC_6039_UN""","""O(CCOCCOCCF)CC(NC(C(C)C)(C)C#N)=O""",21,"""FCDA031414BF628E"""
-"""6CD3EEE8D9054B20_CA3B840E4C86F4E3_6039_UN""","""O(CCOCCOCCF)CC1=C([N](=O)=O)C=CC(=C1)F""",21,"""FCDA031414BF628E"""
-"""ED517EB57FCA44FF_4B4B934161654933_6039_UN""","""O(CCOCCOCCF)CC1=CSC(=N1)CC(NC)=O""",21,"""FCDA031414BF628E"""
-"""EFA85A697EFD9722_938209E55CDD3216_6039_UN""","""O(CCOCCOCCF)CC1=CC=C(N(CC)C)C=C1""",21,"""FCDA031414BF628E"""
-"""8AF8BDDF5B8DAB5F_289B4CBDDD421CBC_6039_UN""","""O(CCOCCOCCF)CC1=CSC(=N1)N(C)C2CC2""",21,"""FCDA031414BF628E"""
-"""5F3E668206A74D92_616524802628A452_6039_UN""","""O(CCOCCOCCF)CC1=NC(=N[NH]1)C2=CC=CS2""",21,"""FCDA031414BF628E"""
-"""0B5262464F6F40AF_CBB0F0C15DF350D5_6039_UN""","""O(CCOCCOCCF)CC1=C(C)SC(=C1)C(OC)=O""",21,"""FCDA031414BF628E"""
-"""F221899AFDFC575C_7205D0467316D15F_6039_UN""","""O(CCOCCOCCF)CC(=O)NNC(=O)C1CCC1""",21,"""FCDA031414BF628E"""
-"""7FE7FAF14C513E13_543E504728E31049_6039_UN""","""O(CCOCCOCCF)CCCOCC1CCCCO1""",21,"""FCDA031414BF628E"""
-"""1B25B0708306BDF2_4AC6C721951723F4_6039_UN""","""O(CCOCCOCCF)CC1=C(C=C([N](=O)=O)C=C1)F""",21,"""FCDA031414BF628E"""
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-"""CDFAB61FD60F39F5_D71759684D7DEA2F_6039_UN""","""O(CCOCCOCCF)CC1=CSC(=N1)C2CCCO2""",21,"""FCDA031414BF628E"""
-"""5642BEC24ABB8585_8AF7819C17D9C7AA_6039_UN""","""O(CCOCCOCCF)CC(=O)NCC1=CC=CC=C1""",21,"""FCDA031414BF628E"""
-"""676A4C01134DB198_2EF5BB13DD38B36E_6039_UN""","""O(CCOCCOCCF)CCCCCN1CCCCC1""",21,"""FCDA031414BF628E"""
-"""667359E782687F00_93C569367E6FA909_6039_UN""","""O(CCOCCOCCF)CC1OC(=C(C(OC)=O)C1)C""",21,"""FCDA031414BF628E"""
-"""054F8E7B3B63A3A0_552E5392B38A05A4_6039_UN""","""O(CCOCCOCCF)CC1=C(ON=C1)C2=CC=CO2""",21,"""FCDA031414BF628E"""
-"""A16EB460F00AAFFB_063199F654996445_6039_UN""","""O(CCOCCOCCF)CC1=C2C(=CN=C1)C=CC=C2""",21,"""FCDA031414BF628E"""
-"""8704061199CB5E16_738A41F79435BA16_6039_UN""","""O(CCOCCOCCF)CC(N(C)C1=CC=CC=C1)=O""",21,"""FCDA031414BF628E"""
-"""7DA76A75F1912EBC_A0A2A626F5D68396_6039_UN""","""O(CCOCCOCCF)CC(NC1=CC=C(C)C=C1)=O""",21,"""FCDA031414BF628E"""
-"""3EA6DD7082311869_5017E6D189E00CB6_6039_UN""","""O(CCOCCOCCF)CC(NC1=C(F)C=CC=C1)=O""",21,"""FCDA031414BF628E"""
-"""32B4A7B7CD09FB61_8C45596073584B56_6039_UN""","""O(CCOCCOCCF)CC(NC1=CC=C(F)C=C1)=O""",21,"""FCDA031414BF628E"""
-"""99BA794D119308E9_A547D834392D0990_6039_UN""","""O(CCOCCOCCF)CCC(C1=CC=C(C)C=C1)=O""",21,"""FCDA031414BF628E"""
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-"""07C51657E0B6F51C_959AF95981E2A06A_6039_UN""","""O(CCOCCOCCF)CC1=NN=C([N]1C)C2CCC2""",21,"""FCDA031414BF628E"""
-"""95D404B5FDE05A9D_2ABFDDDDCB035908_6039_UN""","""O(CCOCCOCCF)CC(NC1=C(C)C=CC=C1)=O""",21,"""FCDA031414BF628E"""
-"""DDD32F1625CB5B13_DA797E7098794A2E_6039_UN""","""O(CCOCCOCCF)CC(NC(C(C)C)C(=O)O)=O""",21,"""FCDA031414BF628E"""
-"""BA2D00422CAA2516_38A0958EFA1DB7D6_6039_UN""","""O(CCOCCOCCF)CC2=NC1=C(C)C=CN=C1[NH]2""",21,"""FCDA031414BF628E"""
-"""4A5956E78A83E2A1_23F8876A32CFCAF4_6039_UN""","""O(CCOCCOCCF)CC1=C(N=C(C)S1)C(F)(F)F""",21,"""FCDA031414BF628E"""
-"""73AF9D0697D51671_1DFDE01EFBF7303B_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(C=C1)[NH]C(=N2)C""",21,"""FCDA031414BF628E"""
-"""432C92FD3A81283C_CA6C185356E9FC4C_6039_UN""","""O(CCOCCOCCF)CC[N]1C=C(C(OC)=O)N=N1""",21,"""FCDA031414BF628E"""
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-"""5D7471156C4AFB40_CE82EED3EBC2A2D0_6039_UN""","""O(CCOCCOCCF)CC(NC1CCCCC1C)=O""",21,"""FCDA031414BF628E"""
-"""9F77F05AB556B590_A09E734AAE738572_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(C=C1)N=CC=C2""",21,"""FCDA031414BF628E"""
-"""9BB39E6FE1E5EE4B_B8202AE96302894D_6039_UN""","""O(CCOCCOCCF)CC(N1C(CCCC1C)C)=O""",21,"""FCDA031414BF628E"""
-"""C07E5A3B9DACFC18_634020B47B80CEFA_6039_UN""","""O(CCOCCOCCF)CCC2COC1(CCCC1)O2""",21,"""FCDA031414BF628E"""
-"""AA5C148D3A576C8A_597FCF75C47A60F3_6039_UN""","""O(CCOCCOCCF)CC1=CC(=C([N](=O)=O)C=C1)F""",21,"""FCDA031414BF628E"""
-"""F49E051A692B1673_93426135A3730E96_6039_UN""","""O(CCOCCOCCF)CC1=CC=C(C(NC)=O)C=C1""",21,"""FCDA031414BF628E"""
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-"""254BE3C2DD31D517_0D7FE30E48B1CCD0_6039_UN""","""O(CCOCCOCCF)CC1=C([S](N)(=O)=O)C=CC=C1""",21,"""FCDA031414BF628E"""
-"""420C287FC9C220E8_C77056F5B02FAF83_6039_UN""","""O(CCOCCOCCF)CC(C(C(OCC)=O)(C)C)=O""",21,"""FCDA031414BF628E"""
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-"""6664801D901987D4_1977AFFBC7DA4EA2_6039_UN""","""O(CCOCCOCCF)CC1=C(OC)N=C(C=C1C)C""",21,"""FCDA031414BF628E"""
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-"""E99B5090C2935DDD_10CE4BA3CF2DCE7F_6039_UN""","""O(CCOCCOCCF)CC(C1=CC(=NC=C1)OC)=O""",21,"""FCDA031414BF628E"""
-"""1D1AB7E94B9FDE9D_229B5755C74416F0_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=C1)[S](Cl)(=O)=O""",21,"""FCDA031414BF628E"""
-"""29C606B01D964B9B_581FC0A4E7F3C380_6039_UN""","""O(CCOCCOCCF)CC1=CC=C([S](F)(=O)=O)C=C1""",21,"""FCDA031414BF628E"""
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-"""044204447E61D486_454A8805C9339668_6039_UN""","""O(CCOCCOCCF)CC1=CC=N[N]1C2CCCC2""",21,"""FCDA031414BF628E"""
-"""111D9B277998247A_00B615DA00199D64_6039_UN""","""O(CCOCCOCCF)CC1=CC=N[N]1CC(F)(F)F""",21,"""FCDA031414BF628E"""
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-"""FCAE4D9B19657DD3_9F05BC3654CC0105_6039_UN""","""O(CCOCCOCCF)CC(N(C)CC1=CC=CO1)=O""",21,"""FCDA031414BF628E"""
-"""6A1989D1A0007C6B_A9FB08C6F5C9ED2B_6039_UN""","""O(CCOCCOCCF)CC(=O)CCC1CCCCO1""",21,"""FCDA031414BF628E"""
-"""68ADB9E555A634D9_675BFF9D558C54FC_6039_UN""","""O(CCOCCOCCF)CCC(NC1=NOC(=C1)C)=O""",21,"""FCDA031414BF628E"""
-"""378A4600A280A0C7_74A65AB5A013EA16_6039_UN""","""O(CCOCCOCCF)CC(=O)NC1=C(C=CS1)C#N""",21,"""FCDA031414BF628E"""
-"""3837FBC0B588D5F2_EBBF2A31DF0519B4_6039_UN""","""O(CCOCCOCCF)CC1=NOC(=C1)C2=CC=CS2""",21,"""FCDA031414BF628E"""
-"""30B967CEF7410AFE_1EA7DF646096E4C0_6039_UN""","""O(CCOCCOCCF)CC(OC)CC1=CC=CC=C1""",21,"""FCDA031414BF628E"""
-"""7F0DDB0582E4343A_6A3E9D3B3E029509_6039_UN""","""O(CCOCCOCCF)CCOC1=C(C=CC=C1)C#N""",21,"""FCDA031414BF628E"""
-"""55921BA2E2043644_921E702E7AC47DED_6039_UN""","""O(CCOCCOCCF)CC(NC(NCCCC)=O)=O""",21,"""FCDA031414BF628E"""
-"""20B34BAE4DB2B366_BF0B668F180086F7_6039_UN""","""O(CCOCCOCCF)CC2=NC1=C(C=C(F)C=C1)O2""",21,"""FCDA031414BF628E"""
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-"""4456550477A8F1B4_FCE7B85292FB3742_6039_UN""","""O(CCOCCOCCF)CC1=CSC(=N1)C[S](C)(=O)=O""",21,"""FCDA031414BF628E"""
-"""5745CDAD27A758DC_E31AB7CD248CD03A_6039_UN""","""O(CCOCCOCCF)CCC(CC)(CC)C(=O)OC""",21,"""FCDA031414BF628E"""
-"""0040AC9828D23EC6_736DF4FCC575FCD7_6039_UN""","""O(CCOCCOCCF)CC(C1=C(OC)N=CC=C1)=O""",21,"""FCDA031414BF628E"""
-"""51BDBF707AE0332D_4375E359B3EE55A3_6039_UN""","""O(CCOCCOCCF)CC(C1=C(C=C(C)C=C1)C)=O""",21,"""FCDA031414BF628E"""
-"""0297A79EFB597C55_9C584C0D8D08E6C0_6039_UN""","""O(CCOCCOCCF)CC1=CC(=C(N(C)C)C=C1)C""",21,"""FCDA031414BF628E"""
-"""A350543BA1901F1C_2422CD534F9E7F6E_6039_DP""","""O(CCOCCOCCF)CC(NCC1CCCNC1)=O""",21,"""FCDA031414BF628E"""
-"""682DE0741191D11B_AA22FEDC44EC67CB_6039_UN""","""O(CCOCCOCCF)CC1=CC(=N[N]1C)C(OC)=O""",21,"""FCDA031414BF628E"""
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-"""EB76F7BC83D642D0_816359C46EE75700_6039_UN""","""O(CCOCCOCCF)CCCC1=C(OC)C=CC=C1""",21,"""FCDA031414BF628E"""
-"""9A62280BE2E64CDF_F5F55CD6E7FF2955_6039_UN""","""O(CCOCCOCCF)CC1=C(C(OC)=O)C=CC=N1""",21,"""FCDA031414BF628E"""
-"""6499D0442D4ED9D4_68F18CC4375A96B7_6039_UN""","""O(CCOCCOCCF)CC1=NC(=CC(=N1)N(C)C)C""",21,"""FCDA031414BF628E"""
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-"""44EF22CF80683C6E_8DFF0314A4091EE4_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)C(OCC)C""",21,"""FCDA031414BF628E"""
-"""B779007C416F3F8C_139716221E3E2257_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)CC(F)(F)F""",21,"""FCDA031414BF628E"""
-"""A94C9D521B0E199F_B21E8530CEEB024A_6039_UN""","""O(CCOCCOCCF)CC(=O)C1=CC(=CC=C1)C#N""",21,"""FCDA031414BF628E"""
-"""8BFFB9010B163A20_844E40B74313204F_6039_UN""","""O(CCOCCOCCF)CC1=N[N](C=C1)C2CCCC2""",21,"""FCDA031414BF628E"""
-"""903D57F63DB11169_D80EC87E6CB49EBD_6039_UN""","""O(CCOCCOCCF)CCCSCC1=CC=CC=C1""",21,"""FCDA031414BF628E"""
-"""5F1DC7E4B1577EE2_2988979FDEF6B2A9_6039_UN""","""O(CCOCCOCCF)CC1=C(OC(F)F)C=CC=C1""",21,"""FCDA031414BF628E"""
-"""E362D07F4E3631FD_1CB7874403A09FA5_6039_UN""","""O(CCOCCOCCF)CCCCOC1CCCCC1""",21,"""FCDA031414BF628E"""
-"""D3C87116CF698412_90ABE703FFFD64E2_6039_UN""","""O(CCOCCOCCF)CC1=CC(=C(OC)C=C1)C#N""",21,"""FCDA031414BF628E"""
-"""B18AE17FB95A50CF_AD95774614257CAD_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=C1)NC(C)=O""",21,"""FCDA031414BF628E"""
-"""35B307EAFF0EBFDF_85F97E26FD7C7358_6039_UN""","""O(CCOCCOCCF)CC1=CC=C(OC(F)F)C=C1""",21,"""FCDA031414BF628E"""
-"""EA3E94793D3E74C1_B00AFD2823D8685F_6039_UN""","""O(CCOCCOCCF)CC(C1=NC=C[N]1C(C)C)=O""",21,"""FCDA031414BF628E"""
-"""908333F27EEDBFD4_05CC0FC1FEE0E758_6039_UN""","""O(CCOCCOCCF)CC1=N[N](C)C(=C1)C(F)(F)F""",21,"""FCDA031414BF628E"""
-"""49DC896F6A65DA1A_71145E54CE89E66D_6039_UN""","""O(CCOCCOCCF)CC1=CC(=N[N]1C)C(F)(F)F""",21,"""FCDA031414BF628E"""
-"""8B3EAEA12C01DA54_FC6DA243535DB04F_6039_UN""","""O(CCOCCOCCF)CC(NC(CCCCC)C)=O""",21,"""FCDA031414BF628E"""
-"""44F308D815B80023_CDF95F293575A3DB_6039_UN""","""O(CCOCCOCCF)CC1=C(C=CC=C1)OC2CC2""",21,"""FCDA031414BF628E"""
-"""E2CD8B8EC9BAA26A_E6164258F90E5DC3_6039_UN""","""O(CCOCCOCCF)CC(NC1=CC(=N[N]1C)C)=O""",21,"""FCDA031414BF628E"""
-"""ECA575479B111CB1_89B0E73B4753B8A3_6039_UN""","""O(CCOCCOCCF)CC(=O)CCC1=CC=CC=C1""",21,"""FCDA031414BF628E"""
-"""CF4F628F8FCD0CC2_7A25085B42D5D8B3_6039_UN""","""O(CCOCCOCCF)CC(C1=N[N](CC)N=C1C)=O""",21,"""FCDA031414BF628E"""
-"""8CCBC13563F21904_2E71D5A41153D927_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)CC(NC)=O""",21,"""FCDA031414BF628E"""
-"""B7EED003699ED49A_56B55E3B651CEB24_6039_UN""","""O(CCOCCOCCF)CC1CN1CC2=CC=CC=C2""",21,"""FCDA031414BF628E"""
-"""E1C0E512FC881A79_9C7AB8CADABD5792_6039_UN""","""O(CCOCCOCCF)CCO[S](C[S](C)(=O)=O)(=O)=O""",21,"""FCDA031414BF628E"""
-"""850233A534449645_400C50708790832A_6039_DP""","""O(CCOCCOCCF)CC2=CC1=C(CCNC1)C=C2""",21,"""FCDA031414BF628E"""
-"""575C37A9295DCE02_A2962D06966EA41E_6039_DP""","""O(CCOCCOCCF)CC(N[C@@H](C(C)C)C(=O)O)=O""",21,"""FCDA031414BF628E"""
-"""D14B553247234A71_2C4A1A82F2E44E2F_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)C(OCC)=O""",21,"""FCDA031414BF628E"""
-"""681E1D31435B3163_8EF7C3F1CF193587_6039_DP""","""O(CCOCCOCCF)CC(N[C@H](C(C)C)C(=O)O)=O""",21,"""FCDA031414BF628E"""
-"""87D46F95B51B5199_A1A2F9B4E0B0F6C3_6039_UN""","""O(CCOCCOCCF)CC1=CN=C(C(F)(F)F)N=C1""",21,"""FCDA031414BF628E"""
-"""E932BEEA62C9D89A_A6F30A2E9C0B51DF_6039_UN""","""O(CCOCCOCCF)CCC2=NC1=C(C=CC=C1)[NH]2""",21,"""FCDA031414BF628E"""
-"""DE19C01448FBE615_63AB416E42908E7E_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=C1)C(C)(C)C""",21,"""FCDA031414BF628E"""
-"""E76F6AB553E7E9CC_8066662A54C9FFE0_6039_UN""","""O(CCOCCOCCF)CC1=NC=CC(=C1)OC(C)C""",21,"""FCDA031414BF628E"""
-"""99A1E1CF7475CB81_252365E116D752F8_6039_UN""","""O(CCOCCOCCF)CC1=C(C=C(C(O)=O)C=C1)F""",21,"""FCDA031414BF628E"""
-"""F65EB9B527EC2E75_3EA0BC3FCEC1DF88_6039_UN""","""O(CCOCCOCCF)CCCN(C)C1=CC=CC=C1""",21,"""FCDA031414BF628E"""
-"""BE3D35E6DF157969_A4EFB8C17DE9BF62_6039_UN""","""O(CCOCCOCCF)CC1=C(F)C=C(C(=C1)F)C#N""",21,"""FCDA031414BF628E"""
-"""A21833A2216EB536_E8C151A28C5E015E_6039_UN""","""O(CCOCCOCCF)CCSC1=CC=CC(=C1)OC""",21,"""FCDA031414BF628E"""
-"""7CB733B4992FC052_3BFD793A23DE2664_6039_UN""","""O(CCOCCOCCF)CCC1=NSC2=C1C=CC=C2""",21,"""FCDA031414BF628E"""
-"""1B7886FD12DF86CF_06445168F97FD799_6039_UN""","""O(CCOCCOCCF)CCC1=NOC2=C1C=CC=C2""",21,"""FCDA031414BF628E"""
-"""BB0DCB00DED561EF_B5AA4F14A084137F_6039_UN""","""O(CCOCCOCCF)CC1=NC2=C(N=C1)C=CC=C2""",21,"""FCDA031414BF628E"""
-"""4212C8110133FCBF_F5F1985B1BE262E2_6039_UN""","""O(CCOCCOCCF)CCO[P](OCC)(=O)OCC""",21,"""FCDA031414BF628E"""
-"""AB106C585233B8D7_860B1940D5D0CBF8_6039_UN""","""O(CCOCCOCCF)CCSC1=C(C=C(F)C=C1)F""",21,"""FCDA031414BF628E"""
-"""5F40CD3EB626D532_59E7141C038DCE0E_6039_UN""","""O(CCOCCOCCF)CCCOCCOCCOC""",21,"""FCDA031414BF628E"""
-"""9FECE53E98C2ADF0_DCAF13C26B55EF6C_6039_UN""","""O(CCOCCOCCF)CC1=C([N](=O)=O)C=C(C=C1)F""",21,"""FCDA031414BF628E"""
-"""93F7BFEE9D155772_021B6829CF63A709_6039_UN""","""O(CCOCCOCCF)CCC1=N[N](C(C)(C)C)N=N1""",21,"""FCDA031414BF628E"""
-"""9A2F40239639C5F2_0952AFE64524BE2E_6039_UN""","""O(CCOCCOCCF)CCC1CCC2=C1C=CC=C2""",21,"""FCDA031414BF628E"""
-"""D5E1F427F0AB49C5_45585B60A5F1ECA7_6039_UN""","""O(CCOCCOCCF)CCCC(CC(OCC)=O)=O""",21,"""FCDA031414BF628E"""
-"""A54CA7A1FFA5D3F5_3117D8896E551F27_6039_DP""","""O(CCOCCOCCF)CC1=CC=CC2=C1CCNC2""",21,"""FCDA031414BF628E"""
-"""CA19252B10A8EE86_91B64EABE9411920_6039_UN""","""O(CCOCCOCCF)CC(OC)C1=CC=C(C=C1)F""",21,"""FCDA031414BF628E"""
-"""B9000F101901B40B_8105D569D7408DB9_6039_UN""","""O(CCOCCOCCF)CC2=NC1=C(C=CC(=C1)C)S2""",21,"""FCDA031414BF628E"""
-"""8BB0AA88DA05335B_DFF56F1A81858EF5_6039_UN""","""O(CCOCCOCCF)CC1=C(C(F)(F)F)N=CC=C1""",21,"""FCDA031414BF628E"""
-"""DC140EC325025A4E_937B4179C768724E_6039_UN""","""O(CCOCCOCCF)CC(N(CC)CC(F)(F)F)=O""",21,"""FCDA031414BF628E"""
-"""BF454B216B5F6BBB_86BDF8293234C361_6039_UN""","""O(CCOCCOCCF)CC(NC1=C(C)C=CC=N1)=O""",21,"""FCDA031414BF628E"""
-"""49EBF9AA111116F8_25E396819FC035CC_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=C1F)[N](=O)=O""",21,"""FCDA031414BF628E"""
-"""BE556A78B6FBD18A_E8744DF1CEEF8AF7_6039_UN""","""O(CCOCCOCCF)CC1=CC(=NO1)C(OCC)=O""",21,"""FCDA031414BF628E"""
-"""B8AAE3105B1D9043_2E523D05DB0EC2BD_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(C=C1)C=CN=C2""",21,"""FCDA031414BF628E"""
-"""3AC98235ED2FE6AE_F4E70ABD9F0020BF_6039_UN""","""O(CCOCCOCCF)CC2=C1CCOCC1=CC=C2""",21,"""FCDA031414BF628E"""
-"""35D20BD79734E328_552C2455D27262A5_6039_UN""","""O(CCOCCOCCF)CC(NC1CCN(C)CC1)=O""",21,"""FCDA031414BF628E"""
-"""8437B786F1089FAD_1A3E7956E59064DE_6039_UN""","""O(CCOCCOCCF)CC1=CC(=C(C)C=C1)[N](=O)=O""",21,"""FCDA031414BF628E"""
-"""120803C6782D2B86_9683884D401B7000_6039_UN""","""O(CCOCCOCCF)CC1CC2(CO1)CCCCC2""",21,"""FCDA031414BF628E"""
-"""DB2CA00E744E95C9_1DEE5509AE22DEF7_6039_UN""","""O(CCOCCOCCF)CC1CC2(CO1)CCOCC2""",21,"""FCDA031414BF628E"""
-"""9518B2AC8778429C_9DA5E61DD799EAF1_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(C=C1)N=CC=N2""",21,"""FCDA031414BF628E"""
-"""4BE0C6EB7837F720_29FB9470C9B734A6_6039_UN""","""O(CCOCCOCCF)CC1=CN=C(C(OCC)=O)S1""",21,"""FCDA031414BF628E"""
-"""F7894DB3E4035392_BDFDCAE545E9671D_6039_UN""","""O(CCOCCOCCF)CC2CCC1(CCOCC1)O2""",21,"""FCDA031414BF628E"""
-"""601701C59BD9269A_F0FA3B090AEC52E1_6039_DP""","""O(CCOCCOCCF)CC2OCC1(CCNCC1)C2""",21,"""FCDA031414BF628E"""
-"""575D057B3EAC5408_13D304C72DF51C2C_6039_UN""","""O(CCOCCOCCF)CC2COC1(CCCCC1)O2""",21,"""FCDA031414BF628E"""
-"""2405DF6DB7F6A9AC_5D724EF404E28C7D_6039_UN""","""O(CCOCCOCCF)CC(N1CC(C)(C)OCC1)=O""",21,"""FCDA031414BF628E"""
-"""5446EF8E1B7FCF44_E7C1CD0A397FCB4B_6039_UN""","""O(CCOCCOCCF)CC(C1=CC=C(OC)C=C1)=O""",21,"""FCDA031414BF628E"""
-"""106D3A62AA5361F0_D6F2B73A96C72A2C_6039_UN""","""O(CCOCCOCCF)CC(=O)N1CC2CCC(C1)O2""",21,"""FCDA031414BF628E"""
-"""6C44F3661E4B4725_CD618991ED52A638_6039_UN""","""O(CCOCCOCCF)CC(C1=CC=C(F)C=C1)(F)F""",21,"""FCDA031414BF628E"""
-"""0FD82540B44B3522_E35796C6E4C150AD_6039_UN""","""O(CCOCCOCCF)CC(=O)NC1CCCCCC1""",21,"""FCDA031414BF628E"""
-"""172E1A9B1544B8E2_B8FE99F33E947BA3_6039_UN""","""O(CCOCCOCCF)CCCOC1=CC=C(F)C=C1""",21,"""FCDA031414BF628E"""
-"""9E553F1CC6407447_49A145960F309800_6039_UN""","""O(CCOCCOCCF)CCOC(=O)C1=CC=CC=C1""",21,"""FCDA031414BF628E"""
-"""9B52374A3516FEEC_040044AB0336EF7C_6039_UN""","""O(CCOCCOCCF)CCC[S](NC(C)(C)C)(=O)=O""",21,"""FCDA031414BF628E"""
-"""D091E34265F3A2F9_A24AAC99D2D10FB2_6039_UN""","""O(CCOCCOCCF)CC(C1=C(OC)C=CC=C1)=O""",21,"""FCDA031414BF628E"""
-"""B33EBB4C5EDB9B40_CE2F82793AA5033D_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=C1)C(F)(F)F""",21,"""FCDA031414BF628E"""
-"""395A72C7BFE027B7_6E4950CF9C6BE78C_6039_UN""","""O(CCOCCOCCF)CC1=C(F)C=C(C(=C1)C#N)F""",21,"""FCDA031414BF628E"""
-"""863A68B7E714844C_286BD8D3A669197F_6039_UN""","""O(CCOCCOCCF)CC1=C(CC(C)C)C=CC=C1""",21,"""FCDA031414BF628E"""
-"""66A4694C8E685DC0_D43AF13E2A3A8E1A_6039_UN""","""O(CCOCCOCCF)CC(=O)NCC1CCCCC1""",21,"""FCDA031414BF628E"""
-"""839379B5C6D6895D_84230FFB3659E215_6039_UN""","""O(CCOCCOCCF)CC(N(C)C1CCCCC1)=O""",21,"""FCDA031414BF628E"""
-"""7A6B178F24A3A2B7_E1FE394F6FA58BB6_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)COC(C)C""",21,"""FCDA031414BF628E"""
-"""4F49CD6392207642_BDB4171E4B67BCD3_6039_UN""","""O(CCOCCOCCF)CC2COC1(CCOCC1)O2""",21,"""FCDA031414BF628E"""
-"""F8CECF88AF49CA5C_D913EF37C7DD1952_6039_UN""","""O(CCOCCOCCF)CC1CCCC(C(F)(F)F)O1""",21,"""FCDA031414BF628E"""
-"""D9FB1D1210B8056D_2D04F74B2C68BDA9_6039_UN""","""O(CCOCCOCCF)CC1=NSC(=N1)C(OCC)=O""",21,"""FCDA031414BF628E"""
-"""CBC361F45A0B1BE5_496CC93A231B49DA_6039_UN""","""O(CCOCCOCCF)CCCCCCCCCCC""",21,"""FCDA031414BF628E"""
-"""00D71662A1404E44_73396A0A0959EB3B_6039_UN""","""O(CCOCCOCCF)CC1=NN=C2C(=O)NC=C[N]12""",21,"""FCDA031414BF628E"""
-"""11BC7E5C449037B9_FEBD7EA584183E4A_6039_UN""","""O(CCOCCOCCF)CC1=NC(=C(S1)C(C)(C)C)C""",21,"""FCDA031414BF628E"""
-"""47617A5D16702066_0C84A4A676C589BB_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(C=C1)C=NC=C2""",21,"""FCDA031414BF628E"""
-"""8FF23E17FC89D1E3_B18FFAB6791F68D8_6039_UN""","""O(CCOCCOCCF)CC1=C(C)C=C(C=C1C)C#N""",21,"""FCDA031414BF628E"""
-"""7B366B44EB7FC0A3_11D26AD1FF23457C_6039_UN""","""O(CCOCCOCCF)CC1=CN=CC(=C1)C(OC)=O""",21,"""FCDA031414BF628E"""
-"""42B4FB3C862C062D_68D35F8ABCAF7228_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=C1)[S](F)(=O)=O""",21,"""FCDA031414BF628E"""
-"""42663743863194A5_95897C4D9B08A818_6039_UN""","""O(CCOCCOCCF)CC1=C(CC(C)=O)C=CC=C1""",21,"""FCDA031414BF628E"""
-"""11A14C878E587397_F3BDB820F9EC9BA5_6039_UN""","""O(CCOCCOCCF)CC1=CC(=NN=C1C2CC2)C""",21,"""FCDA031414BF628E"""
-"""639979F950A96513_EC2255BD24B0EB67_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=N1)C(F)(F)F""",21,"""FCDA031414BF628E"""
-"""E949929A9FE06122_DACBEC9DC1A0A460_6039_UN""","""O(CCOCCOCCF)CCCN1CCC(F)(CC1)F""",21,"""FCDA031414BF628E"""
-"""691675C5265AC233_D23A288D17C43A26_6039_UN""","""O(CCOCCOCCF)CC1=C(C)C=CC(=C1)[N](=O)=O""",21,"""FCDA031414BF628E"""
-"""1EE1F2C3CF9BEE1F_2D84639CF39DC173_6039_UN""","""O(CCOCCOCCF)CC1=C(C=CC(=C1)C(O)=O)F""",21,"""FCDA031414BF628E"""
-"""B0C7A686BD9D8314_84739078ACA8A492_6039_UN""","""O(CCOCCOCCF)CCNC(=O)C1CCOCC1""",21,"""FCDA031414BF628E"""
-"""0EAF6A87334C23F8_2B503F010BEF9A34_6039_UN""","""O(CCOCCOCCF)CC1=NC=CC(=C1)C(OC)=O""",21,"""FCDA031414BF628E"""
-"""436C38E6C928FC06_ED72F45F75C873DF_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(C=C1)COCC2""",21,"""FCDA031414BF628E"""
-"""1C5DB8F703655604_76879B79634E660D_6039_UN""","""O(CCOCCOCCF)CCOC1CC[S](=O)(=O)CC1""",21,"""FCDA031414BF628E"""
-"""AC95A66A3ADCA7E5_2C68A9D60C6B6C26_6039_UN""","""O(CCOCCOCCF)CC1=NSC2=C1C=CC(=C2)F""",21,"""FCDA031414BF628E"""
-"""D57ABF809A81C2C2_80A80D16D377F2D9_6039_UN""","""O(CCOCCOCCF)CCCNC(C(CC)CC)=O""",21,"""FCDA031414BF628E"""
-"""FF3FCEEBDD388681_B1148FDDBB033BDA_6039_UN""","""O(CCOCCOCCF)CC1=C(F)C=C(C=C1F)C#N""",21,"""FCDA031414BF628E"""
-"""BFDD7ACDF5046734_506932DC63C999E7_6039_UN""","""O(CCOCCOCCF)CC1(F)OC(=O)CC12CCC2""",21,"""FCDA031414BF628E"""
-"""47E56F0D80AF68E7_79FE7D9BB34F2421_6039_UN""","""O(CCOCCOCCF)CC1=C([N](C)N=N1)C(F)(F)F""",21,"""FCDA031414BF628E"""
-"""A55A3474E161B463_C7F884EA681559EE_6039_UN""","""O(CCOCCOCCF)CC1=C[N](C)N=C1C(F)(F)F""",21,"""FCDA031414BF628E"""
-"""83F3B69CDC703678_91AA786DA174594D_6039_UN""","""O(CCOCCOCCF)CC1=CC(=C(OCC)C=C1)F""",21,"""FCDA031414BF628E"""
-"""75BCF72B2CA5A363_77F58602FC75689C_6039_UN""","""O(CCOCCOCCF)CC2=NC1=C(F)C=CC=C1O2""",21,"""FCDA031414BF628E"""
-"""F6B98A48D4C176F6_867CDA02725CC520_6039_DP""","""O(CCOCCOCCF)CC1OCCC12CCNCC2""",21,"""FCDA031414BF628E"""
-"""944F6F06A5115F93_6E6CECC79E988C80_6039_UN""","""O(CCOCCOCCF)CC1=CC=C([S](N)(=O)=O)C=C1""",21,"""FCDA031414BF628E"""
-"""1F2794709724CEF9_16F1A1650FD71A2B_6039_UN""","""O(CCOCCOCCF)CC(C1=CC=C([N](=O)=O)O1)=O""",21,"""FCDA031414BF628E"""
-"""AA90F16196A26ADB_8D00304938199402_6039_UN""","""O(CCOCCOCCF)CC1=C([S](C)(=O)=O)C=CC=C1""",21,"""FCDA031414BF628E"""
-"""311C596D8D12EF13_942CCDB8489D0139_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)C(OC)(C)C""",21,"""FCDA031414BF628E"""
-"""7906A8BD54791CC0_3218F18151F9F6FD_6039_UN""","""O(CCOCCOCCF)CC(NCCCOC(C)C)=O""",21,"""FCDA031414BF628E"""
-"""6265C03BAABF6E52_88014748E1F0658C_6039_UN""","""O(CCOCCOCCF)CC1=NCCC2=C1C=CC=C2""",21,"""FCDA031414BF628E"""
-"""9C3DB8B7165A79C6_7C5FE65504DB4BB1_6039_UN""","""O(CCOCCOCCF)CC1=CC=C(SC(F)F)C=C1""",21,"""FCDA031414BF628E"""
-"""1ECAEE6E7BDA708E_C486D431E6360EBE_6039_UN""","""O(CCOCCOCCF)CCC(=O)NC1=NC=CC=C1""",21,"""FCDA031414BF628E"""
-"""8D1C40097BCF6AD1_CE8002CCF9825563_6039_UN""","""O(CCOCCOCCF)CC1=C(C)OC(=C1)C(OC)=O""",21,"""FCDA031414BF628E"""
-"""3766B77FAD34EF53_743C68D87F66A929_6039_UN""","""O(CCOCCOCCF)CC1=CC=C(C=C1)[S](=O)(=O)Cl""",21,"""FCDA031414BF628E"""
-"""2D00CDE8F0E86CBE_8F48D1F5622B0225_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=C1[N](=O)=O)C""",21,"""FCDA031414BF628E"""
-"""C5F86DB4187AB5EC_7BB0DE0FE96B9E7B_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(C=C1)C=CC=N2""",21,"""FCDA031414BF628E"""
-"""C3B54CEB0DC90448_5BCE76824B929BCD_6039_UN""","""O(CCOCCOCCF)CCCOC1=C(F)C=CC=C1""",21,"""FCDA031414BF628E"""
-"""2A1420BC450085F7_059141DB65F1739E_6039_UN""","""O(CCOCCOCCF)CC1=C(C=CC(=C1)[N](=O)=O)F""",21,"""FCDA031414BF628E"""
-"""984E2F1AF6C6FB42_60EF62E137D84664_6039_UN""","""O(CCOCCOCCF)CCCNC(CC(C)(C)C)=O""",21,"""FCDA031414BF628E"""
-"""9AE87AC52304121F_97946C99F66906B0_6039_UN""","""O(CCOCCOCCF)CCC(=O)N1CCCCCC1""",21,"""FCDA031414BF628E"""
-"""9483DF28B6264BEE_714F34CC9AFE7738_6039_UN""","""O(CCOCCOCCF)CC2=NC1=C(CCCCC1)S2""",21,"""FCDA031414BF628E"""
-"""4AAF9A886BF017C6_25658902A85E84B4_6039_UN""","""O(CCOCCOCCF)CC1=CN=CC(=C1)C(C)(C)C""",21,"""FCDA031414BF628E"""
-"""91C3953B61A2BB80_E7947A7ACECC75A6_6039_UN""","""O(CCOCCOCCF)CC2CCCC1(CCOC1)O2""",21,"""FCDA031414BF628E"""
-"""C254D039E950446E_747339B48CEACEE0_6039_UN""","""O(CCOCCOCCF)CC(N(C)CC1=CSC=C1)=O""",21,"""FCDA031414BF628E"""
-"""A3F30143B3BD41F0_8AF5B48C02C69F8E_6039_UN""","""O(CCOCCOCCF)CC1CCCC(F)(F)C(N1)=O""",21,"""FCDA031414BF628E"""
-"""2D7BD5E94750E51B_213BB69B9DC03226_6039_UN""","""O(CCOCCOCCF)CC1=NOC(=N1)N2CCCC2""",21,"""FCDA031414BF628E"""
-"""67CB13604E3463EF_9AD6E78EC75D2A60_6039_UN""","""O(CCOCCOCCF)CC1=C(C)OC=C1C(F)(F)F""",21,"""FCDA031414BF628E"""
-"""4A41208BF88A079D_179BC998C68B1212_6039_UN""","""O(CCOCCOCCF)CC2=CC1=C(CN(C)C1)C=C2""",21,"""FCDA031414BF628E"""
-"""3B57EB201F832480_D5C1CD7F13FD8641_6039_UN""","""O(CCOCCOCCF)CC1=C(C(OCC)=O)[NH]N=C1""",21,"""FCDA031414BF628E"""
-"""F55FFC297FC093DB_4A01589F4B67B230_6039_UN""","""O(CCOCCOCCF)CC1=CC(=C(C)O1)[S](=O)(=O)C""",21,"""FCDA031414BF628E"""
-"""5F7B8FCA764E5077_AE8A3F81C5C738C5_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC2=C1N=C(C)O2""",21,"""FCDA031414BF628E"""
-"""CC572B74AF0F8F40_332BC861087E6A21_6039_UN""","""O(CCOCCOCCF)CC(C1=CC=CC(=C1)OC)F""",21,"""FCDA031414BF628E"""
-"""91D3546FDBC9F2B4_A7AF6810D9F79BD8_6039_UN""","""O(CCOCCOCCF)CC1=NN=C2[N]1CCOCC2""",21,"""FCDA031414BF628E"""
-"""ADAA631F43B66E5B_28A486783C16F32A_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(C=C1)CCOC2""",21,"""FCDA031414BF628E"""
-"""78F770C609F304E6_7C304E9B95D88DA3_6039_DP""","""O(CCOCCOCCF)CC1(OC(CC12CNC2)=O)F""",21,"""FCDA031414BF628E"""
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-"""0E798149E12B7F87_0B0DFC96D39548E6_6039_UN""","""CC1=C(C=C(C=C1)OCCC(=O)NC2CCCC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""65418E1232CE1893_EAC744DCBAACA8C7_6039_UN""","""CC1=C(C=C(C=C1)OCCCC(N(CC)CC)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""C25D5D7958FB20FC_03A300AA14CC3116_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC(=CS2)C(F)(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""ACC1E6B0E716259D_4CD6E703DB156A0C_6039_UN""","""CC1=C(C=C(C=C1)OCCC2CC(CC(C)C2)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""87737123273DD945_9EB1164F40BCC9E4_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)NC2=NC=CN=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""F31673E973FCEECD_F391A4C1417964CF_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC(=N2)C(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""5467B5DBBA467BD5_1BFC2A239DF20A16_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NN=C([N]2CCC)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""57AC21E4A3DE89BE_CD01D1B065700251_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NN=C(C(C)C)[N]2C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""EEEEA2E11294BE7C_BBD54F23680419CA_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC(=CC(=N2)OC)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""23BE3D06394D3B50_338441C798A01304_6039_UN""","""CC1=C(C=C(C=C1)OCC(N2CCN(C)CC2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""3097D4D03124DB2C_387BAF307C74257A_6039_UN""","""CC1=C(C=C(C=C1)OCCCC2=CC=CC(=C2)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""AC565595AB84892E_B9218B8CF8E4D0DD_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC(=NC=C2)N(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""B729C8AB6DB285D0_2667920C5A577021_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC(=CC(=C2)OC)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""2045C4343E279145_4A26F9C88894C0F6_6039_UN""","""CC1=C(C=C(C=C1)OCC(NCCCN(C)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""6C78F1ACF3AA81A5_D0451359FFDA91B3_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC=C([N]2C)[N](=O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""D78182F0A2D7A5D2_4CCE86BB26BB6F74_6039_UN""","""CC1=C(C=C(C=C1)OCC3=NC2=C(N=CC=C2)S3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""4224884636E0D12C_CA650C6283EAED0E_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=C(CCC)C=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""F4A12B09F4603332_77B0431E14E90D8C_6039_UN""","""CC1=C(C=C(C=C1)OCCCC2=CC=C(C)C=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""EA087F2134D421B0_9B46FC33F678F10B_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=C(C(F)F)C=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""7972202993C321ED_96B91E015C7A8909_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)NCC2=CC=CO2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""4B22C2D290635F1A_4C44635B87F8A710_6039_UN""","""CC1=C(C=C(C=C1)OCCCOC2CCCCO2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""22563D87DCBE632B_60104D3C2297B278_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)NC2=CC=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""7B19F53FFA03F00D_11909087262605CD_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(N=C(CCC)O2)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""B4EAEB38127A7225_057B3CCE434D90DE_6039_UN""","""CC1=C(C=C(C=C1)OCCCC2=CC=CC(=C2)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""87880A55459C29FC_751E549BE6EFB003_6039_UN""","""CC1=C(C=C(C=C1)OCCC2=CC=CC(=C2F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""16454021C216D1B4_BE5916FDF4780043_6039_UN""","""CC1=C(C=C(C=C1)OCCCN2CCN(C)CC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""8B2CF65A12E03036_3B502F518E5ECF33_6039_UN""","""CC1=C(C=C(C=C1)OCCNC(NC(C)(C)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""88DA344A7E354B52_E00C8549C6782E94_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=CN=CC(=C2)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""0FFF76386369CBD1_62E121A876FE001A_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NN=C(O2)C3CCC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""E0996689F403FD3C_A87A3240A087BF53_6039_UN""","""CC1=C(C=C(C=C1)OCCC(=O)C2=CC=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""8B139FC7620A3608_13AD566660BB1660_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CSC3=NCCCN23)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""264FBFE5BB541404_C87108B049E64E3D_6039_UN""","""CC1=C(C=C(C=C1)OCCCCC[N]2N=CN=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""1C65CB807FB2B06F_AB760DAFB87F7C72_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=C(C(C)=O)C=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""DCB12C43B85B5BBD_B36FC08E3F987735_6039_UN""","""CC1=C(C=C(C=C1)OCCOC2=CC=CC(=C2)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""484ED30A987EC12C_59E0552FC78464AD_6039_UN""","""CC1=C(C=C(C=C1)OCCC[N]2N=C(C)C=C2C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""3514883029C380D9_AD47D6E58E268339_6039_DP""","""CC1=C(C=C(C=C1)OCC2=NC(=NO2)C(N)(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""E00A4692E5423FA4_96A3AF3969A5651C_6039_UN""","""CC1=C(C=C(C=C1)OCC(N(C)CC(F)(F)F)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""E9892B6C1A8EC53F_61D0BAECF48B4914_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CN=C(N(C)C)C=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""CA3B5613C8889FF4_EDD98945FA1F73E7_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=C(C(OC)=O)O2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""5E99BAD38F5FA0CA_DED900A7AE484CB3_6039_UN""","""CC1=C(C=C(C=C1)OCCN2C(NC(C)C2=O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""1891EBBB9ECEE74B_AE3B945606F167A9_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=C(C=C2)N=[N]#N)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""CF1F1C12FBD942AB_26759323E0F8CC6A_6039_UN""","""CC1=C(C=C(C=C1)OCCCC(NCC(C)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""958DCF0A7FA17E59_DC3DA01A8A805443_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC(=NC=C2)OCC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""0A6CCB3C18FA04C1_93536A48D0A0082F_6039_UN""","""CC1=C(C=C(C=C1)OCCO[S](C(F)(F)F)(=O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""E0AEA95C8B49CD61_D634BE865E9988BB_6039_UN""","""CC1=C(C=C(C=C1)OCC3=C2SC=CC2=CC=C3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""090974DB9E802EE3_23C949C33CA673F1_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC3=NC=N[N]23)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""ECCC4419B19A8B7D_31EC5277781F9E89_6039_UN""","""CC1=C(C=C(C=C1)OCC2CCC(F)(F)C(N2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""3E3090D4FC40EDF8_2CD91157419F96E8_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=C[N]3C2=NC=C3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""BF25B8F2B21A5C60_8ED971580A388F35_6039_UN""","""CC1=C(C=C(C=C1)OCC3CC2COCCC2O3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""AA863EC36E095274_F751125586E00484_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)CCC2CCCC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""6E43E67EBC81D8D9_5F8C63476089120F_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=C(C)SC(=C2)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""68FF04394633EC6F_EFF349E58E834881_6039_UN""","""CC1=C(C=C(C=C1)OCCC[S](CCOC)(=O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""48FACDBE721C84A0_946A580C4F539486_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CSC(=N2)NC(C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""D61826F4DDBB44A5_61DA6B59703B2574_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NN=N[N]2C3CCC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""C00F32F15CAE85B9_5F0C6764EB3206B4_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NOC(=N2)CC(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""7A8430159E6C2063_E8B802B6B6A43889_6039_UN""","""CC1=C(C=C(C=C1)OCCOC2=C(C)C=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""B546534240D30502_43346699C60A6C70_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NN=N[N]2CCCC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""36F281B2562AFBFF_74546A4789F51ECD_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NN=C(C(F)(F)F)O2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""7CAA4ADFEBC365D3_8812B3EF812AD74D_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC(=C(F)C=C2)C#N)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""0F48A4252DB6E4D0_A7E88180233594BF_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C([S](C)(=O)=O)SC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""FBA4337B7AA790D5_DA7FE9A9AAFAFE44_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=C([S](C)(=O)=O)O2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""15AFD02F0184EDB2_825FAF49DF454180_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NSC3=C2C=CC=C3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""2674F8878B02E4B3_E60BB45574B23623_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(OC=N2)C3CCC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""7DD52F8F50BFE5E6_D5A12D81B48F794F_6039_UN""","""CC1=C(C=C(C=C1)OCCOC2(CCOC2)C#N)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""BCCF5CA783F195D0_446B878641F18018_6039_UN""","""CC1=C(C=C(C=C1)OCCC2C3CCN(C2)CC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""D06554D24CD6E929_3672AD0F6D0E1E6B_6039_UN""","""CC1=C(C=C(C=C1)OCC3=CC2=NC=N[N]2C=C3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""0AA43DC17F8B9EAD_92647CF7BB56EE1F_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC(=NO2)C(C)(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""FFE297256B0F3F01_723954E5A44C033D_6039_UN""","""CC1=C(C=C(C=C1)OCC2NC(=O)CC23CCC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""0E4F6E04C1AE1CCA_E7963968E1C5C2A6_6039_UN""","""CC1=C(C=C(C=C1)OCC3=NC2=C(CCCC2)[NH]3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""23A85F56EE3B7C97_7BE8CD815FF4CA00_6039_UN""","""CC1=C(C=C(C=C1)OCC2CCCC(O2)C3CC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""8B4882897DB98809_9093CDC816BE1116_6039_UN""","""CC1=C(C=C(C=C1)OCC3=NC2=C(CCCC2)S3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""0AE21768FFDD929E_302747725BDED899_6039_UN""","""CC1=C(C=C(C=C1)OCC3=CC2=NSN=C2C=C3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""CD618CCE476DB4FB_6463122FB662FCA7_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC(=CC=C2)C3CC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""2DD188B62AC41CFD_40AAAFBC1404AC03_6039_UN""","""CC1=C(C=C(C=C1)OCC(OC)C2CCCOC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""2CA32B491FEC02EC_2B9A188C5DF16C03_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC(=N2)CCC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""AFE309A406A000C0_2BC9BDF20F2B4182_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CN=C(OC)C=C2C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""53D6F1F84719B151_83DF78B461490A50_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC3=NC=C[N]23)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""386EFE7377B44E39_5DFF2EBC3B63B663_6039_UN""","""CC1=C(C=C(C=C1)OC[C@@H]2O[C@H]2C3=CC=CC=C3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""8D24FF9B7E4C1D15_D307BC7ED6B35A99_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=CC(=NC=C2)F)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""903C09BE2B9F8FAD_5B1DC0A415A2CCF9_6039_UN""","""CC1=C(C=C(C=C1)OCCC2=CC=CC(=C2)OC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""B38BBA6E1CA5CD6F_EC87FF642498CF33_6039_DP""","""CC1=C(C=C(C=C1)OCCOC2=CC=C(O)C=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""50CE76DABFDC3D59_C9C34C63480FC2A6_6039_UN""","""CC1=C(C=C(C=C1)OCC3[N]2C=CN=C2CCC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""9A4317A166CEB7AA_5B48726741F1AC4C_6039_UN""","""CC1=C(C=C(C=C1)OCC2ON=C(C(C)(C)C)C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""6C79FDF9FB188864_FF9C092E8BD9B38E_6039_UN""","""CC1=C(C=C(C=C1)OCC3CCC2(CCOC2)O3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""8471C78207D95FF8_A584DDBF63294B93_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=N[N](C(=C2)C)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""CE07EE293DF05C25_82C02AD63B65C71B_6039_UN""","""CC1=C(C=C(C=C1)OCC3=NC2=C(COCC2)S3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""4BD626E83BA258CF_3A29963AD488FA9C_6039_UN""","""CC1=C(C=C(C=C1)OCCC2CC(C)(C)NC2=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""8147808434C0FE78_A78FC390A961104C_6039_UN""","""CC1=C(C=C(C=C1)OCCC2=C(OC)C=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""CAFE9EE92BAB3D07_52B5614ABD1154CC_6039_UN""","""CC1=C(C=C(C=C1)OCC(N(C)C2CCCC2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""E190D6BDA55D6FB8_4C1CCFA62602AFD1_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(C=CC(=C2)OC)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""2663D5CB670B1A9A_1CF23043CEFD715A_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC=C(C(O)=O)C=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""06C829576C607594_E4936F0B08D5084E_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2C(C)(C)C2(C)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""01E927E0FE048078_146108564BB02FEB_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC(=CC=C2)CC=C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""0CF6B20B64175046_B4D93FA452776014_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(C=CC(=C2F)C)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""76237EEBEF1CD98D_D3AE762C253D2ADE_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(C(C)C)ON=C2C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""BF07764E098A19A8_4C8F95B3DCF41B50_6039_UN""","""CC1=C(C=C(C=C1)OCCO[Si](C(C)(C)C)(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""DD49B7A0D5DFF4DB_FD395A4734155AEA_6039_UN""","""CC1=C(C=C(C=C1)OCCC[S](C(C)(C)C)(=O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""25310E86D269C23E_4FC095F5AE59FC6B_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(OC)C=CC=C2F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""4BCFD59BEEA623C1_EF0DE7CA01C97E36_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=C[N](CC)N=C2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""F35A1F06D8088575_6528BA20259EAF96_6039_UN""","""CC1=C(C=C(C=C1)OCCOC[P](OC)(=O)OC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""4AF8DB016E0F96AF_6CFE2949A23A671B_6039_DP""","""CC1=C(C=C(C=C1)OCC3CC2(CCN2)C(O3)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""D624B3CFA95A468A_E3EF015CD56913AB_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(C(F)(F)F)OC=N2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""7472C38CD9F763FA_B41786DF8B281A9F_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=CC(=N[N]2C)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""281C8DA9E5AAF313_708F917286278296_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)C2=CNC(C=C2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""4E455B569F52F9F4_7B9C7BF364CC135E_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(C=C(OC)C=C2)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""1DB0BB2D2295BBA0_DFE5783D6D8D7B49_6039_UN""","""CC1=C(C=C(C=C1)OCCC2=C(C=C(C)C=C2)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""3CAAA039306BCAFB_BF89AF578C70FB65_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC(=NO2)C(C)(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""9A5EF016310109A8_D37F45AE85E5F7E8_6039_UN""","""CC1=C(C=C(C=C1)OCC3CC2CCCCC2O3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""6260A50DCC7EE81E_AEE8E69B26BE2D8C_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CON=C2C(C)(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""FF9B9D85CA0C61D2_A780A7EE79CD0AB1_6039_DP""","""CC1=C(C=C(C=C1)OCC3=C(C2CNC2)OC=N3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""2054169B818BF64B_01A24CD86BC9403E_6039_UN""","""CC1=C(C=C(C=C1)OCCCN2CCOCCC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""CA466D304DE2BCC3_87A951697B9A6941_6039_UN""","""CC1=C(C=C(C=C1)OCC3COC2=CSC=C2O3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""FE09FAC77A150237_952C6DDE803D6FFE_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(C=CC=C2)CC=C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""E7ED02E82DB2D6A0_6E1718B043FF3917_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CON=C2C3CCC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""6961E3BABDDB4C96_5EF8CC8088814F39_6039_UN""","""CC1=C(C=C(C=C1)OCCC=CC2=CC=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""3E67550AD0E63EFE_48DAEC818EDF7621_6039_UN""","""CC1=C(C=C(C=C1)OCCCN[S](=O)(=O)C2CC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""07CCA2A6CC1CDE5D_13D522CAE4971018_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C[N](C(C)(C)C)N=N2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""D8B5665349F0586B_16657D7E9980262F_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=C(C)C=CC=C2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""4B57EA05371BB832_17B0E8E704D6673C_6039_DP""","""CC1=C(C=C(C=C1)OCC3CC2(CCNCC2)O3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""3B49DA653F3B6D0D_E8204236839D8370_6039_UN""","""CC1=C(C=C(C=C1)OCCC2(C(F)(F)F)CCC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""C70630F0BAB27BF7_576C8320FB1341DA_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CSC=C2C(F)(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""B885866046B82EE1_5196C442A70EB22D_6039_UN""","""CC1=C(C=C(C=C1)OCCN2C(C)(COCC2)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""AA620C1F9AFF34E4_4406B845088B5552_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C([S](C)(=O)=O)C=CS2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""AABA88CAC92A6632_F4BBF79BE4F9555A_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(OC)C=CC(=N2)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""421B661C9B5DD8BA_1D0DCDE1003B9FB3_6039_UN""","""CC1=C(C=C(C=C1)OCCN2CC[S](=O)(=O)CC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""3ECD6DA2F7C8C0A4_05979E1ADE9EEA9A_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NSC(=C2)C(F)(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""6EAD0674B67B907A_AB2C692EC69DB9BF_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(N=C(OC)C=C2)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""72A5CB1936D1B6AE_988109E15FD8CDEE_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CSC(=C2)C(F)(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""525DB125C96BFC92_1F13FC41C0C777A1_6039_UN""","""CC1=C(C=C(C=C1)OCCCCCC2OCCO2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""10B9000839A3A601_283F7C85D9C03040_6039_UN""","""CC1=C(C=C(C=C1)OCC3CC2(CC2)[S](=O)(=O)N3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""BC5EE8D1CE451886_95C24946B5AE62BA_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC3=C(C=C2)N=N[NH]3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""DC4D6DF98ECC3700_4F72C4006E65DF6A_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC3=CC=N[N]23)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""07487379DDE26362_4096A4636187040F_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(COC)C=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""45B803FE835272A8_BB0567B0F4E64B14_6039_UN""","""CC1=C(C=C(C=C1)OCCCC2=C(C)C=CN=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""B1BB1E25269AB18A_68D5046AA5AF4895_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC(C(OC)=O)CO2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""C3742F6A2A330F30_E70DA5F38D0026FB_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC(=CC=C2)CC#N)C(=O)N""",21,"""9AD1142EEEAD50BE"""
-"""824C9CE0D64C0F4D_5ADD8EEB2AE379F2_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC(=CS2)C(F)(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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-"""AE72442605B071A5_4BF23D05D42CC8EF_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCN3CCCC3""",21,"""93233C30C095383F"""
-"""F5F55263902A210F_BEADB429F4612D83_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC[S](CCC)(=O)=O""",21,"""93233C30C095383F"""
-"""23E2A5022A04F2AB_C4816E02FCE2019B_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)SC(=C3)C""",21,"""93233C30C095383F"""
-"""5C86BEE8B46EABAA_A391C3765613D7D3_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3COC(C)(C)O3""",21,"""93233C30C095383F"""
-"""D6816847B2D48C11_2F80866743D90319_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3OCCN(C)C3""",21,"""93233C30C095383F"""
-"""C954616B9CBCEA26_E07D462AC6AC7CB8_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=[N](=O)C=CC=N3""",21,"""93233C30C095383F"""
-"""AF429216CFC0EBC0_1E0582B5640E7B37_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=C(C)N=CS3""",21,"""93233C30C095383F"""
-"""FEF3889290FFBD70_4A673FE454F2E748_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN3CCOCC3""",21,"""93233C30C095383F"""
-"""2090BD1C80D279E5_474934DA0D3AD0B0_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN[S](CC)(=O)=O""",21,"""93233C30C095383F"""
-"""26A636744F1924DA_580752F263382036_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CN=C(C)C=N3""",21,"""93233C30C095383F"""
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-"""0C2B728AE59E51AF_EE5B7B1AD2AF96DD_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC=C(CC)O3""",21,"""93233C30C095383F"""
-"""B83F6C6B7740521F_71B0292229427DAB_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3ON=C(CC)C3""",21,"""93233C30C095383F"""
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-"""F92367130DDF6356_666C53BD8911BB3E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCNC(=O)C3CC3""",21,"""93233C30C095383F"""
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-"""34690983AC63517B_AAE45749E030EEA7_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC(OC)OC""",21,"""93233C30C095383F"""
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-"""5C29644340716A16_35EBE499CF518D9C_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CN=C(C)C=C3""",21,"""93233C30C095383F"""
-"""D40C01D3A9E484E8_C48A4B543FDCC636_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC[S](C)(=O)=O""",21,"""93233C30C095383F"""
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-"""7753F728487D7F63_D525C066B6131AAD_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3N(C)CCC3""",21,"""93233C30C095383F"""
-"""74ECA1AC150AA158_666C209AE12829F0_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN3CC(C)CC3""",21,"""93233C30C095383F"""
-"""1970AA9967B540EB_F09A0DE28F96D9D7_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN3CCSCC3""",21,"""93233C30C095383F"""
-"""5F3658B8A3E29388_AC2B90DEF0D8D460_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOCCN(C)C""",21,"""93233C30C095383F"""
-"""37615838AC6FF2EF_0668F93C8B526B78_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)C=CN=C3""",21,"""93233C30C095383F"""
-"""979E8A04CB3DC0A6_3245BA7675FFEE78_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCSCC(C)C""",21,"""93233C30C095383F"""
-"""FDE9F364055CC41A_050D8096DE375077_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCC(F)(F)F""",21,"""93233C30C095383F"""
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-"""B459B6C78475C99D_8FAF7DC9F8B2C87A_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CCCC(=O)N3""",21,"""93233C30C095383F"""
-"""A4DDAB8FB7423995_1FEC793222BBE752_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)C=CC=N3""",21,"""93233C30C095383F"""
-"""83C96B6CAA9CB11D_259E7CD811A3DE7E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(OCC(C)C)=O""",21,"""93233C30C095383F"""
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-"""150DEF3907C6B29B_354942DFE630CF63_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)[N](N=C3)C""",21,"""93233C30C095383F"""
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-"""0408AB1E1C070F66_B6F2CB9A70D9665F_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=CN=C[N]3C""",21,"""93233C30C095383F"""
-"""61A9CB9D71D36B39_F6D6DBDCC38E5969_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC=C(F)C=C3""",21,"""93233C30C095383F"""
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-"""9F30FF10E857891F_1860BF47641EDB0F_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3CCCNC3""",21,"""93233C30C095383F"""
-"""6CEDB4A0037ACC9F_E62261F251FC658A_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CN=CC(=C3)C""",21,"""93233C30C095383F"""
-"""EB015647092F82F1_9AB5AB107BA65189_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC(N(OC)C)=O""",21,"""93233C30C095383F"""
-"""57393C567C8265B0_5A1D96E92D98DCC6_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=CC=N[N]3C""",21,"""93233C30C095383F"""
-"""E2574610139A1241_DC2A272E8D9246B6_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=NC=CS3""",21,"""93233C30C095383F"""
-"""2F523EA1ED442762_B1992467C0EC149C_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=CSC=N3""",21,"""93233C30C095383F"""
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-"""A1D89A4309063137_0FB0132B12FF8B02_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC=N[N]3CC""",21,"""93233C30C095383F"""
-"""D591FC3F7C00F651_754A79EEFDBD1AF3_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCCCCN""",21,"""93233C30C095383F"""
-"""5B738597B2DCA375_9911951ADC5244AD_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3CCCC3""",21,"""93233C30C095383F"""
-"""780B464C57E3E955_C9A7C1AF43DA1407_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCSCCOC""",21,"""93233C30C095383F"""
-"""3068172910E7B400_3327FDC6ABDC4C08_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3C[S](=O)(=O)C3""",21,"""93233C30C095383F"""
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-"""6EA5A7DB53838511_EE08A98201E77CC5_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CN=C(C)N=C3""",21,"""93233C30C095383F"""
-"""73EA5A046BA29DF7_8A3AE659D5D145C1_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=CC=NC=C3""",21,"""93233C30C095383F"""
-"""9EA3F615519FF6B0_AD1476E2B5B3F8DF_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=NC=C[N]3C""",21,"""93233C30C095383F"""
-"""6FD6BEB39C854741_CDDA511770797880_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(C(OC)(C)C)=O""",21,"""93233C30C095383F"""
-"""6ABA996DB36D43BA_8E763EE58C28B3EA_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(C)O[Si](C)(C)C""",21,"""93233C30C095383F"""
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-"""185CE7061CB9A728_7043F4BBE7128FA9_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(C(CC)(C)C)=O""",21,"""93233C30C095383F"""
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-"""99110B29BE84769A_3084CA139A45FD80_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN3CCNC3=O""",21,"""93233C30C095383F"""
-"""242C440DCBD98E3B_34845CEB12DF26DB_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(OCC)OCC""",21,"""93233C30C095383F"""
-"""A01209EDE5DDC832_FA876A58F3F553D1_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3(OC)CCC3""",21,"""93233C30C095383F"""
-"""D19766A0CBD91981_6C899E081CB79403_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3CCNC3=O""",21,"""93233C30C095383F"""
-"""3A6B8644A2EB232C_2949A256AE90A9A1_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC(=NC=N3)C""",21,"""93233C30C095383F"""
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-"""9B67F8302C40DC99_765C0A6C15BD5445_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC=C(F)C=N3""",21,"""93233C30C095383F"""
-"""C57D971A12C65B7D_55C5E19D598B7568_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=N[N](CC)C=C3""",21,"""93233C30C095383F"""
-"""9D2EB04865396CD5_E53FA731B08D12CA_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC(=NO3)CC""",21,"""93233C30C095383F"""
-"""0BB8BB3D2E9EEEAE_B317A6802BAE5737_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(ON=C3C)C""",21,"""93233C30C095383F"""
-"""BA7D125F7D416328_CF89956E9A66DD07_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(CC(F)(F)F)=O""",21,"""93233C30C095383F"""
-"""27D125234EB4273E_404AB586623E6FC5_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC(OCC)=N""",21,"""93233C30C095383F"""
-"""72AFEBE21EA17A7D_9AD9807E4D8EE6AC_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=C(C#N)S3""",21,"""93233C30C095383F"""
-"""28884A642C4CCAE7_BDDE02CC13A06782_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CON=C3CC""",21,"""93233C30C095383F"""
-"""8B3522C7A93C8E63_7461935A3B3402A2_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC(C(OC)=O)C""",21,"""93233C30C095383F"""
-"""F246F8030B03B999_D9300CFC26FA1290_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCCC(C)C""",21,"""93233C30C095383F"""
-"""85A683BA7027402D_21B31A8D4ACC2714_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3CCOCC3""",21,"""93233C30C095383F"""
-"""9C7C9D6358D93B31_D18436F5EEE1F31A_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(CCC(C)C)=O""",21,"""93233C30C095383F"""
-"""78B175F7C5BD2849_087C982917D72A28_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC3=C[NH]N=C3""",21,"""93233C30C095383F"""
-"""37D5D895567849E5_BD1901C5D3131DB7_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3CCNCC3""",21,"""93233C30C095383F"""
-"""413D521DA344F208_D623DF2ED9FFFE8B_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=CC(=N3)F""",21,"""93233C30C095383F"""
-"""81881892831ED02A_6CCB9095F678D1BC_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CN(C)C(O3)=O""",21,"""93233C30C095383F"""
-"""1867DAF406DD43FA_5BB403B1F234F4CE_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=CCCCC3""",21,"""93233C30C095383F"""
-"""B1A4DD2C09B13C85_02FCCF29FB2CEF9D_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3OC3CCCC""",21,"""93233C30C095383F"""
-"""3011FC56B667D870_2BB122793136FB58_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(N=C(C)O3)C""",21,"""93233C30C095383F"""
-"""6EBECDDBBD5DBDDA_B752E573EC6B8A44_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN3CCNCC3""",21,"""93233C30C095383F"""
-"""0084969ADE3D74AA_9D27BA3788362252_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3OCCCO3""",21,"""93233C30C095383F"""
-"""EF87B1DF90DF4B8F_93A17F72B8197FCE_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC(C)(C)C#N""",21,"""93233C30C095383F"""
-"""BE95AA26E6CA984D_AD9432E116BFD50D_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(N=C(C)S3)C""",21,"""93233C30C095383F"""
-"""76EEFCA13EF036DD_1AEEA872C782CF79_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC[S](=O)(=O)Cl""",21,"""93233C30C095383F"""
-"""F19D40B5FD0D8DFA_CF21157EE9E92927_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NN=C(CC)O3""",21,"""93233C30C095383F"""
-"""933E3D5778D2A5EB_35CA578E0937F134_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C[N](N=C3C)C""",21,"""93233C30C095383F"""
-"""E46E471A1ED0C0F4_6B61083FC6A0F821_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN(C(OC)=O)C""",21,"""93233C30C095383F"""
-"""DF37232FC4C18B3F_39A984CCF9709EB6_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC(=NC=C3)N""",21,"""93233C30C095383F"""
-"""267BD5A51941CFC0_C91478D3C1B0F42E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3CCCC3=O""",21,"""93233C30C095383F"""
-"""D8DB41C3F4E48D4E_A9A09197496B6FEF_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CN=N[N]3CC""",21,"""93233C30C095383F"""
-"""B52F407179AD2D95_1CB09D144CA2E2F2_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(F)C=NC=C3""",21,"""93233C30C095383F"""
-"""169B0A6C36F33263_6699D8D5634CC7A1_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC(=NO3)OC""",21,"""93233C30C095383F"""
-"""DCE2D1D5D421CDE6_E202B9103BB9EC3E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=N[N](CC)N=C3""",21,"""93233C30C095383F"""
-"""83D7EC723D0C8648_D3713FDDD4B805D9_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC(=NS3)OC""",21,"""93233C30C095383F"""
-"""700190F915E55167_BA2E674AF5A478DA_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC=NNC(OC)=O""",21,"""93233C30C095383F"""
-"""0F6A6374A105042D_5B3A96E8AE6EF6F6_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(OC)CC(C)C""",21,"""93233C30C095383F"""
-"""8150ECADCF51AB8D_937FDD3B82BD4421_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOCC3CCC3""",21,"""93233C30C095383F"""
-"""6FD734ABDFD5D9DA_70449874ECC3C46F_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC(=CS3)C#N""",21,"""93233C30C095383F"""
-"""A305336B17573E29_7E13ED86DD101767_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=C)C[S](=O)(=O)Cl""",21,"""93233C30C095383F"""
-"""2B01AB456D509ACF_0028D0F0BE494E53_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CN3CC4CC4""",21,"""93233C30C095383F"""
-"""188643B9482C6DE4_694D16E17FC1E6C9_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C[N](CC)N=N3""",21,"""93233C30C095383F"""
-"""166891C9EE322F25_1C74F349D7685955_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(N=[S](C)(=O)C)=O""",21,"""93233C30C095383F"""
-"""78C1EB57BF0D9771_F8CA9B0EA289D11E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN3CCOC3=O""",21,"""93233C30C095383F"""
-"""4FC29BC8F5272D65_10D69CD6877635DF_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC3CCOC3""",21,"""93233C30C095383F"""
-"""332638DD1A487175_B35B2E8CBFB924AB_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CN3CC(C)C""",21,"""93233C30C095383F"""
-"""11CA38FA6C9F29CC_3D91CE79E2928990_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC(C)(C)C3CC3""",21,"""93233C30C095383F"""
-"""0F3C538C0485A63D_6B42E1E8763DD57C_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC3=NN=N[NH]3""",21,"""93233C30C095383F"""
-"""3BE8BC8F37D74CF6_9950AC57D11D77DE_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=NOC(=N3)C""",21,"""93233C30C095383F"""
-"""9B61D411C15AF5E2_66DC000DCF88E8F5_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOC3CC3(F)F""",21,"""93233C30C095383F"""
-"""5E29D2BD1876963A_90B56AABD6873C66_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CCC[S]3(=O)=O""",21,"""93233C30C095383F"""
-"""41D6C5BD5FAEAD73_9DD981D2B7413787_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C[N](CC)N=C3""",21,"""93233C30C095383F"""
-"""91F735649EEB101F_E45456771A96F5E4_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(OC)C3CCC3""",21,"""93233C30C095383F"""
-"""BD6ED20026E78A73_5A8AB80D70084DF7_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=NC=CC=C3""",21,"""93233C30C095383F"""
-"""2F07835775FC0B52_F48B439EBCBFED12_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=CC=NS3""",21,"""93233C30C095383F"""
-"""0166B8B5EDBCE02A_1755629DA30858FF_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=C[N](C)N=N3""",21,"""93233C30C095383F"""
-"""7BB9F4B433279A65_2572D6736EB4F18B_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=COC=C3""",21,"""93233C30C095383F"""
-"""F60ADDDE7F22F1BC_3D2C00D5AFCD0E74_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(OCC)C3CC3""",21,"""93233C30C095383F"""
-"""9767A6A555833EDC_49DCE5BD5A675D19_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC(CCC)C""",21,"""93233C30C095383F"""
-"""505A3890436F96FA_7E9413FCE4BCFE2D_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)C=NC=C3""",21,"""93233C30C095383F"""
-"""7760F39CF6F5A4F3_322168A4381ADC1D_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC(=NC=C3)F""",21,"""93233C30C095383F"""
-"""B848971D95253F2A_A80AB548F243C9B9_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=CC(=C3)F""",21,"""93233C30C095383F"""
-"""BC8B3D2633FB0790_3D8D5F6B4A95A517_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NN=C(CC)S3""",21,"""93233C30C095383F"""
-"""BADD8E17B7A51091_657B328A1E28BB71_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC(=C([NH]3)C)C""",21,"""93233C30C095383F"""
-"""AB762946D3F79087_3C2C3C6FD7F42BD4_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)N=CC=N3""",21,"""93233C30C095383F"""
-"""8E30E044F85B145A_4E72DE0F143668FE_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC(=NC=C3)C""",21,"""93233C30C095383F"""
-"""6AD120042BFBD790_ECB28ED73DD2E98F_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCSC(C)(C)C""",21,"""93233C30C095383F"""
-"""6051343612DD8E9D_4C6D21E3B27A1C2F_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3OCC(C)(C)C3""",21,"""93233C30C095383F"""
-"""96E06E264D9B6E27_88C574D30F168380_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=NN=N[N]3C""",21,"""93233C30C095383F"""
-"""47A2E2B6420E065A_1F071B67B0CFDA67_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOC(C(C)=C)=O""",21,"""93233C30C095383F"""
-"""CE87E8BFF7339C17_67BFB5275D9ED7D8_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCC(OC)=O""",21,"""93233C30C095383F"""
-"""4D2ADD8BE57731F7_0B5EB8F2669682F6_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(N=C(C)[NH]3)C""",21,"""93233C30C095383F"""
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-"""E4D24D61490D7842_DC1F4E2C295E7FF3_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=C(C#N)O3""",21,"""93233C30C095383F"""
-"""A1C287004D3A96BC_AAFE29D0D01BDB95_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(CC(OC)=O)=O""",21,"""93233C30C095383F"""
-"""DE7F35370C1B88D0_ABC2D9B95D291383_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC[C@@H]3C[C@H]3C4CC4""",21,"""93233C30C095383F"""
-"""C3D2E8AFEABE9ED1_2DE78C71620EDE59_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC(OCC)=O""",21,"""93233C30C095383F"""
-"""50922EC456C219A0_805C014A93C408C3_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC3=NC=C[NH]3""",21,"""93233C30C095383F"""
-"""F7D5847ED38A2BAE_1B98535FA2511976_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(N(CC)CC)=O""",21,"""93233C30C095383F"""
-"""9EE90E6003C05727_C9094C86C33D081E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)C=CC=C3""",21,"""93233C30C095383F"""
-"""999DC8BFA3AB0F35_F75B6566AAFEDCE7_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(NC(CC)C)=O""",21,"""93233C30C095383F"""
-"""8093ED19E9E68199_A0D08A08E16BA52E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(C(OCC)=O)=O""",21,"""93233C30C095383F"""
-"""EC21A70D79B0E7B0_B8589A3AE1E6B751_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCOC(F)(F)F""",21,"""93233C30C095383F"""
-"""0363B7BCBA7A9943_0FCF4FC69F010293_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=CC(=C3)O""",21,"""93233C30C095383F"""
-"""57E3B9C537F868E7_3964EA1F75336AF3_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=C(F)C=C3""",21,"""93233C30C095383F"""
-"""A25A5C50313FA1A3_B8668A87A11627CF_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(F)C=CN=C3""",21,"""93233C30C095383F"""
-"""7CBFF0726E503841_A90C266FA805645F_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=C(C)C=C3""",21,"""93233C30C095383F"""
-"""6BEA5E0D181E9DBE_A460A43FDA81B4CD_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=CC(=C3)C""",21,"""93233C30C095383F"""
-"""28B1DF961F880BF8_20D71FD2CAC0EC90_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NN=C(C)[N]3C""",21,"""93233C30C095383F"""
-"""4B78C23FE19E58E0_80C6D256B6AF99F9_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(NCC(C)C)=O""",21,"""93233C30C095383F"""
-"""9E35B95C90F37EB3_4BEC994DA4851455_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(NCCCC)=O""",21,"""93233C30C095383F"""
-"""30DE7CAA0F8A551B_F9804030A56B5E18_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC3CCCC3""",21,"""93233C30C095383F"""
-"""62DCE33F410809BF_5951C845F39C27AD_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCOCCOC""",21,"""93233C30C095383F"""
-"""C9E910E8B82E71A7_E35BF0F47C52D907_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCC(C)(C)C""",21,"""93233C30C095383F"""
-"""76F905FD6D949820_9D4F141BACC2AE4B_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=NN=C[N]3C""",21,"""93233C30C095383F"""
-"""A2D026E4433F24D7_01C804795815EDB3_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC(C(C)C)=O""",21,"""93233C30C095383F"""
-"""FE0E3821999A74EE_670C7CB91E875527_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC[S](C(F)(F)F)=O""",21,"""93233C30C095383F"""
-"""875E82CD04CD91AF_B94607425CEE83DE_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOCCOCC""",21,"""93233C30C095383F"""
-"""F6DBAEDD466F2B3D_189A33FDFC230FC5_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CN=C(CC)O3""",21,"""93233C30C095383F"""
-"""51F7F95D20B0C2C4_57043E34E4021C1F_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOC3CCOC3""",21,"""93233C30C095383F"""
-"""07453E866B7F2936_3FC242D7B48CDA58_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=NN=C(C)O3""",21,"""93233C30C095383F"""
-"""AD4C1D72037CC493_F255B41BD699C32A_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=CC(=N3)O""",21,"""93233C30C095383F"""
-"""04C5D9743B95A73F_1AB43B7C6ED83866_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCCCC#C""",21,"""93233C30C095383F"""
-"""A182C55378D7FDA8_A5DE860CB595BF22_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=N[N](C=C3C)C""",21,"""93233C30C095383F"""
-"""B1A8476AC7EBC747_4648D68727E3DB24_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3OCCNC3=O""",21,"""93233C30C095383F"""
-"""0B3C3A37973C3BF6_B1D6ED9979629A7D_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CSC(=N3)CO""",21,"""93233C30C095383F"""
-"""5BE21B568CFB413D_4C78CC0CA51125B4_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCOC3CCC3""",21,"""93233C30C095383F"""
-"""84342A04F5234482_551B7DB3F93F812F_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC[N]3C=NC=C3""",21,"""93233C30C095383F"""
-"""6A84D47BAAD26164_9A13463925B3734F_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3OCC(F)(F)C3""",21,"""93233C30C095383F"""
-"""582B9F27815D7F52_9631EFC32ABDC2AC_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=CSC=C3""",21,"""93233C30C095383F"""
-"""D49660AE3EEE979C_5A3F27A6A9A1EA36_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=CSN=C3""",21,"""93233C30C095383F"""
-"""37358CB1BEF54CC6_A38C12B4546F1457_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3CCCO3""",21,"""93233C30C095383F"""
-"""8F97020D1667157C_D768F8A294C8000D_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC[N]3N=CN=C3""",21,"""93233C30C095383F"""
-"""C3DB8BC4C61B6C68_D1D6EF2923C44F95_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NN=C(C)C=C3""",21,"""93233C30C095383F"""
-"""D7713AAE59AF7399_6FD31220E74DF8DD_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3OCCC3(C)C""",21,"""93233C30C095383F"""
-"""6311EB6C3AF55EAA_573A8A744CF854C1_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CN=C[N]3CC""",21,"""93233C30C095383F"""
-"""4BAB6914E0A108BF_B244F7D675F76AA6_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC(C(F)F)(F)F""",21,"""93233C30C095383F"""
-"""7108216084265C85_42722AFE7870391E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=CC=C[N]3C""",21,"""93233C30C095383F"""
-"""0B39A5F4EC211EA3_13DF4090DDFC0169_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOCCC(C)=O""",21,"""93233C30C095383F"""
-"""D6816847B2D48C11_856B06F5D361547F_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CN(C)CCO3""",21,"""93233C30C095383F"""
-"""79407D5F147A3314_CF7828EC93200259_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCSC3CCOC3""",21,"""93233C30C095383F"""
-"""36956E8DE77674F7_5DDB153B22A44E3E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN(C)[S](=O)(=O)C""",21,"""93233C30C095383F"""
-"""C2ECA320A4DFADD2_16A7CD57A47B4C34_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NN=C(OC)S3""",21,"""93233C30C095383F"""
-"""F3ED03C10C34DD9D_9FB02CA2A1A5FF33_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=N[NH]C(=N3)CC""",21,"""93233C30C095383F"""
-"""B7DC3CE7062128B3_B25F37C3FA411F27_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)NCCC#N""",21,"""93233C30C095383F"""
-"""43720564731F870C_A1AAC068060A7422_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCCC(O)=O""",21,"""93233C30C095383F"""
-"""2EF1E2332F459509_6522B3EDFDBCF99D_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(NC(C)(C)C)=O""",21,"""93233C30C095383F"""
-"""5DE183DC248BDFED_87E7FFD21768F099_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)SC(=N3)C""",21,"""93233C30C095383F"""
-"""281AA7CC325E8F15_A6ACCC68EE2783AB_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(C3CCNC3)=O""",21,"""93233C30C095383F"""
-"""9409060DAC1A913A_7243FF104BB25337_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=N[N]3CC""",21,"""93233C30C095383F"""
-"""BF7334C390517B45_15EEC3A79AA1D6B8_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC#C[Si](C)(C)C""",21,"""93233C30C095383F"""
-"""B5FE2A5DC0464F84_55DADE37DEE77743_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=NC=CN=C3""",21,"""93233C30C095383F"""
-"""B31E24C591E1553E_EE2F28D9D38A3A03_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC[N]3C=NN=N3""",21,"""93233C30C095383F"""
-"""400EDC7CAF2E841D_A03CAA9ECBF1DC0F_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC#CC3=CC=CS3""",21,"""93233C30C095383F"""
-"""A1FC19E5696A7E58_251A58BBDB99A608_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCCC(C)=O""",21,"""93233C30C095383F"""
-"""B1281E8ED77DEB58_5914CE8F2677DB23_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(CN)OC=N3""",21,"""93233C30C095383F"""
-"""8BBB75C46539360A_B22B8A69C6987807_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CC[S](=O)(=O)N3""",21,"""93233C30C095383F"""
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-"""0E49DCFEFB914D8B_5E53D29A5F2AC30E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=COC=N3""",21,"""93233C30C095383F"""
-"""D0241646711C7239_7AE584D9EF54DB78_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(SC=C3)C#N""",21,"""93233C30C095383F"""
-"""67B0F747B8CE9CAB_6701A9BAB6625316_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(F)C=CC=N3""",21,"""93233C30C095383F"""
-"""646CA8E9FB0C5346_2A0AE200C2CDE8EE_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=CC=CS3""",21,"""93233C30C095383F"""
-"""06D14FC2539F7CA9_7845B314DAE70EB9_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=CN=CO3""",21,"""93233C30C095383F"""
-"""0C80E3B154417208_BC795832CED0A854_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=CSN=N3""",21,"""93233C30C095383F"""
-"""0293B7B1B9273F57_882A57E8906D5EDC_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3=NOC=C3""",21,"""93233C30C095383F"""
-"""E60C579D70D39174_DB473432F4EB8D02_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NN=C[N]3CC""",21,"""93233C30C095383F"""
-"""F78711BF122C31F2_1ABCFDF2B01F8F73_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)C=N[N]3C""",21,"""93233C30C095383F"""
-"""B965459B300B03C8_400A122DDAC23055_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOCCC(O)=O""",21,"""93233C30C095383F"""
-"""7381E67344E1BA26_93632FF51635CAD3_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC#CC3=CC=NS3""",21,"""93233C30C095383F"""
-"""8EE02A52AA5E9CA0_913D4EFD22F3C156_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CCCCCO3""",21,"""93233C30C095383F"""
-"""5C1D2E249EAF4CEC_9B37915D7D46DFA8_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CCC(C)(C)O3""",21,"""93233C30C095383F"""
-"""3F49ECDA4D60821F_4084E7DAD37E7C22_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC[N]3N=CC=C3C""",21,"""93233C30C095383F"""
-"""CF46E3BE80664473_468FE30FC99EC0CE_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NOC(=N3)CN""",21,"""93233C30C095383F"""
-"""8EEC38D823CAF03D_8CEA8ABBBEEA27D3_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC=CC(=C3)C""",21,"""93233C30C095383F"""
-"""ACFC8B07A1740464_29524163ED1A8FA3_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3OCCNC3""",21,"""93233C30C095383F"""
-"""1A744E424B3EABBD_0B4296FBF964F856_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(F)N=CC=C3""",21,"""93233C30C095383F"""
-"""C86B1A7414BB44DA_BE40AC700C7CB4DB_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC(=N[N]3C)C""",21,"""93233C30C095383F"""
-"""BA176E12B4B00E35_0FEF972FD444DA64_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC=C3CCOCC3""",21,"""93233C30C095383F"""
-"""875EEC163A2FD141_B1651349D4DD1C83_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3CCCOC3""",21,"""93233C30C095383F"""
-"""DD497DA4856D8F36_ABE9399F9F3E64D5_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3COCCO3""",21,"""93233C30C095383F"""
-"""EC509D2AFB3B5E87_DFC29BBCEFE6338A_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NOC(=C3)CN""",21,"""93233C30C095383F"""
-"""04BADB47C994E00C_9E7D524724AA1254_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC(C)(C)CO3""",21,"""93233C30C095383F"""
-"""D872943B4D9333D0_C170A23D92CBFA05_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC#CC3=CN=CS3""",21,"""93233C30C095383F"""
-"""B9AB4209969AFEE3_B2D3CEF90FF886BF_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC(=CS3)CC""",21,"""93233C30C095383F"""
-"""EAF7098B3AE12240_8188DE1E890C57FD_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC(C(OC)=O)N""",21,"""93233C30C095383F"""
-"""5649B4B82B741C25_1F48E170FAFE4B96_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC3=NN=CO3""",21,"""93233C30C095383F"""
-"""C886BE68CAA976F0_865CDCAD75251F0B_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCOCC3CC3""",21,"""93233C30C095383F"""
-"""C51C1BE488D86A41_CD6BC2CA8058A219_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3N(C)CCCC3""",21,"""93233C30C095383F"""
-"""090A0888DF2E20DF_A1C6378AA3D9E0D3_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN(CCC)CC""",21,"""93233C30C095383F"""
-"""B957EDBA94D0E621_6AE1D52A8DB21E7C_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC[S](N)(=O)=O""",21,"""93233C30C095383F"""
-"""5E6E73B8DF2BF5DE_7A5CA341472256DE_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(CCC(O)=O)=O""",21,"""93233C30C095383F"""
-"""F4571BF67995E272_B3890042003C0D9E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOC(OCC)=O""",21,"""93233C30C095383F"""
-"""C4D2F00821A36823_5886441B2149B3D9_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCCCCO""",21,"""93233C30C095383F"""
-"""3A611974A4E664D8_B50BCC904F15A93B_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC(=C[N]3C)C""",21,"""93233C30C095383F"""
-"""525995F12FC7E0D6_0CE5D90DCA4DFC32_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC(=NS3)CC""",21,"""93233C30C095383F"""
-"""E2B0E4B75B4593EB_7F9400A5D8EEEBD5_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(CC(O)=O)(F)F""",21,"""93233C30C095383F"""
-"""15F19BC43B81825D_B8538A064E670DBD_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3OCCC3C""",21,"""93233C30C095383F"""
-"""E0D93CAB33D028A4_CD345D8174B6A8A6_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NCC(C)(C)O3""",21,"""93233C30C095383F"""
-"""96271CD5B8D55FF9_89ADDFE1E498C503_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)OC(=N3)C""",21,"""93233C30C095383F"""
-"""CBCBFCD0FE75BA4B_711ED72EB6113CDF_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCSCCCCC""",21,"""93233C30C095383F"""
-"""21636A8D6AB5EC32_51EEF26248894891_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3CCC(C)O3""",21,"""93233C30C095383F"""
-"""2121EE534E4C2C53_D103E7A2440571A5_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCN3C(C)CCC3""",21,"""93233C30C095383F"""
-"""2992315B3861F5AE_D0DB1463773B0E84_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NOC(C)(C)C3""",21,"""93233C30C095383F"""
-"""9E7592DC552591DA_477EEAB80A30C19E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(C(C)(F)F)(F)F""",21,"""93233C30C095383F"""
-"""015C7877D1607FC8_F278C24F7AD00071_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CCC(C)CO3""",21,"""93233C30C095383F"""
-"""FA959BD863BB7E55_7364564E666B1E6D_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOC(C)(C)C#N""",21,"""93233C30C095383F"""
-"""B29C49BCC7FEB098_6F0379B905AD68D9_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CN=C(CC)S3""",21,"""93233C30C095383F"""
-"""CE30702E6A0C8229_4D1CA41B01DCD61D_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC4=NC3(CC3)CO4""",21,"""93233C30C095383F"""
-"""D8B5880EEF67DEE2_6C6B828650128A64_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCC(OC)=N""",21,"""93233C30C095383F"""
-"""699C530252FD6364_E336DA981E775A37_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC[C@]34C[C@H]3CCC4""",21,"""93233C30C095383F"""
-"""03CFD3773A50C3F5_334F47B37DD66F57_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(C3(N)CCC3)=O""",21,"""93233C30C095383F"""
-"""5FA8478F5B06F233_229D1D03923A9653_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3CN3C4CCC4""",21,"""93233C30C095383F"""
-"""234A8A437BEFFC30_631D7EBC9A52A50E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(N(CC)CC)C""",21,"""93233C30C095383F"""
-"""41154565D8C5F58B_AB1EBE284916ECC0_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC([C@@H]3CCCN3)=O""",21,"""93233C30C095383F"""
-"""2BB24B81352AAF8B_486B7F22617A1861_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NOC(=C3)CC""",21,"""93233C30C095383F"""
-"""4BF6B89F300771C3_CAD928B8954D7150_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC([C@H]3CCCN3)=O""",21,"""93233C30C095383F"""
-"""09F74A166C2B61C6_2F5B5128E02CA740_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCCCC3CC3""",21,"""93233C30C095383F"""
-"""894EABE5BE2DB2E0_84EA1F28C1FF706B_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3CCCCO3""",21,"""93233C30C095383F"""
-"""B8DD7C7AE03C4AEA_BD36B314502628D3_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC3=CON=C3""",21,"""93233C30C095383F"""
-"""A499E79929B9CFAD_5F4A07756C5367CD_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=C[N](=C3)=O""",21,"""93233C30C095383F"""
-"""214A467C512C1DA4_84776EE72F9FBCC0_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC=C(C)C=C3""",21,"""93233C30C095383F"""
-"""5CAF381BB62B8883_0FF0514D9AA09FE1_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCN[S](C)(=O)=O""",21,"""93233C30C095383F"""
-"""ACC003237DA649C3_A3188A6C44A3A814_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(C(C)=NO)=NO""",21,"""93233C30C095383F"""
-"""4C74B558EE5BBBC9_6523149607237AD0_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NN(C)C(N3)=O""",21,"""93233C30C095383F"""
-"""1967B5A308B40BF7_8E9265A19750660A_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC3=CSC=C3""",21,"""93233C30C095383F"""
-"""5F9D39194496D8A1_CD17666E10D34A52_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CN=C(F)C=C3""",21,"""93233C30C095383F"""
-"""92FF21C6116CE32C_48098418BCA22FF6_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOCCC3CC3""",21,"""93233C30C095383F"""
-"""626B2C2175A82513_5F62B84045B97744_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC#CCOCOC""",21,"""93233C30C095383F"""
-"""43A4548BAEFCD3F0_BD6F8A2D2DAD0388_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(NC(C2=CC=C[N]2C)=O)=O""",21,"""ED5573F0D1B37AF9"""
-"""0C8F4B8DEBA06F4D_8D42FF5DB3EE071A_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(C2=CC(=C(OC)C=C2)F)=O""",21,"""ED5573F0D1B37AF9"""
-"""8449BA95AD77D3A2_0DB4034AE6E232CB_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(N2CCCC(C(N)=O)C2)=O""",21,"""ED5573F0D1B37AF9"""
-"""7D951862C2873B02_2EB5B3C766E614C5_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2CN=C(O2)C3=CC=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""6806D7EF41593252_2DB18F657A140FCD_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCCCCCCCCCCC""",21,"""ED5573F0D1B37AF9"""
-"""B09D60B5208699F2_AA3BB127504359E6_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(N2CCC(C(N)=O)CC2)=O""",21,"""ED5573F0D1B37AF9"""
-"""0C51FB8CC911FC22_430E172894FFB1B0_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCCC3=NC2=C(C=CC=C2)O3""",21,"""ED5573F0D1B37AF9"""
-"""F41D8BF82E129E3D_40327F2BDD03150B_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(C2=CC(=C(C)C=C2C)C)=O""",21,"""ED5573F0D1B37AF9"""
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-"""5B3655369387E482_48A0334FA8187502_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(=O)NC2=NN=C(O2)C3CC3""",21,"""ED5573F0D1B37AF9"""
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-"""385C408BE7A4DEF8_626C467E7E7D2AE9_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCC2=CC3=C(C=C2)C=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""27EE3A7BA7B6FAB5_47B41F6B682B0EE4_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2SC(=NC2)N3CCOCC3""",21,"""ED5573F0D1B37AF9"""
-"""878D53FE607BD0CB_531A4EE09E0D7B84_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(C2=C(C)OC(=C2)C(=O)O)=O""",21,"""ED5573F0D1B37AF9"""
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-"""3586017F6A0260C1_1972E7ED14E02C49_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(=O)N2CCN(CC2)CC#C""",21,"""ED5573F0D1B37AF9"""
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-"""B3DC967FBCE061F7_0178C071CAE5F254_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCC=CC2=CC=CC(=C2)OC""",21,"""ED5573F0D1B37AF9"""
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-"""EF8856C001602C3B_ECD91FD2E2940070_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC=C(C=C2)C3=CC=CS3""",21,"""ED5573F0D1B37AF9"""
-"""9DF647F446D79553_7DBDF6EB57812ABD_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC=C(C=C2)OCC3CC3""",21,"""ED5573F0D1B37AF9"""
-"""9057FEE527810C74_209BDD76CD122273_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NC=C[N]2C3=CC=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""B5E20F7E6E5C7861_10E189EAD90196B4_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NC(=CS2)C3=CC=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""7B396F61AE172942_7B76C082490EB7B1_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NC(=CS2)C3CCCCC3""",21,"""ED5573F0D1B37AF9"""
-"""1AE5B1266E8A631A_52429AE671E99348_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCCC3=NC2=C(C=CC=C2)[NH]3""",21,"""ED5573F0D1B37AF9"""
-"""B038F38BB11871B5_6A970C7938A2C840_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCCC2=N[N](C)C=C2C(=O)O""",21,"""ED5573F0D1B37AF9"""
-"""01942008E5F52A5C_8BFD0785458FCC3A_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NN=N[N]2C3CCOCC3""",21,"""ED5573F0D1B37AF9"""
-"""8F087D9F489A3230_064C943A0228FEAD_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(N(C)CC2=CC=CC=C2)=O""",21,"""ED5573F0D1B37AF9"""
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-"""197626178434AB04_2FC52A5AEA2757C3_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=C([N](=O)=O)C=C(C=C2)C#N""",21,"""ED5573F0D1B37AF9"""
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-"""4AECCC41888B3A9B_BDD024FBCA6CCE05_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NN=C(O2)C3CCCOC3""",21,"""ED5573F0D1B37AF9"""
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-"""592FCE4644A89E13_20E855AE2F246D29_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(CCNC(C(F)(F)F)=O)=O""",21,"""ED5573F0D1B37AF9"""
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-"""D458FEA2336736D7_FD174CFF79ECB2EB_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC=CC(=N2)C(OCC)=O""",21,"""ED5573F0D1B37AF9"""
-"""FC9690D36BA51359_303402AB5DF2E955_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=COC(=N2)C3=NC=CC=C3""",21,"""ED5573F0D1B37AF9"""
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-"""F53EF8A54E82C7D0_88804DFDD411CF87_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC3=NC2=C(COCC2)C(=O)N3""",21,"""ED5573F0D1B37AF9"""
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-"""C035B1B4D1F4A5D1_CEE6AB42A6B50D09_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NOC3=C2CC(C)(C)CC3""",21,"""ED5573F0D1B37AF9"""
-"""6CA79ACF6DAA7A60_58533D47C8559DFA_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CSC(=N2)C3=N[N](C)C=C3""",21,"""ED5573F0D1B37AF9"""
-"""2BFD6E8EC3EFE920_AE7CDE3B956048D0_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NN=C3[N]2C=CN(C)C3=O""",21,"""ED5573F0D1B37AF9"""
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-"""3694BF91ED2C6C37_0FE07703019281E5_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC3=NC2=C(CCCC2)C(=O)N3""",21,"""ED5573F0D1B37AF9"""
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-"""A6DBA177B88671FE_2C61BD989165D572_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NN=C([N]2C)C3=CC=CS3""",21,"""ED5573F0D1B37AF9"""
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-"""705BB300CCB1D453_E0CCCAF30EA09746_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC3=NC2=C(C=C(OC)C=C2)S3""",21,"""ED5573F0D1B37AF9"""
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-"""72200865AB8A74B9_22C2E73B9FC8AFEA_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC(=CC(=C2)C(F)(F)F)F""",21,"""ED5573F0D1B37AF9"""
-"""E76F82180B5E6F44_846A9EE28B0D4F4F_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=C(C=CC(=C2)F)C(F)(F)F""",21,"""ED5573F0D1B37AF9"""
-"""EC1A1126D4DDA749_C71C106C02D68FEE_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCC2=CC=C(NC(C)=O)C=C2""",21,"""ED5573F0D1B37AF9"""
-"""CC3708DB5787805C_5CA10AFCA9EA0BBA_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC(=C(F)C=C2)C(F)(F)F""",21,"""ED5573F0D1B37AF9"""
-"""9B33455808DE8F23_FB47DA0903CD063C_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCC2=CC(=C(OC)C=C2)OC""",21,"""ED5573F0D1B37AF9"""
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-"""E7810C769601C46B_85B3276E8937B251_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCC2=CC=CC(=C2)NC(C)=O""",21,"""ED5573F0D1B37AF9"""
-"""ED446F2238D8C64B_7803C6B51A5D64CE_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=C(C)C=C(C=C2)C(F)(F)F""",21,"""ED5573F0D1B37AF9"""
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-"""1D42FC03FE8F040A_11CA2F054CB4BF61_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(C2=CSC=C2C(OC)=O)=O""",21,"""ED5573F0D1B37AF9"""
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-"""E249DC81E20F73DB_A93D746AB0F6AAC4_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=C(C(=N[N]2C)C)[S](=O)(=O)Cl""",21,"""ED5573F0D1B37AF9"""
-"""E6D92966D5811ADB_76130EC2365F23D9_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(C2=C(C)OC(=C2)C(=O)N)=O""",21,"""ED5573F0D1B37AF9"""
-"""4AFDA961C0ADF4FF_06AD9ABB08B5BF37_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NN=C(O2)N3CCCCC3""",21,"""ED5573F0D1B37AF9"""
-"""3F1BCD82124FD26D_3C80F083FBEA0EF3_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2COC(O2)C3=CC=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""DF8280A999F4A85A_EDC9028AEEEB5382_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NN=C(O2)N3CCOCC3""",21,"""ED5573F0D1B37AF9"""
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-"""EC0B396631622EDC_8AD009659440B305_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=N[N](CCC(F)(F)F)C=C2""",21,"""ED5573F0D1B37AF9"""
-"""DCAADD1F1F900ED4_713E4A0D6ACB40E4_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC#CC2=CC(=CC(=C2)F)C#N""",21,"""ED5573F0D1B37AF9"""
-"""3FA31531BCF16D0C_4D9202635C03381F_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC(=N[NH]2)C3=CC=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""B3FCC2A2C52809E2_03277C44B78BAEF0_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC=CC(=C2)SCCCC""",21,"""ED5573F0D1B37AF9"""
-"""0EB157631B2EF923_2D38D5B84CC238E7_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC3=CC2=C(N(C)C(=O)S2)C=C3""",21,"""ED5573F0D1B37AF9"""
-"""D839D60978CCE859_763F8A545D18DBA9_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC=CC(=C2)CCCOC""",21,"""ED5573F0D1B37AF9"""
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-"""801B4FA506320A7E_0CEF3EB0CE904ABC_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCC(C(F)F)C2=CC=CC=C2""",21,"""ED5573F0D1B37AF9"""
-"""C220ABFC930D24E7_9C07C641DD07DB3F_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC=C(CNC(C)=O)C=C2""",21,"""ED5573F0D1B37AF9"""
-"""01700AD255316FC1_5A976E9399A57E3D_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NC=C(O2)C3CCOCC3""",21,"""ED5573F0D1B37AF9"""
-"""955669209FE5768E_517553685CC71CCA_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCCCO[S](C(F)(F)F)(=O)=O""",21,"""ED5573F0D1B37AF9"""
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-"""6D139CD077DBFDC6_638595C9A4013566_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=N[N](C=C2C(OCC)=O)C""",21,"""ED5573F0D1B37AF9"""
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-"""3A44A50E7536E35C_91D8F18CF8444B83_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC3=CC2=C(N(C)C(=O)O2)C=C3""",21,"""ED5573F0D1B37AF9"""
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-"""272EC4528A1CEDDE_35105B060012DD6F_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC(=NC(=N2)C3CCC3)C""",21,"""ED5573F0D1B37AF9"""
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-"""99FA5AA26B048F37_A1770242894833AB_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(=O)C2CCCC3=C2C=CS3""",21,"""ED5573F0D1B37AF9"""
-"""3A6C31FAA4541CFB_2C976CB739613BE3_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=NC=C(O2)C3CCCCC3""",21,"""ED5573F0D1B37AF9"""
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-"""C4B859E4E6122B5B_9F92CDE009C6B79A_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=C(F)C=CC3=C2N=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""749DC3FE6DBFA7D1_D0C615F239C14FB5_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CSC(=N2)COC3CCC3""",21,"""ED5573F0D1B37AF9"""
-"""A07247F795029B36_8E7555BE78E97A09_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC3=NC2=C(C(=CC(=C2)F)F)[NH]3""",21,"""ED5573F0D1B37AF9"""
-"""137463183B720EBA_EA8A71032FB02715_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(=O)C2=CN=C3C=CC=C[N]23""",21,"""ED5573F0D1B37AF9"""
-"""ECD8D84384D03EC2_89E17FB6131FD287_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(F)(F)C(=O)C2=CC=CC=C2""",21,"""ED5573F0D1B37AF9"""
-"""F5EBF3DD5EA628AF_ECB37209D969EA2D_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(CC2=C(OC)C=CC=C2)=O""",21,"""ED5573F0D1B37AF9"""
-"""51F0290D4C0E7F52_DE4BA8DF416571D1_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CN=C(C=C2)[N]3C=CC=N3""",21,"""ED5573F0D1B37AF9"""
-"""3DB15BDA8049326B_29A891E83D9B43FE_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(NC2(C)CC[S](=O)(=O)C2)=O""",21,"""ED5573F0D1B37AF9"""
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-"""6D902179761481DC_C9163E0779AA87AC_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=N[S](=O)(=O)C3=C2C=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""7FF96510A0325980_713CFAD371EF383A_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(=O)NC2CCCCNC2=O""",21,"""ED5573F0D1B37AF9"""
-"""251BC02DD7573AB6_4D7550DD4B383466_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(NC2=CC(=C(C)C=C2)F)=O""",21,"""ED5573F0D1B37AF9"""
-"""19D4DB415501519E_409D1BFBE76E7F90_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(NC2=NC=C([N](=O)=O)S2)=O""",21,"""ED5573F0D1B37AF9"""
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-"""E83E201C3688EF0A_9DAB708FD966A1F4_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC[N]2N=C(C)C(=C2C)C(=O)O""",21,"""ED5573F0D1B37AF9"""
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-"""1E7150CB1B6EE39E_5073FDB3530759AF_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCN2C(=O)OC3=C2C=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""6E0C206FDFA6E58F_60A8869AE455D93A_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCCCC[N]2N=C(C)N=C2C""",21,"""ED5573F0D1B37AF9"""
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-"""8FD19EE9FC9B7CBF_E4637F273987F61C_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CN=C([NH]2)C3=CC=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""792920093359E819_B265FF24A0519E62_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CSC(=N2)C3=C[N](C)N=C3""",21,"""ED5573F0D1B37AF9"""
-"""E377FAB46980CD48_B7881F05DD99E98A_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CSC(=N2)C3=NC=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""78AF13D4D6F1F865_F79C42ED6A436AE3_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=N[N](C(=C2[S](=O)(=O)Cl)C)C""",21,"""ED5573F0D1B37AF9"""
-"""A5B208311308AF08_860D7B10C352A677_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC=C(C=C2)C3=CSC=C3""",21,"""ED5573F0D1B37AF9"""
-"""2BC72B7ECF05A974_071EF2DC2EDF1D09_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(=O)C2=CC3=C(N=C2)OCO3""",21,"""ED5573F0D1B37AF9"""
-"""BDAEE4D498F43DEF_B292AF3DC624386F_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=CC=CC(=C2)SC(F)(F)F""",21,"""ED5573F0D1B37AF9"""
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-"""FB50AE6223184D64_DC871A38FC6D06B6_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC2=C(C(C)(C)C#N)C=CC=C2""",21,"""ED5573F0D1B37AF9"""
-"""914B19E7EB82425E_E3A2A5590FE54F62_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(N(C)C2=CC=C(C=C2)C)=O""",21,"""ED5573F0D1B37AF9"""
-"""F9916D25B7E7AC22_53F51B7DD51BFDE1_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(=O)[C@@H]2C[C@H]2C3=CC=CC=C3""",21,"""ED5573F0D1B37AF9"""
-"""47E5E01FEFB4D689_EA95187395A57029_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCCCCCCCCN=[N]#N""",21,"""ED5573F0D1B37AF9"""
-"""1B8FE1A09E9AFE97_319EB604B4729CA8_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC(NCC(OC)=O)=O)C""",21,"""A2F18F398BC697E7"""
-"""887F7A4875E234A4_6420364F777E03DE_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC(=O)N2CCNC2=O)C""",21,"""A2F18F398BC697E7"""
-"""B24DA1319CB894F1_1978DA48F1D3077F_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC2=CC=C(SC)C=C2)C""",21,"""A2F18F398BC697E7"""
-"""9D76CB57AB798CC2_5D323E04658E6BF3_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC(NC(NCC)=O)=O)C""",21,"""A2F18F398BC697E7"""
-"""5A44CC726A2089ED_5DDCB29FE019A7C1_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC(NC(C(C)C)=O)=O)C""",21,"""A2F18F398BC697E7"""
-"""0CAFB7925F804AB2_C92D2601E5269784_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC=NNC(C(C)C)=O)C""",21,"""A2F18F398BC697E7"""
-"""24447C41F286B9A6_2C8F30120607673C_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC2=CC(=CC=C2)C#N)C""",21,"""A2F18F398BC697E7"""
-"""BEB213B1DDEF3278_434AFDDDFE1D8770_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC(NC(C)C2CC2)=O)C""",21,"""A2F18F398BC697E7"""
-"""5CE8BD1C2D5B8736_329E9FFE0D1127AB_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC(=O)N2CCOC2=O)C""",21,"""A2F18F398BC697E7"""
-"""450FA7311251655F_F37C84245820F5D3_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC2=CC(=CC(=C2)C)C)C""",21,"""A2F18F398BC697E7"""
-"""A1146369E4196539_24803AD3BE5E5A39_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC(=O)NC2=NN=CS2)C""",21,"""A2F18F398BC697E7"""
-"""C58DFA52364B8DCC_6BA90B2E64EB2935_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC2=C(C=CC=C2)C#N)C""",21,"""A2F18F398BC697E7"""
-"""7DD9A633E4DEBE42_732AC2B5C7C2C715_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC2=CSC(=N2)CCC)C""",21,"""A2F18F398BC697E7"""
-"""406A626D266EFE5F_7296734F93A9D8F6_6039_UN""","""COC(=O)C1=C(C=CC(=C1)OCC2=NC(=NO2)C3CC3)C""",21,"""A2F18F398BC697E7"""
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-"""2CB60D31FA5AA79E_C3271E8229F32CE1_6039_UN""","""CC3(COCC1=NC2=C([N]1CC)C=CC(=C2)F)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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-"""185D1EA0D721128B_14AA10AB1B52B273_6039_UN""","""CC2(COCCOC1=CC=C(C(F)(F)F)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
-"""DDFBA09ECAA97F53_FB35C3AF38BE5BD5_6039_UN""","""CC2(COCC(C1=CC=C(C(F)(F)F)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
-"""2212E7EA745A68A1_9D61909AC17B4A07_6039_UN""","""CC2(COCC1=NC(=CC(=N1)C(OCC)=O)C)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
-"""F2FB79E742FF3040_100EDF151689C243_6039_UN""","""CC3(COCC1=CC(=NO1)C2=CC=C(C)C=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
-"""8B49555662183105_325D923BA7AD63DD_6039_UN""","""CC3(COCC1=CSC(=N1)CC2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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-"""D916BCC8EB3363D5_8184C5FD2E9D0E0A_6039_UN""","""CC3=NC1=C(CCCC1OCCN(C)C2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""7341ADD69EF3E0E2_00C7801BF32A841D_6039_UN""","""CC3=NC1=C(CCCC1OCCCCC[N]2C=CN=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""B368BEB563F7707D_BF620228B5DB0A74_6039_UN""","""CC2=NC1=C(CCCC1OCCCOC(NC(N)=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
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-"""580D84653F491AE1_AB02A420EECC9509_6039_UN""","""CC4=NC1=C(CCCC1OCC3=CC2=C(C=CC=C2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
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-"""021916C48B9A4FE3_AD00440EC1A5D363_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC=C(OCC)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""3812D902470AE156_270368CDC53A79BC_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(F)(F)F)[NH]N=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""134F1FE8A4CF0D89_FE1ECE2EFECFA408_6039_UN""","""CC3=NC1=C(CCCC1OCCCCC2(C)OCCO2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""C3999833FC731EA9_6CB6EA85A8E79343_6039_UN""","""CC4=NC1=C(CCCC1OCC3CCC2(CC2)C(=O)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
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-"""3D4E2F5CC8ECAA55_B40713296D16B298_6039_UN""","""CC4=NC1=C(CCCC1OCC3CC2=C(C=CC=C2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""D3E09E8FC182FE59_4E3D4D2B7C6BC448_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NN=C3[N]2CCCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""3DD435F4E9D9EA40_C91AD6CD88DCFE7E_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)C2CCCCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""0CC705BF1934ACEF_4BD22B8D4F609310_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NOC(=C2)C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""1D7F72ECA5699D81_BDC5D364BBE8E025_6039_UN""","""CC3=NC1=C(CCCC1OCC(N2CCC(C)CC2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""7B90B965CF4349F6_0B5F6D86E2681DBD_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(N=C(OC)N=C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""301FA6BEC4946A48_D1B4D9ACF13D8788_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC=N[N]2C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""B86C2AF4DC80B7A7_EFF852F384024880_6039_UN""","""CC3=NC1=C(CCCC1OCC2N(C(C)C)CCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""CB44092A92BB5799_9E74831837982E0D_6039_UN""","""CC3=NC1=C(CCCC1OCCCCC2CCOCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""86CFF3EED5C0B3C4_0864DAACB489C259_6039_UN""","""CC3=NC1=C(CCCC1OCCCC2=CC(=NO2)CC)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""2A565B94F1C13A53_1CE90ABFF758AA7C_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=CN=CC(=C2)F)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""3F85A0138367E279_6864AAEC6E4A0153_6039_UN""","""CC2=NC1=C(CCCC1OCC(C(C(OC)=O)(C)C)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
-"""7484F9893BF9C3E1_87F33674533C41DD_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(OC)=O)C=NO2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""985224B60E2E4AC9_AC6D460C2E59463B_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NN=C3[N]2CCOC3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""21E1B2423B25C0B8_AC587E93A660F6B7_6039_UN""","""CC3=NC1=C(CCCC1OCC(OC)C2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""A43746D3D558A6B4_287E43E009723E64_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=NC=CC(=C2)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""4A4958D86B416F98_8E9EBE38556AB127_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(COC)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""4F453E06A0AE1C9B_79A6E80BAF1E0868_6039_UN""","""CC3=NC1=C(CCCC1OCC2=N[NH]C(=N2)C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""66649DFC38CAE93F_35A42B29C88C9F43_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NOC(=N2)CCOC)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""456C7421FF2CD923_C210C71EED27B636_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=CO2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""EFB61707714B7535_790D508BDAC7546D_6039_UN""","""CC3=NC1=C(CCCC1OCCC2CC(C)(C)NC2=O)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""AEF2F40E6D6F33E8_1191A7FBB35EFA3D_6039_UN""","""CC3=NC1=C(CCCC1OCC(N(C)C2CCCC2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""A58887CE97DE8771_0F380917284D0120_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C=CC(=C2)OC)F)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""161CD0683C064350_AC29217B0F86D0C7_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C[N](CC)N=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""C1BCF2053DECBCBB_260C7C912BD10167_6039_UN""","""CC2=NC1=C(CCCC1OCCOC[P](OC)(=O)OC)O2""",21,"""D9F5D29FE0E2FE4F"""
-"""1705CA2D243D7391_2FDAEFF8AC75C9EA_6039_DP""","""CC4=NC1=C(CCCC1OCC3CC2(CCN2)C(O3)=O)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""3BF9C68899850080_A0CBC7EDDB26BD5A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(F)(F)F)OC=N2)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""AA5B08EC8C47C46C_33AB57C388682C67_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)C2=CNC(C=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""52C49C4946C2263A_9CC1BE8C63C2D5B8_6039_UN""","""CC3=NC1=C(CCCC1OCCC2=C(C=C(C)C=C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""6F9C51B38184EBB9_FCAD69E6823F5594_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=NO2)C(C)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""4E21626B3CC4D1A8_905B831F8BAA5919_6039_UN""","""CC4=NC1=C(CCCC1OCC3CC2CCCCC2O3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""51728F45D327E871_EDCC202A28F1837D_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CON=C2C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""0A02ED651AAF63C4_E4A4615F7782A440_6039_DP""","""CC4=NC1=C(CCCC1OCC3=C(C2CNC2)OC=N3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""A447B25C8000B107_42868A696586EECF_6039_UN""","""CC3=NC1=C(CCCC1OCCCN2CCOCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""CD2E735518BAF111_2D33DE014DB097E6_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CON=C2C3CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
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-"""DFB92E0FF43189AC_0BFE2A308090D8D0_6039_UN""","""CC3=NC1=C(CCCC1OCCCN[S](=O)(=O)C2CC2)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""C699BDD792542101_5541BBCF97CF88DE_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C(C)C=CC=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""CF9F5590CF0C1DBB_AB0484878DD22D81_6039_UN""","""CC3=NC1=C(CCCC1OCCC2(C(F)(F)F)CCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""DFDDCEBF696FD385_07227EF406C4FBA3_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C([S](C)(=O)=O)C=CS2)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""D44B44F647F09982_DBA5CF505197631F_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CSC(=C2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""534CB0F8915DB820_3F3196B3F904AA81_6039_UN""","""CC3=NC1=C(CCCC1OCC2=N[NH]C(=C2)C(OC)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""C1BA25603E75CE76_0E38BB8A04D8C4ED_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(OC)=O)SN=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""712FDD93E7C4DE34_087201469370A2EF_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(F)F)C=NC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
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-"""48639923788AF360_83050F4DFB7339C1_6039_UN""","""CC2=NC1=C(CCCC1OCCC(C(OCC)=O)(F)F)O2""",21,"""D9F5D29FE0E2FE4F"""
-"""C17AD35BC976516B_EFD1371A56FE26DD_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(SN=C2OC)OC)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""1E2B4B4044ADB5BF_E0B3684A075619C9_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NOC(=C2)CC3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""502850C3CD11E54C_A17487D1079A2B0A_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC3=C(C=C2)OCO3)O4""",21,"""D9F5D29FE0E2FE4F"""
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-"""5A34F7C28C87C7F2_B3FC6850298AD35F_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NO[C@@H]3CCCC[C@H]23)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""9816DE68D5D6AA55_3EF5EB2D65829B45_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=NC(=N2)COC)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""326DC2641641F8A3_AAE0F76ED48C69AA_6039_DP""","""CC4=NC1=C(CCCC1OCCC3CC2CCC(N2)C3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""02067CC698D22039_0AFEE14A4F140D1B_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2)C(N)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""2E8A0708E4798D4E_CF9646DDBFAF3560_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(C(OC)=O)S2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""F55DF43807B12F2E_D74691CB29810A70_6039_UN""","""CC2=NC1=C(CCCC1OCC(NCCCC(O)=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
-"""4E3D2A581DFAB629_BF0645B667FB4016_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NCC2=CC=CS2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""4D54614C220DFF63_F54A9D01B8F9C7DE_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC=CC3=NON=C23)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""DB2F9ECD02FB6B1E_E5A29C5FD93C75FE_6039_UN""","""CC4=NC1=C(CCCC1OCC3=C[N]2C=CC=NC2=N3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""298ADD731DF6D51A_7A30E29F159A117B_6039_UN""","""CC3=NC1=C(CCCC1OCCOC2CCCCC2C)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""DC158EB6A7B506ED_A88E426AE7FEBFD1_6039_DP""","""CC4=NC1=C(CCCC1OCC3=CC2=C(C=C[NH]2)C=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""69B561874E5E9F48_2FF46C8C8505F106_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(=NO2)C)[N](=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""F08A4898789EA163_C9FC0716B0A9705D_6039_UN""","""CC3=NC1=C(CCCC1OCCOC2=CC=C(C)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""693AB4636EC9DE55_C27EB6B979526D46_6039_UN""","""CC2=NC1=C(CCCC1OCCOCC(C(F)F)(F)F)O2""",21,"""D9F5D29FE0E2FE4F"""
-"""87058DB4CD2B1687_249AC1A2061E862E_6039_UN""","""CC2=NC1=C(CCCC1OCC(NC(NCCC)=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
-"""FED485A84627B904_8289A7E8CCEE1AF8_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NN=C([N]2C)C3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""04F1163BCD763A35_D5E3EA28398F2E77_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NN=C(S2)C3CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
-"""AF0FE59EB58D0D6F_1ED643587C042455_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2)C(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""C42C441F9072512A_A79C09A292810600_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=C(C=C2)C)OC)O3""",21,"""D9F5D29FE0E2FE4F"""
-"""214959B301232C34_BFAB39C27AB8F25F_6039_UN""","""CC4=NC1=C(CCCC1OCC2=C(C=CC=C2)C3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
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-"""371FB9B67F0A6101_537D3D352193A2A3_6039_UN""","""O(C1CCC=C(C1)C#N)CC(N(C)CC2=CC=CC=C2)=O""",21,"""B864DAFFF20826F7"""
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-"""3BFAF1ED51040386_5F26BAAA3C88B3B9_6039_UN""","""O(C1CCC=C(C1)C#N)CCCB2OC(C)(C)C(O2)(C)C""",21,"""B864DAFFF20826F7"""
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-"""9CC7E7539D24F883_8D0A0C6186F45AEF_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(C(CC)(C)C)C=C2""",21,"""B864DAFFF20826F7"""
-"""C44D40057E761965_6C1EF3E455387CEB_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=CC2=C(OC(F)(F)O2)C=C3""",21,"""B864DAFFF20826F7"""
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-"""FECE981965F973AF_7711F7B7F4C79703_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=CC(=C2)OCC(C)C""",21,"""B864DAFFF20826F7"""
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-"""86605C4F72A70AED_E4448C543C291C59_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=CC(=C(C=C2F)F)C)=O""",21,"""B864DAFFF20826F7"""
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-"""2756CE96900FB752_52FF7C1EDE72D448_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=NC2=C(C=CC=C2)NC3=O""",21,"""B864DAFFF20826F7"""
-"""2E29A4A7C7F4B4EE_D855B780AC748400_6039_UN""","""O(C1CCC=C(C1)C#N)CCOC2=C([N](=O)=O)C=CC=C2""",21,"""B864DAFFF20826F7"""
-"""39EB841A7E0FAB43_85EC8C5128AE922F_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NOC(=N2)C3CCOCC3""",21,"""B864DAFFF20826F7"""
-"""DA856970D9E9AD6F_A7B7E3B38E713909_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NC(=CS2)C3=CN=CC=C3""",21,"""B864DAFFF20826F7"""
-"""1BCA054FA2C29553_80C729B21A0B7E4E_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)CC2=CC=C(C=C2)C#N""",21,"""B864DAFFF20826F7"""
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-"""D654F3DEF5F953DA_82D1A986576C064B_6039_DP""","""O(C1CCC=C(C1)C#N)CC(N[C@H](CC(C)C)C(=O)O)=O""",21,"""B864DAFFF20826F7"""
-"""D52BCF48447660C3_16566D323DAE1C6D_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=CC2=C(C=CC(=C2)C)N=C3""",21,"""B864DAFFF20826F7"""
-"""9C347715D0B93A02_1A2831F3E12CB5A9_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NC2=C(F)C=CC=C2F)=O""",21,"""B864DAFFF20826F7"""
-"""8FE234C624EBEDB9_77DEA5F4EB99A089_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=CC(=C2)OC(F)(F)F""",21,"""B864DAFFF20826F7"""
-"""BF260A41D25FCE6F_C4E339471A56D7D1_6039_UN""","""O(C1CCC=C(C1)C#N)CCC=CC2=CN=CC(=C2)OC""",21,"""B864DAFFF20826F7"""
-"""C2BB5531A653646C_60B534A01B579D06_6039_UN""","""O(C1CCC=C(C1)C#N)CCOC(CC)C2=CC=CC=C2""",21,"""B864DAFFF20826F7"""
-"""E70D1167D422666C_398B15F15A66E7CA_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C([S](N(C)C)(=O)=O)S2""",21,"""B864DAFFF20826F7"""
-"""6432A783CCC017E3_7AF48355C99C0BCD_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C([N](=O)=O)C=C(C=C2)C#N""",21,"""B864DAFFF20826F7"""
-"""C1972293B208457D_39B261FEAF74FECB_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(OC)C=CC(=C2)C(C)C""",21,"""B864DAFFF20826F7"""
-"""13B1D571AFB04627_2150B9DBA1F4F137_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CN=C([N]2C)SC(F)(F)F""",21,"""B864DAFFF20826F7"""
-"""6AF57897C673BEB8_08A5883E39F1D779_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(OC(F)F)C=CC(=C2)F""",21,"""B864DAFFF20826F7"""
-"""F1F6EB8F14F8D861_5F9FAB942B03CF30_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(C[S](C)(=O)=O)C=C2""",21,"""B864DAFFF20826F7"""
-"""8ABD959D55B8A940_44AE4FF55CA13484_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(OC(F)F)C(=CC=C2)F""",21,"""B864DAFFF20826F7"""
-"""E62A5945208F1D22_5115C279176A7821_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=CC3=C2OC(F)(F)O3""",21,"""B864DAFFF20826F7"""
-"""3ADC824271995687_31678EEB40E88938_6039_UN""","""O(C1CCC=C(C1)C#N)CCOCCN2C(=O)CSC2=O""",21,"""B864DAFFF20826F7"""
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-"""F97FC7DA9801E04D_815B1F240CB4E5C5_6039_UN""","""O(C1CCC=C(C1)C#N)CC(COC2=CC=C(F)C=C2)=O""",21,"""B864DAFFF20826F7"""
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-"""24693244DB83D089_E0BC171D5ECDB66A_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NC(=NO2)C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
-"""098E4CEECD35E5DF_784BF16B766E6A80_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C([S](NC)(=O)=O)C=C2""",21,"""B864DAFFF20826F7"""
-"""AF49B52D0996234D_E8E18DF4E9D7920B_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NN=C(O2)C3CCCOC3""",21,"""B864DAFFF20826F7"""
-"""6134F8806CEF2E22_FD891D290A4E6002_6039_UN""","""O(C1CCC=C(C1)C#N)CC(N[C@H](C)C2=CC=CC=C2)=O""",21,"""B864DAFFF20826F7"""
-"""05A067DB0717E0D7_67D15DF7BF08E7F3_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CN=C(O2)C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
-"""CAD5AB7420B8AF51_75D9FCA10C9F3127_6039_UN""","""O(C1CCC=C(C1)C#N)CC(CCNC(C(F)(F)F)=O)=O""",21,"""B864DAFFF20826F7"""
-"""6A080E25018261C5_60D1D4BD05111A16_6039_UN""","""O(C1CCC=C(C1)C#N)CC(N(CCC)CC(F)(F)F)=O""",21,"""B864DAFFF20826F7"""
-"""F53A511474592F4E_FAFA7F3C705380D2_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=CC=C(C(OC)=O)S2)=O""",21,"""B864DAFFF20826F7"""
-"""862C7CC470F51F53_31E5FAC23E29FCF7_6039_UN""","""O(C1CCC=C(C1)C#N)CCN(C)CC2=CC=C(C=C2)F""",21,"""B864DAFFF20826F7"""
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-"""756C1C1990EBB352_7E5CC37C438375D3_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NCC2=C(C)C=CC=C2)=O""",21,"""B864DAFFF20826F7"""
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-"""07718B1CD4BF0521_86606634396FD120_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=NC2=C(CC(C)(CC2)C)S3""",21,"""B864DAFFF20826F7"""
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-"""15AB58AAE115CDE5_014388392FB4A679_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C2=CN=C3[N]2C=CC=C3""",21,"""B864DAFFF20826F7"""
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-"""6E08F282A4657683_53F7CB513071C189_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=CSC(=C2)C(OC)=O)=O""",21,"""B864DAFFF20826F7"""
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-"""0D7ADCC80C4223AD_20EAEED376CBC483_6039_UN""","""O(C1CCC=C(C1)C#N)CCC(C)OCC2=CC=CC=C2""",21,"""B864DAFFF20826F7"""
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-"""559A5FD7AD0F7474_83F3A2FB9EE25964_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(OC(F)(F)F)C=CC=C2""",21,"""B864DAFFF20826F7"""
-"""0295DF9F54D0F279_300E71A03E0E4618_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=CC(=C(C=C2)C#N)F)=O""",21,"""B864DAFFF20826F7"""
-"""6E72E38AC13CA2E3_44D059BEFFD868A3_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=CC(=C2F)C(F)(F)F""",21,"""B864DAFFF20826F7"""
-"""D103329482CA1DFF_77F34E34BC73F3E4_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=CC(=C2)C(F)(F)F)F""",21,"""B864DAFFF20826F7"""
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-"""054E9A4EC55C61B8_B8B5672E4C361494_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=N[N](N=C2)C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
-"""866ECC67C6DEF55E_C89AD980FADDFDFA_6039_UN""","""O(C1CCC=C(C1)C#N)CC[N]2N=C(C)C(=C2C)C(=O)O""",21,"""B864DAFFF20826F7"""
-"""AA7378D1C8906461_C020088C11CC1003_6039_UN""","""O(C1CCC=C(C1)C#N)CC2CC(=NO2)C3CCCCC3""",21,"""B864DAFFF20826F7"""
-"""905D01590DC39896_054254BC70BC05A1_6039_UN""","""O(C1CCC=C(C1)C#N)CCN2C(=O)OC3=C2C=CC=C3""",21,"""B864DAFFF20826F7"""
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-"""26C921E880024D70_B152D6281A3CAA12_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CN=C([NH]2)C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
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-"""95EE1107E40BE7EE_E2B9B60AFE22B584_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CSC(=N2)C3=NC=CC=C3""",21,"""B864DAFFF20826F7"""
-"""48F99B435959AC39_A2ADEBE249F836ED_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=N[N](C(=C2[S](=O)(=O)Cl)C)C""",21,"""B864DAFFF20826F7"""
-"""A9DC795C1852E439_D33CD21FE0E9FA79_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(C=C2)C3=CSC=C3""",21,"""B864DAFFF20826F7"""
-"""281AFF0B2329A3ED_522F5BD30D644107_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C2=CC3=C(N=C2)OCO3""",21,"""B864DAFFF20826F7"""
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-"""1CFB97673A82B25E_06C4B272F6A0A1EF_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)[C@@H]2C[C@H]2C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
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-"""D45DE05AE30957CA_55474A610BBF2DA5_6039_DP""","""CCOC(=O)CC(OCC1=CC=C(C(N)=O)C=C1)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""2931D42D2B7A31E5_DFBFC915C32C7D8E_6039_DP""","""CCOC(=O)CC(OCC(N1C(C=C(C)O1)=O)=O)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""5E01BBA2B272FD1D_360F4E67D066C5A8_6039_DP""","""CCOC(=O)CC(OCC(NC1=CC(=NO1)C)=O)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""B732D669280BFAE2_F13532F50C7B8B63_6039_DP""","""CCOC(=O)CC(OCC(NC1=NN=C(C)S1)=O)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""62DC98C5BA818228_A4D305ECD5FDB640_6039_DP""","""CCOC(=O)CC(OCC1=C(OCC)C=CC=C1)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""BA73EA444D29617B_532FD64E0F27456E_6039_DP""","""CCOC(=O)CC(OCCCCCCCCCC)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""9EBD641629F04F5B_EB441F58CB33BD5D_6039_DP""","""CCOC(=O)CC(OCC(C1=CC=C(F)C=C1)=O)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""3645A132B64E7EB4_71411B3359DA5DDD_6039_DP""","""CCOC(=O)CC(OCC1=C(OC)C=CC(=C1)C)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""165F3CA8D00BD3B3_26E367A0C5140AEF_6039_DP""","""CCOC(=O)CC(OCC(=O)NC(=O)NCC=C)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""3605C911D708E9A6_1EC085231A64D8B6_6039_DP""","""CCOC(=O)CC(OCC(C1=CC=C(C)C=C1)=O)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""C9A9ED48A61F22CD_AA043C5D70E73BE0_6039_DP""","""CCOC(=O)CC(OCC(NC1=NOC(=C1)C)=O)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""B26E23BC8B0BE77B_CD28088EE4B92A40_6039_DP""","""CCOC(=O)CC(OCC2=CC1=C(C=CC=C1)S2)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""F652D49AF862C89F_F88BFF52950E35B5_6039_DP""","""CCOC(=O)CC(OCC1=NOC(=N1)C(F)(F)F)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""89BEB96FC3F86F2C_78993BF4D82696C8_6039_DP""","""CCOC(=O)CC(OCCCC1=CC=CC(=C1)F)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""D4D9B63876933825_D598357A3BECB945_6039_DP""","""CCOC(=O)CC(OCCC(=O)C1=CC=CC=C1)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""742C1E54BA9AE0DE_6E4F515CFBD01076_6039_DP""","""CCOC(=O)CC(OCC1=CSC2=NCCCN12)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""C3B9AF8B80FA25BC_863040E2540A79EB_6039_DP""","""CCOC(=O)CC(OCC1=C(N(C)C)C=CC=C1)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""2FD726E471988317_C3FB3F3F0B01B85F_6039_DP""","""CCOC(=O)CC(OCC1=CC=N[N]1C2CCC2)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""DF5092B3EA628A37_256309411B9DAA2A_6039_DP""","""CCOC(=O)CC(OCC(=O)C1=CC=CNC1=O)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""CCFCD30118A277D5_A07F360C3D78AD98_6039_DP""","""CCOC(=O)CC(OCC(C1=C(N=C(C)S1)C)=O)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""BC4E87983EFF6072_2BF2A48EBCDBBD6B_6039_DP""","""CCOC(=O)CC(OCCCCC1(CCC1)C#N)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""D73BD87844CA2FF8_91C0123B62CA014C_6039_DP""","""CCOC(=O)CC(OCC1=C(ON=C1C)C2CC2)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""368A88C04819A1DE_9F0722AA97350482_6039_DP""","""CCOC(=O)CC(OCC1OC(CC12CNC2)=O)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""ED89006B05AF37EF_8FDD2B7686F23C1D_6039_DP""","""CCOC(=O)CC(OCC1OC(=O)CC12CCC2)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""34482AF42E82F232_40B0277875B84512_6039_DP""","""CCOC(=O)CC(OCCC1(C(O)=O)CCOC1)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""73DAF0F550C84896_025E23D0A5C643A5_6039_DP""","""CCOC(=O)CC(OCC(CC(OCC)=O)(F)F)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""169FC1FD130A20E4_A23A88D5D64C0EDD_6039_DP""","""CCOC(=O)CC(OCC1=C(CCC)C=CC=C1)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""EEFAA5BA7BACCA84_6CE64F70D42A5D3A_6039_DP""","""CCOC(=O)CC(OCCN1CCC(F)(CC1)F)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""A3F7D33331B08F23_5BEFB53423DC3801_6039_DP""","""CCOC(=O)CC(OCC(=O)NC1=NN=CC=C1)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""932CD9D92C893279_35D623CA353DE8CC_6039_DP""","""CCOC(=O)CC(OCC1=N[NH]C2=C1COCC2)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""371D05651248EC18_A2077F07F6E67D5F_6039_DP""","""CCOC(=O)CC(OCCC1=C(C=C(C)C=C1)C)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""B6F3BDA5A8AFDD21_95C2450C18F68566_6039_DP""","""CCOC(=O)CC(OCCC1(C(F)(F)F)CCC1)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""B20840F7C146F76E_2A8E841A607847CC_6039_DP""","""CCOC(=O)CC(OCC1=CSC=C1C(F)(F)F)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""29C9369121499F36_2C74C3783C65B43B_6039_DP""","""CCOC(=O)CC(OCCN1C(C)(COCC1)C)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""7ADA7DB59D2D97CD_8959F0A17F92534C_6039_DP""","""CCOC(=O)CC(OCC1=C(OC)C=CC(=N1)C)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""E8C3149223FF9CF6_60EFCADB9B5099A5_6039_DP""","""CCOC(=O)CC(OCCN1CC[S](=O)(=O)CC1)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""2B1C74173CD2BB70_7875992045F5EC8C_6039_DP""","""CCOC(=O)CC(OCC1=NSC(=C1)C(F)(F)F)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""57E0312BD75CD5E2_D6CE6E145DF6BFA9_6039_DP""","""CCOC(=O)CC(OCC1=C(N=C(OC)C=C1)C)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""DB17CDECA7C60790_E5630EDBC4B3CBF8_6039_DP""","""CCOC(=O)CC(OCC1=CSC(=C1)C(F)(F)F)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""47D5847280843FB1_62F1FB7B5BAC71B7_6039_DP""","""CCOC(=O)CC(OCCCCCC1OCCO1)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""A8C3EE14659F3877_55DD7BBF42AB3656_6039_DP""","""CCOC(=O)CC(OCC2CC1(CC1)[S](=O)(=O)N2)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""1DFFEB279522E0D5_E8204E7C2EC564AC_6039_DP""","""CCOC(=O)CC(OCC1=CC2=C(C=C1)N=N[NH]2)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""F90D90ED6BDE1949_3290C33AF50ED97C_6039_DP""","""CCOC(=O)CC(OCC1=CC=CC2=CC=N[N]12)[C@@H](C)N""",21,"""E733131475C656A8"""
-"""1D3ABD0748BCCA15_3D74A359FAEC0219_6039_DP""","""CCOC(=O)CC(OCC1=C(COC)C=CC=C1)[C@@H](C)N""",21,"""E733131475C656A8"""
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-"""F99C33158F265EEB_D27874349157475E_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCOC(C#N)C2CC2""",21,"""FED139B8B8BC70B5"""
-"""6090445819C789B9_613922133F816902_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2CC(=NO2)C3CC3""",21,"""FED139B8B8BC70B5"""
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-"""BB9B41897E22C469_57074FABACA3D843_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(ON=C2OC)C""",21,"""FED139B8B8BC70B5"""
-"""53DC5128DCAD0D38_622CD084756092A4_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCOCC(OC)OC""",21,"""FED139B8B8BC70B5"""
-"""7613108263B4B9FE_5C2E79F86629D966_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NC(=CC=C2)C#N""",21,"""FED139B8B8BC70B5"""
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-"""3F06B1ADD69F3706_BF5D6ED6C85EB9B7_6039_UN""","""C[N]3C=C(COCC1=NN=C2[N]1CCCC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""95C85238ED509C79_387AF5303CE98381_6039_UN""","""C[N]2C=C(COCC(=O)C1CCCCCC1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""0229F34AB078ED3B_BAB20870FB55EEEF_6039_UN""","""C[N]2C=C(COCC1=NOC(=C1)C(C)(C)C)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
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-"""4D9B50833EB17198_48A5F8B8294423EF_6039_UN""","""C[N]3C=C(COCC1=CC2=C(C=C1)C=N[NH]2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
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-"""0177E5A3F9A4EF3A_69136027A8A568A7_6039_UN""","""C[N]2C=C(COCC1=COC(=C1)[S](N)(=O)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""C23C8577F7451A0A_013950F43B3D5F1F_6039_UN""","""C[N]2C=C(COCC(OC)C1CCCCC1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
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-"""EF18672B9097B71F_554940BF377AF5F5_6039_UN""","""C[N]2C=C(COCC1=NC(=CC=C1)CC#N)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""9D0BB39FCB2AD5BB_E8996BA79099AAFC_6039_UN""","""C[N]2C=C(COCC1=CC(=CS1)C(F)(F)F)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
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-"""B4FB6DA2238F4523_7D1E270BCBF7C674_6039_UN""","""C[N]2C=C(COCC1=NOC(=C1)CC(C)C)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""F223AFE76BE61393_CE51B54E4D31D77E_6039_UN""","""C[N]2C=C(COCC1=N[NH]C(=C1)C(OC)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""74E68D528EB8C92D_C6FE92A1C0B7E5D3_6039_DP""","""C[N]2C=C(COCC(N1CC(C)NCC1)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""4D86107879EB46B6_127C489CCA318848_6039_UN""","""C[N]3C=C(COCC2=CC1=C(C=CC=N1)S2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""438ECE468B33CBF0_9BEF9F1E04828D2C_6039_UN""","""C[N]2C=C(COCC1=CC(=NC(=C1)C)OC)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""277C314966B2B4A1_DFB7138D902A2D67_6039_DP""","""C[N]3C=C(COCC1CNCC2(O1)CCC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
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-"""3C2C9A2479D76DE4_F0DC8B98F8E89D32_6039_UN""","""C[N]2C=C(COCCN1CCCO[P]1(N)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""B48759360CF2EDFD_37BB874015551009_6039_DP""","""C[N]3C=C(COCC1=N[NH]C2=C1CNCC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""9EC1A90E886EFD79_F0D344914DAF034B_6039_UN""","""C[N]3C=C(COCC1=C2C(=N[NH]1)CCCC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
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-"""7039483EFDF81D79_FF589877B0EDB912_6039_UN""","""C[N]2C=C(COCC1=C(C(OC)=O)SN=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""D321DE8BE8CF8FE2_F91222BB2745DF10_6039_UN""","""C[N]2C=C(COCC1=C(C(F)F)C=NC=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""2AFC820C70D760A4_75DCE5922C66C902_6039_UN""","""C[N]2C=C(COCC1=C(C(F)(F)F)SC=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""0F44200A7F8DA1F1_EC0AAD9F142FFFA8_6039_UN""","""C[N]2C=C(COCC(C1(C(F)(F)F)CC1)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""F8B4BA4B1E0BB26A_DCC053C3CB3A180E_6039_DP""","""C[N]3C=C(COCC1CNC2(CO1)CCC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""80BB840863DB652C_98B3F19B22047DB6_6039_UN""","""C[N]2C=C(COCC1=C(C(C)(C)C)OC=N1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""70F0FF8282714443_98BCD299BA16704E_6039_UN""","""C[N]1C=C(COCCOCCOCCOC)C(=N1)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""83421A1DB603A918_507467FFD2A5EE8D_6039_UN""","""C[N]2C=C(COCC1=NN=C(C(F)(F)Cl)S1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""9191D87199CFE6D6_72652CB04F46443E_6039_UN""","""C[N]1C=C(COCCC(C(OCC)=O)(F)F)C(=N1)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""46E47F4567EAA064_1EB114E7E2CB5B22_6039_UN""","""C[N]2C=C(COCC1=C(SN=C1OC)OC)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""B0A008AFE09B902F_11D34BB7B3636436_6039_UN""","""C[N]3C=C(COCC1=NOC(=C1)CC2CC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""8B46377484C09C59_5014A42CB3AF56F5_6039_UN""","""C[N]3C=C(COCC1=CC2=C(C=C1)OCO2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""863FEB07253FEF93_3B9DC061648AF30F_6039_UN""","""C[N]2C=C(COCC1=NC(=C[NH]1)C(F)(F)F)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""7EB60391293E934B_429C4BAD9DBFAEA0_6039_UN""","""C[N]3C=C(COCC1=NO[C@@H]2CCCC[C@H]12)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""9DCAC73AEA442271_CF95C8D0D1B7E6BA_6039_UN""","""C[N]2C=C(COCC1=CC=NC(=N1)COC)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""3FF07F726C4B5F63_5B80D49360B91455_6039_DP""","""C[N]3C=C(COCCC2CC1CCC(N1)C2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""7D119A68B9CA7FA7_FB9EC2B7FB2170E4_6039_UN""","""C[N]2C=C(COCC1=CC=CC(=C1)C(N)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""B8DCCC31E03850EC_3EF665200B9A489F_6039_UN""","""C[N]2C=C(COCC1=CC=C(C(OC)=O)S1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""8735BAF09D47B1C4_2626B2369DB4778F_6039_UN""","""C[N]1C=C(COCC(NCCCC(O)=O)=O)C(=N1)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""4A5D85C78305831F_4E66664BD3CE3DE9_6039_UN""","""C[N]2C=C(COCC(=O)NCC1=CC=CS1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""2181ED1D9BD7EC4A_042ABEFC0CCCBA21_6039_UN""","""C[N]3C=C(COCC1=CC=CC2=NON=C12)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""BF34A599DFB8505D_14C2BFA26D090801_6039_UN""","""C[N]3C=C(COCC2=C[N]1C=CC=NC1=N2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""B3332622B97F2421_8B50C162A1AF6C84_6039_UN""","""C[N]2C=C(COCCOC1CCCCC1C)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""0EB9317FE0683206_59EE619753CBC22E_6039_DP""","""C[N]3C=C(COCC2=CC1=C(C=C[NH]1)C=C2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""153B1E104B306DB1_DE944F7131308CF9_6039_UN""","""C[N]2C=C(COCC1=C(C(=NO1)C)[N](=O)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""14818299015F0078_389C24EB049C0DA2_6039_UN""","""C[N]2C=C(COCCOC1=CC=C(C)C=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""7DE02A12E2A5F383_331E9544CD6710B9_6039_UN""","""C[N]1C=C(COCCOCC(C(F)F)(F)F)C(=N1)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""2662EEA3234423EB_D5FAE25FB22BFBD1_6039_UN""","""C[N]1C=C(COCC(NC(NCCC)=O)=O)C(=N1)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""A47BB0E3B9B612B8_73E9841578DB6707_6039_UN""","""C[N]3C=C(COCC1=NN=C([N]1C)C2CC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""3B4988DBB13314B8_2483C9D58DBA5388_6039_UN""","""C[N]3C=C(COCC1=NN=C(S1)C2CCC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""80633F50BBFABB52_EFB660A5C83159AA_6039_UN""","""C[N]2C=C(COCC1=CC=CC(=C1)C(F)F)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""F9AAFEC08AF8BD01_56FC2A5F26B47BFF_6039_UN""","""C[N]2C=C(COCC1=CC(=C(C=C1)C)OC)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""A26BC2EE14F7B710_4ECB1A3FCE8D8FA0_6039_UN""","""C[N]3C=C(COCC1=C(C=CC=C1)C2CC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""2420B06E5E132A5C_5410434709EA42BD_6039_UN""","""C[N]3C=C(COCC2CC1(CCC1)C(=O)O2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""AB02CA1CF5271033_6C9E058A3BB4E056_6039_UN""","""C[N]1C=C(COCC(NCC(C(C)C)=O)=O)C(=N1)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""DCF2F61956BEED89_E9855D093E7FC73C_6039_UN""","""C[N]3C=C(COCC2=NC1=C(C=CC=N1)O2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""9C7BCC14444CAC7D_54A362D931F5EEE7_6039_UN""","""C[N]2C=C(COCCC1=CC=C(C=C1)C#N)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""91A21168041FF43A_06AE4B16C6F59B5E_6039_UN""","""C[N]2C=C(COCC1=CC(=C(C=C1)C#N)C)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""3148CD3497207492_6FE7CDAE0AB3B341_6039_UN""","""C[N]2C=C(COCCCN1C(=O)CNC1=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""78976D6916C1A43A_1F38B93DA9E7FAB8_6039_UN""","""C[N]3C=C(COCC1=CC=C(C=C1)C2CC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""1864024EE98D2549_356F43097D72D4BA_6039_UN""","""C[N]2C=C(COCC1=NC=N[N]1CC(F)F)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""1228A424F6C9728C_7D03A280A6800B4E_6039_UN""","""C[N]2C=C(COCC1=CC(=C(OC)N=C1)C)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""CC035C154F1B5BDB_D3FD1C079A689028_6039_DP""","""C[N]3C=C(COCC2=NN=C(C1CNC1)S2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""9FC29CDE03C720B0_0C257AE77C475CFE_6039_UN""","""C[N]2C=C(COCC(C1=C(C)[N](N=C1)C)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""7445536B83BC29D2_1024ABE2B39DF2BE_6039_UN""","""C[N]2C=C(COCC1=CC=C(C(F)(F)F)S1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""823CCBD9071400CB_307958B812FAC75F_6039_UN""","""C[N]2C=C(COC[C@H]1CC[C@@H](C(OC)=O)O1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""60BC6FB78A890D01_4F40B68FC2AF9777_6039_UN""","""C[N]2C=C(COCC1=CON=C1C(F)(F)F)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
-"""D11ED28E5F5F4F95_712924288B55C44F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NCC(OC)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""F73CC66DCD764332_2497A46348595B39_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)N2CCNC2=O""",21,"""E2461D15B4E1CF00"""
-"""D299272C73F51D77_59CF4864CEF45F98_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=C(SC)C=C2""",21,"""E2461D15B4E1CF00"""
-"""A4B617EF0219C4AA_1D85AC285AA93314_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NC(NCC)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""31A68CC0AA61E3D7_1D6B20B3DF3EFF26_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NC(C(C)C)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""DC11992FC42190F0_899AB42DDA01CF63_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC=NNC(C(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""57CD7D7D84956009_6C38A23E39203FDB_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=CC=C2)C#N""",21,"""E2461D15B4E1CF00"""
-"""5B318A857726712B_03FD6FF1C13ADF97_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NC(C)C2CC2)=O""",21,"""E2461D15B4E1CF00"""
-"""F40C949F505740C3_72290DD232367F4C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)N2CCOC2=O""",21,"""E2461D15B4E1CF00"""
-"""B4A2FB4F623F7C46_B3CB16086707AD34_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=CC(=C2)C)C""",21,"""E2461D15B4E1CF00"""
-"""551036C0D68FE6FC_6437A8FF817902DE_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)NC2=NN=CS2""",21,"""E2461D15B4E1CF00"""
-"""B268D89E3C24C7D3_2B1E99025BCC71D2_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C=CC=C2)C#N""",21,"""E2461D15B4E1CF00"""
-"""D4B9BBAD4AC0751F_339D5099F8E59FF2_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CSC(=N2)CCC""",21,"""E2461D15B4E1CF00"""
-"""8239EC293B9CA4ED_3221E163AC8E8011_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=NO2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""487D2F817D683ACF_5470C4432EA9C9F5_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=N[N]2C3CC3""",21,"""E2461D15B4E1CF00"""
-"""10589F093930485F_0BAF5EB835B64CD0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=NO2)C(C)C""",21,"""E2461D15B4E1CF00"""
-"""E3109075202CCA63_82CDA7F2AC7BCE31_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)NC2=NOC=C2""",21,"""E2461D15B4E1CF00"""
-"""3FFA58C3685EF7B9_00E236CC010DAA58_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NOC(=N2)CCC""",21,"""E2461D15B4E1CF00"""
-"""14978162C0142D40_64AF19AACA78BE13_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=NO2)CCC""",21,"""E2461D15B4E1CF00"""
-"""B81122296ACE8BD9_E8B42514C9AC4E2A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=CC=C(C)S2)=O""",21,"""E2461D15B4E1CF00"""
-"""F131EB646F6C0186_61FC386957419734_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2C(SC=C2C)=O""",21,"""E2461D15B4E1CF00"""
-"""1D3B91373BA364D2_500CCD9C089EB732_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2C(=O)CNC2=O""",21,"""E2461D15B4E1CF00"""
-"""36763397DB3984F9_A18472315E292D0C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2C(=O)CCC2=O""",21,"""E2461D15B4E1CF00"""
-"""26BC117F0AF2E276_B3AEBF3050AB4DE0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOC2CCCCC2""",21,"""E2461D15B4E1CF00"""
-"""DCAFBAD953FECCA3_2945E8E480ED2C47_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C=C(F)C=C2)F""",21,"""E2461D15B4E1CF00"""
-"""8879615C99C05987_41704168340897CE_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=N[N]2CCC""",21,"""E2461D15B4E1CF00"""
-"""4A928E0786A82968_C07C5C721D2B4F30_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(N(CC)C2CC2)=O""",21,"""E2461D15B4E1CF00"""
-"""3915DCB5CECA292F_336D227AA93CF748_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CSC(=C2)[N](=O)=O""",21,"""E2461D15B4E1CF00"""
-"""7695BBEA0F92B17B_90F814DF81AF84AD_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2=C[N](C)N=C2""",21,"""E2461D15B4E1CF00"""
-"""9C5702B5FC4B1CE1_F1A689F53AF312EF_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC(NC(N)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""AC3BADC7A0968257_7837DFEB463B5EAD_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCN2CCCC2=O""",21,"""E2461D15B4E1CF00"""
-"""6B93AD0C6E4BCAF8_70AE35725A0099AD_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(OCC)S2""",21,"""E2461D15B4E1CF00"""
-"""00BB56D0C546D0AE_E8044EDD15F26408_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NOC(=N2)C(C)C""",21,"""E2461D15B4E1CF00"""
-"""520267666F762740_5A07740B074FAA1B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CSC3=NCCN23""",21,"""E2461D15B4E1CF00"""
-"""91A831670FE192DE_D3DBF28A4BDF6C5E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCN2CCOC2=O""",21,"""E2461D15B4E1CF00"""
-"""9584A310E36DEBBC_B6A79D1D102191DD_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCOCC(F)(F)F""",21,"""E2461D15B4E1CF00"""
-"""F6DBC7B414388137_F309227622F29C33_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NCCN(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""6742BCC933C6C3F7_6FBA49C46C502CC6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C[N]3C(=N2)SC=C3""",21,"""E2461D15B4E1CF00"""
-"""A793479005758601_DBA9724200DD8F6A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCN2CCOCC2""",21,"""E2461D15B4E1CF00"""
-"""6D8195B7B3B3B3FA_B135AF4227C5B61A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2OCCN(CC)C2""",21,"""E2461D15B4E1CF00"""
-"""FCE769801DB42F2D_5422010042968C58_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=N[N]2C(C)C""",21,"""E2461D15B4E1CF00"""
-"""87F6A108FEDDCE6B_B30D098909C190CC_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCCC(N(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""2CCA37A8EC23C42C_26B1D7B1D876C173_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)NCC2CCC2""",21,"""E2461D15B4E1CF00"""
-"""57F6BC70F9F86151_F03C0781B7DA8686_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C[N](C)N=C2)=O""",21,"""E2461D15B4E1CF00"""
-"""CA4B4531BA6FC861_78ED39F5234C9F17_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC[S](N(C)C)(=O)=O""",21,"""E2461D15B4E1CF00"""
-"""507B5DD035A253AF_549D6ADC6D7B9C33_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=N[N](C(C)C)C=C2""",21,"""E2461D15B4E1CF00"""
-"""07CAF42E4CFEE916_2E99F3D4C451518B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C)C=CC=C2C""",21,"""E2461D15B4E1CF00"""
-"""95484F9B9A23DCBE_AC01193A1ADB582E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=CC(=N2)OC""",21,"""E2461D15B4E1CF00"""
-"""3507B199CD1C78B8_F86BAC6CF43AC788_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=C(CC)C=C2""",21,"""E2461D15B4E1CF00"""
-"""72DA6FF143732B99_27BC3CAC872B3A76_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=CC=C(C)C=C2""",21,"""E2461D15B4E1CF00"""
-"""D7A11F90238F01AD_E42A6B80F1CEC323_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CN=C(OC)C=C2""",21,"""E2461D15B4E1CF00"""
-"""EA1BB850F9B39730_39CB2AC19809A56E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2ON=C(C(C)C)C2""",21,"""E2461D15B4E1CF00"""
-"""55E3234BCE64068C_C31BE5B170BBBD4E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2COC(C)(C)O2""",21,"""E2461D15B4E1CF00"""
-"""A853936545C77754_86F13A5F7744F800_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NC(C)C(=O)O)=O""",21,"""E2461D15B4E1CF00"""
-"""F0E5754799DC0D1C_9B90A360081D7A22_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NCCOCC)=O""",21,"""E2461D15B4E1CF00"""
-"""8A9D71A1ADDA038E_B710581B11EE5869_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C=CC(=C2)F)F""",21,"""E2461D15B4E1CF00"""
-"""1C8CAEF38153BEEB_F99636AAABA3FC3F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(OC)N=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""A5F938A9E465C3C8_FA1F0AFF4694ED08_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOCC2CCCO2""",21,"""E2461D15B4E1CF00"""
-"""C99D231C0E130EF2_AD581F392683C4B6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2=C(C)N=CS2""",21,"""E2461D15B4E1CF00"""
-"""75412C83724634A0_8B7649DE237CA684_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2CCC(C)CC2""",21,"""E2461D15B4E1CF00"""
-"""3ACEEEFAD50F886E_F0654D030E896715_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC[S](C(C)C)(=O)=O""",21,"""E2461D15B4E1CF00"""
-"""A585828AD94B4777_F8EA84F2F028B3A4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C([N]2CC)C""",21,"""E2461D15B4E1CF00"""
-"""4C6AD935FC259F58_952220CD49E0432D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)C2CCOCC2""",21,"""E2461D15B4E1CF00"""
-"""8C3B04CA9AB2E0F6_5DB3C14428FE4C6B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCN2CCCCC2""",21,"""E2461D15B4E1CF00"""
-"""1C2565DE70A90892_EA231DF9B1ED1388_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2=NN=C(C)O2""",21,"""E2461D15B4E1CF00"""
-"""88AE285497BD291B_5E0940D7B65038C0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCCN(CC)CC""",21,"""E2461D15B4E1CF00"""
-"""5515A051FCD801D1_08A01F40F4D641C2_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2CCC[S]2(=O)=O""",21,"""E2461D15B4E1CF00"""
-"""818288649D46DD3A_B2A8C067ED2BA6A2_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(N(C)CC2CC2)=O""",21,"""E2461D15B4E1CF00"""
-"""02385FA3326CD350_BBF029FB4C658F12_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=CC=C[N]2C)=O""",21,"""E2461D15B4E1CF00"""
-"""4D764C89C111DD34_C119C4E2A82D4023_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC(NC(NC)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""F86E01E992BD2B9D_DA1C72F4BF254BA6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=C(C(C)C)O2""",21,"""E2461D15B4E1CF00"""
-"""292DF4B141AF23E8_DA6CAD77C3F2F080_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(ON=C2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""5255F4AFA8AAF18E_04CE4150369F782F_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC(N2CCNCC2)=O""",21,"""E2461D15B4E1CF00"""
-"""271355DBF73C927D_533809D05222DA1C_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)C[C@H]2NC(O[C@@H]2C)(C)C""",21,"""E2461D15B4E1CF00"""
-"""36C751D6C88CCBA0_E80C804A5076FCD7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NCCCCC)=O""",21,"""E2461D15B4E1CF00"""
-"""7F41170F92432F3C_550F55ACD43BA79E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C[N](C)C=C2)=O""",21,"""E2461D15B4E1CF00"""
-"""B77357CB630BEBAF_3E6ADB03E6067853_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CSC(=N2)COC""",21,"""E2461D15B4E1CF00"""
-"""46A211F77D6A41DA_77B43EB8C527A092_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=C(ON=C2C)C""",21,"""E2461D15B4E1CF00"""
-"""4798344F288DA2E6_A07759F850B40FDE_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(O2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""4AC6CF6217EE4E39_4AD274C6CCCD7007_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCN[S](CC)(=O)=O""",21,"""E2461D15B4E1CF00"""
-"""FC21D5C9A6A3703A_726E14FC099682CB_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=C(F)C=C2)F""",21,"""E2461D15B4E1CF00"""
-"""DECE9940C2C530C3_9BC565711D229022_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC[N]2C=CN=C2C""",21,"""E2461D15B4E1CF00"""
-"""7F169AA3582009DF_3410671EB7DF4329_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(OC)C=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""B92BFAC80394370A_C582C7267DE65719_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOCC(OCC)=O""",21,"""E2461D15B4E1CF00"""
-"""DE28BDAC3A3C66FF_ABD23EA6E6A89C0B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC[N]2N=C(C)N=C2C""",21,"""E2461D15B4E1CF00"""
-"""B474512CA4E885C5_185C27B490003620_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(ON=C2CC)C""",21,"""E2461D15B4E1CF00"""
-"""A78E87D05659DECB_DFABA2D6D463D1D5_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(OC=N2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""89705A0646F3E9A0_C9B5E4CE148BA624_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2CCN(C)CC2""",21,"""E2461D15B4E1CF00"""
-"""D551756E069AC8D0_03A4BDF2F407FCC1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C(C)C)OC=N2""",21,"""E2461D15B4E1CF00"""
-"""7E655C7E34DC46DF_2D27239B1A63AEAA_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2C(C=CC=C2)=O""",21,"""E2461D15B4E1CF00"""
-"""4450F2A3A106A8E1_996DE3CEC3014575_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=NO2)COC""",21,"""E2461D15B4E1CF00"""
-"""CD58DF2DCC5DF115_1F27864B75C5B986_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=C(CF)C=C2""",21,"""E2461D15B4E1CF00"""
-"""5CD4852BC7237787_5B554428ABFC1D09_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)NC2CCCC2""",21,"""E2461D15B4E1CF00"""
-"""D49DAD349273BACB_EDD462AF96689F5F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)NC2=NC=CS2""",21,"""E2461D15B4E1CF00"""
-"""F9F12461F5D209BA_2BE8C74A83E488C3_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(CCC)S2""",21,"""E2461D15B4E1CF00"""
-"""52614AF5F00D86E2_86982992417ACA7C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CSC(=N2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""E13E7629D02EB447_7858131540095842_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)C2CCCCC2""",21,"""E2461D15B4E1CF00"""
-"""4527FBE288469A5C_C7DDBCEA04144652_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NOC(=N2)COC""",21,"""E2461D15B4E1CF00"""
-"""F26D18500BC98A8E_831D19A631BC0E67_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=C(C=C2)C#N""",21,"""E2461D15B4E1CF00"""
-"""3F3952B5BFF9A4FC_69F14704F724C3D8_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(SC)C=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""BB3164B9C1C086FB_B09D6C579ADEE9C0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NCC(F)(F)F)=O""",21,"""E2461D15B4E1CF00"""
-"""78FAE5DE56E1AC5E_25311B639D787A57_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(C(F)F)S2""",21,"""E2461D15B4E1CF00"""
-"""A5C269143B0FD586_7D2019BEC356ED0F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(F)C=CC=C2F""",21,"""E2461D15B4E1CF00"""
-"""48EE4F0D5FBC4179_84D4C05B1E6114FC_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=CS2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""2C868A49FD20602B_C5A14F9C0243753E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C#C[Si](C)(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""A3BCDB467B0B6CFB_29D59D9C72586CE6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2N(C)CCCC2""",21,"""E2461D15B4E1CF00"""
-"""1F3096BDA9C553A6_C4636F0D08D8637F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)C2CCCOC2""",21,"""E2461D15B4E1CF00"""
-"""FC048C3AB30287E1_0D3897A86095B27F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN(CCC)CCC""",21,"""E2461D15B4E1CF00"""
-"""3557A732D79BA049_FEE94B518D68BB35_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NCC(CC)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""26950AD97855708D_8BC008719F107D2B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=CC(=NO2)C)=O""",21,"""E2461D15B4E1CF00"""
-"""1D5B21B2E61515D2_70EB5CF0B355ED26_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOC2=CC=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""E89B3A46332334E3_5692E16098B92F04_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=NO2)N(C)C""",21,"""E2461D15B4E1CF00"""
-"""BF512F47B9135CBA_DD7DA80D73DDDB51_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C)C=C(C=C2)F""",21,"""E2461D15B4E1CF00"""
-"""E0569FD7AF6A2AAB_D9C4265ECECD5B56_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(N=C(C)C=C2)C""",21,"""E2461D15B4E1CF00"""
-"""076555B0AA9D0936_065C149CFE39833C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOC2=CN=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""32731036B781C841_89B1EFD5E75D5C9A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(CC)C=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""3D95DC947286F78F_0F3AD1777B0B224A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2CCOC(C)C2""",21,"""E2461D15B4E1CF00"""
-"""75C9D5C02F74712A_12C9C527674BC231_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C(C)ON=C2)=O""",21,"""E2461D15B4E1CF00"""
-"""B8ECD51EFE3D59D2_0DCD3F6BABEE747B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C)C=CC(=C2)F""",21,"""E2461D15B4E1CF00"""
-"""FD45E1AEAC14099A_99C5B03E1FE5E6C3_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)C2=NC=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""C43F430A87F9BAD9_7F3E52BFBE7B4006_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=CC=N[N]2CC""",21,"""E2461D15B4E1CF00"""
-"""0C0FD4E648ECCBE6_5180BE26442E4026_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C)C(OC2=O)=O""",21,"""E2461D15B4E1CF00"""
-"""A53540108ECF47F4_1A9A46BCA1AAFF3B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=NN=C(OC)S2""",21,"""E2461D15B4E1CF00"""
-"""DD33E02F56FEA348_197A2807067DF89B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=CC(=C2)CC""",21,"""E2461D15B4E1CF00"""
-"""9253AC408C9F875B_D9BEF25105EEB530_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC#CC2=CC=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""5A2CBE353681BAF2_0A512CD7A4631B16_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2C(C)COCC2""",21,"""E2461D15B4E1CF00"""
-"""F25430FD605DB34C_E8B8B522F0AB14F0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2CC(F)(F)C(O2)=O""",21,"""E2461D15B4E1CF00"""
-"""0D864A5920A576AA_5FBACA9928D20186_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2CCOCCC2""",21,"""E2461D15B4E1CF00"""
-"""65808156522DB2BD_29E6ABDD0B8656FE_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(N(C)C)O2""",21,"""E2461D15B4E1CF00"""
-"""52EF0B6B90769189_BC240728038A3D61_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=N[N]2C(C)C""",21,"""E2461D15B4E1CF00"""
-"""75D5C3A11FCCC51C_DE0650C9B86C58B1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=C(C)C=C2)C""",21,"""E2461D15B4E1CF00"""
-"""3CB9E8242908A34C_C8554BC9E01DEF86_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(OC)C=C2""",21,"""E2461D15B4E1CF00"""
-"""9380A05C63AE8FC2_31DEA65A66BAD2C9_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CN=C(OC)N=C2""",21,"""E2461D15B4E1CF00"""
-"""1B33D9D738145898_02CE0FD745192A6C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCSC2CCCCC2""",21,"""E2461D15B4E1CF00"""
-"""10A000F17A5FACD0_3B8C12BA5FFAEF96_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC(C(OC)=O)(C)C""",21,"""E2461D15B4E1CF00"""
-"""F57D50FE3527CE40_237DD64B09077FBA_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=N[N](C)N=C2)=O""",21,"""E2461D15B4E1CF00"""
-"""82F6CDBAC7F9EC73_E1614A1D0D657EAC_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(CCSC(C)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""0E6C111DDE710073_E2D35FF7E5DC6A3E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=COC(=N2)C(C)C""",21,"""E2461D15B4E1CF00"""
-"""7CEA0B9B2AC1153B_A3ECE5E8AFECCD0E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(OC)C=CN=C2""",21,"""E2461D15B4E1CF00"""
-"""F12215979CCD35CD_C0856F6BC38B300D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CN=CC(=C2)OC""",21,"""E2461D15B4E1CF00"""
-"""C6F6D214C42044CA_658BB21B8EB17778_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C[N](C(C)C)N=N2""",21,"""E2461D15B4E1CF00"""
-"""95B32A6C5C1D88D5_480C8FF795AA67A3_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOCCNC(C)=O""",21,"""E2461D15B4E1CF00"""
-"""C92635DC63D91CC9_BFAE0CB8CFF97A0F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2CCOCC2=O""",21,"""E2461D15B4E1CF00"""
-"""CC52EC629420ACE8_E1554899A915D77E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=NO2)C(C)=O""",21,"""E2461D15B4E1CF00"""
-"""4BFF0E0E8EF90745_95FA5F5C7827F0D6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(CCC(OC)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""40E6FD1CCA70A050_802AC72E1D953C11_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC(C(CC(O)=O)N)=O""",21,"""E2461D15B4E1CF00"""
-"""46A03E4A48E17DA8_230AFE4E1589D6B5_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(N=C(CC)O2)C""",21,"""E2461D15B4E1CF00"""
-"""40605C4BE0A30040_FF63D79536C6EE3D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=NO2)C(C)C""",21,"""E2461D15B4E1CF00"""
-"""B36D1E83CE99BE15_E032C800F2882D75_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=N[N](CCC)C=C2""",21,"""E2461D15B4E1CF00"""
-"""F1B80931AFDA04DD_734C5978F51A540A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)N2CCOCC2""",21,"""E2461D15B4E1CF00"""
-"""8805A6C7A15EFCBE_DA2DBFB8F0DF8B15_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=C[N]2C(F)F""",21,"""E2461D15B4E1CF00"""
-"""CD8F39C650D3686B_A3B228AE5D3790DB_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)N2CCCC2=O""",21,"""E2461D15B4E1CF00"""
-"""9E29EA4221408A5D_805EBBF907BEF03F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=CC(=C2)OC""",21,"""E2461D15B4E1CF00"""
-"""8A7F338A7E429FC3_5DFF27B9BFDA9534_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCCN2CCCC2""",21,"""E2461D15B4E1CF00"""
-"""38C923810F5FD67D_910E8E199E0D291C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=CC(=N2)OC""",21,"""E2461D15B4E1CF00"""
-"""423E88B7ACA79774_B25BF55F21C15160_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(N=C(C)C=N2)C""",21,"""E2461D15B4E1CF00"""
-"""7FC38ACC05514118_073510F58074AC17_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC(C(OC)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""D017BA5776E893A1_561AD598475D0FF0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)C2=NC=CN=C2""",21,"""E2461D15B4E1CF00"""
-"""9C1B93961E819878_17E5A01876DE87BF_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC[N]2N=C(C)C=C2C""",21,"""E2461D15B4E1CF00"""
-"""64C4E2BD52A79298_4B9AC8DD17CDA71F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=N[N](CC)N=C2C""",21,"""E2461D15B4E1CF00"""
-"""8609BB5620A78C83_94211196A6A61ADA_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(OCC(F)(F)F)=O""",21,"""E2461D15B4E1CF00"""
-"""9CE6616665C1B84C_DE1523D4144EF3D4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C=CC(=C2)C)F""",21,"""E2461D15B4E1CF00"""
-"""B375339174D3EBD2_262A856DA5E835DC_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=CN=N[N]2C)=O""",21,"""E2461D15B4E1CF00"""
-"""1958EC904DE44214_2E7C1155811CAAB6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=N[N]2CCC""",21,"""E2461D15B4E1CF00"""
-"""A997F3CBB10FCA2A_4230A7E494E90A20_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2CCOCC2""",21,"""E2461D15B4E1CF00"""
-"""86919016FE3FF097_4C29A3A58359C43E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCCCC(C)(C)C""",21,"""E2461D15B4E1CF00"""
-"""53BDA3170135AC00_A5AFC285EACE8EF4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C=CC(=C2)C)C""",21,"""E2461D15B4E1CF00"""
-"""786801317C24D60A_BF1A06737C39D03E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=N[NH]C(=N2)C(C)C""",21,"""E2461D15B4E1CF00"""
-"""65E501D611A7CCE0_E147DC2B66748463_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=C(F)C=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""47532407872564ED_CCA742BDB2BDBB64_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=NC(=N2)C)C""",21,"""E2461D15B4E1CF00"""
-"""F93B241479599673_6D23C8A6681F357B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=CC(=C2)C#N""",21,"""E2461D15B4E1CF00"""
-"""D20571B114B73DDA_0F2331DCACCB8A86_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=C(C)C=C2)F""",21,"""E2461D15B4E1CF00"""
-"""86C9C3BFDB8BCB0F_CCE23A2B028D9884_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=N[NH]2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""6292CAE0026A6CFB_2C4F48DE0090A729_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NSC(=N2)N(C)C""",21,"""E2461D15B4E1CF00"""
-"""D36E67F741DB0240_24E5EE806E0F26A4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)C2=CN=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""9F12C9331DBAA43E_3B1E9934704D4BC8_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCCC(OCC)=O""",21,"""E2461D15B4E1CF00"""
-"""C619E6012221F8DB_3FE9B104BEC2C955_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2=NC(=NO2)C""",21,"""E2461D15B4E1CF00"""
-"""F2372A256F34B206_8BFDDE04E4B3019C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NOC(=N2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""39FF9EDC194BA5A1_FFC21C7ED72CFF61_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOC2CCCCO2""",21,"""E2461D15B4E1CF00"""
-"""0CBB0A0F0FE83D83_31E30DC333CA30CC_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCSC2=CC=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""F792C822BC5B1C97_9ED9F8CD15AC430C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)CC2CCCO2""",21,"""E2461D15B4E1CF00"""
-"""D444FEE0E49D0851_ACB0E137E6226B35_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOCC2CCCC2""",21,"""E2461D15B4E1CF00"""
-"""FCCF48B649AB39EA_F9F40BC788276D99_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(N=N[N]2CC)C""",21,"""E2461D15B4E1CF00"""
-"""1F5E1D7C91FBA599_B0ECC1532ABB5FBE_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=CC(=C2F)F""",21,"""E2461D15B4E1CF00"""
-"""F91275457C2F6D82_2479BC2FBBA5EC63_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=C(C=N2)C#N""",21,"""E2461D15B4E1CF00"""
-"""6DD898FCFAC41DBD_E0019807D03CF8E9_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCNC(NC(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""0863E9436465D560_5A8090405694963C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2=CN=C[N]2C""",21,"""E2461D15B4E1CF00"""
-"""0536DD5517344C9C_67ADD43EBB0FAA4C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=NO2)C(F)F""",21,"""E2461D15B4E1CF00"""
-"""CBE9F0FD8A69302C_12A6992BAE666B63_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=NC=C[N]2C)=O""",21,"""E2461D15B4E1CF00"""
-"""A7D774A9ADDB6A12_0CDC6FB98261DD8E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=C(N=C2)Cl)F""",21,"""E2461D15B4E1CF00"""
-"""08636D5FD7C12272_8ACCDE62A1D2CF83_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=NON=C2C)=O""",21,"""E2461D15B4E1CF00"""
-"""7EB7561EDA242645_D7E10C4082AC0BA1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(S2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""838C857F270CB1B2_CAB763F1D1B8EE1D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=C(C=C2)C#N""",21,"""E2461D15B4E1CF00"""
-"""8F9B14EE0CB22937_9E0B0ECDAE5B4DA4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C=C(C)C=C2)C""",21,"""E2461D15B4E1CF00"""
-"""0112B5A6C413D38F_0C6D7140D2B16222_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C[N](C)N=N2)=O""",21,"""E2461D15B4E1CF00"""
-"""C9BD09B64C2A260D_5FA11649672AA0A3_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=CC=N[N]2C)=O""",21,"""E2461D15B4E1CF00"""
-"""F5042839145F3360_985F93BC0B54AC17_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC3OCC2(CNC2)C3""",21,"""E2461D15B4E1CF00"""
-"""4773943FB3EC9097_F6430D2899E70D54_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2CCCCCC2""",21,"""E2461D15B4E1CF00"""
-"""E7B2C17F611B050D_9F64AFADEB96CAD3_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC3=N[N]2CCCC2=C3""",21,"""E2461D15B4E1CF00"""
-"""25AE36ECF26C5F58_490A213EC116CC8F_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2CCNCC2""",21,"""E2461D15B4E1CF00"""
-"""480077914CC51847_81643841CE2512B4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C=NC=C2)C#N""",21,"""E2461D15B4E1CF00"""
-"""85B39F60D3E4FA18_8C9D8CB6D2F73144_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2CN(CC)C(O2)=O""",21,"""E2461D15B4E1CF00"""
-"""D4BF1AC8BF96CED3_FD27451D75E8655F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2=CN=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""FB621EC11C240184_B2BCC1394BF5EE13_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=CC(=C2)SC""",21,"""E2461D15B4E1CF00"""
-"""7E85E94DB47BE400_18CCF5121B7BE778_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)C2=CC=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""EF83E726B2BAC195_095F2E6653492ED8_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC#C[Si](C)(C)C""",21,"""E2461D15B4E1CF00"""
-"""7EFA51847D34F5F7_24D6FCE514C431DF_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(OC)C2CCOC2""",21,"""E2461D15B4E1CF00"""
-"""0BF5EDE590DACD11_0610E65B3B1A32D4_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC3CCC2(CNC2)O3""",21,"""E2461D15B4E1CF00"""
-"""8AAD8CBAEC1D4837_4C0862D0A9A102E0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC=N[S](C(C)(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""2983E6D53C6FDC4A_51611AA86420CE1C_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC2NC(OC2C)(C)C""",21,"""E2461D15B4E1CF00"""
-"""14AD208D348CA902_95B15D35CCABD054_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=CS2)C(O)=O""",21,"""E2461D15B4E1CF00"""
-"""7650C547FDC061D9_ED52E23F1BA6BCD0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=NO2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""14EFABA57395634A_843B70B91EDA9365_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2CC(C)(C)C(N2)=O""",21,"""E2461D15B4E1CF00"""
-"""C891DF7FFCF49490_800DE72381D9835A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(C(C)C)S2""",21,"""E2461D15B4E1CF00"""
-"""1EB3AF523DE2A173_51064730996A0335_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOC2CCOCC2""",21,"""E2461D15B4E1CF00"""
-"""EC40404D9F3604C7_B6C197BCADA8AEA1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=NS2)C(C)C""",21,"""E2461D15B4E1CF00"""
-"""91512E0D2ECCC88A_3716C590B2C3D605_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC3CC2(CCC2)CO3""",21,"""E2461D15B4E1CF00"""
-"""DC100CB111FF3C89_4EABF9CFF9648AC9_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC3[N]2N=CN=C2CC3""",21,"""E2461D15B4E1CF00"""
-"""FAB6839CF0084E6F_603A03DD27428BC2_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)NC2=NC=C[NH]2""",21,"""E2461D15B4E1CF00"""
-"""16E576E99C2306EE_63784104817ADA62_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=COC(=N2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""96E450C57A60C58A_761A78A26B0CA4EE_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2CCC(C)(C)CO2""",21,"""E2461D15B4E1CF00"""
-"""E6A17A1DB9F21FA0_280BF923F63C7BF1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C(OCC)=O)=NO""",21,"""E2461D15B4E1CF00"""
-"""B347258067C7349E_8F451F9091696C69_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2CCCC(C)(C)O2""",21,"""E2461D15B4E1CF00"""
-"""FE8EDCF3FBAB38B9_D4E6CF5049446B3D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C([N](N=C2C)C)C""",21,"""E2461D15B4E1CF00"""
-"""148E37147EB5CD0D_3FEC78C3E897CD80_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=NS2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""10EF70860169D14B_9A32EC8B6A3A312F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC3CCC2(CCC2)O3""",21,"""E2461D15B4E1CF00"""
-"""42863BA04C4264EE_94DC41BF3FEB61BE_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(CC(OCC)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""22733DF9218728E6_FD734A3583E1ADAF_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCSC2=CC=NC=C2""",21,"""E2461D15B4E1CF00"""
-"""45158D36E427514E_89FFEE3E3633FE85_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NCC(C)(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""6B37FEE9033F8AD0_C8D7C4C851C615A1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC3CC2CCCC2O3""",21,"""E2461D15B4E1CF00"""
-"""43B439281C795977_DCE6D8597D316E19_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C)C(NC2=O)=O""",21,"""E2461D15B4E1CF00"""
-"""32B76B3B8FFDB033_A0AFF77E8414D82B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2CCC(O2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""978ACD9F7138137F_DE3CE671379E1A3E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=COC(=N2)C(F)F""",21,"""E2461D15B4E1CF00"""
-"""B27623A370F1E112_7CCD34DED4776F40_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCCCCCCC""",21,"""E2461D15B4E1CF00"""
-"""185AA196CFB92C80_48129B61936766A9_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2=CC=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""D8EAA94A489002BD_5A86B3086AE5FCCF_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCCCNC(C)=O""",21,"""E2461D15B4E1CF00"""
-"""AE8EC5B54877CF48_5814FC6162C865FC_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=CN=C2)C#N""",21,"""E2461D15B4E1CF00"""
-"""5F387F042902825A_63965075DE324F2E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NC(COC)C)=O""",21,"""E2461D15B4E1CF00"""
-"""F8BB1E776C30F41F_E8978AAA691A3772_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NC(CC)CC)=O""",21,"""E2461D15B4E1CF00"""
-"""C4449F95449E841A_6B69883B91797F73_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NCCCOC)=O""",21,"""E2461D15B4E1CF00"""
-"""4B9AE97AE454D157_F7EC02BD133CFA8C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NC(CCC)C)=O""",21,"""E2461D15B4E1CF00"""
-"""C20EC663F9FB969E_E318AC7E7C80A7FB_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NC(C(C)C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""23CC6BE96F998179_9B6102229C53F51B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=NN=C2C)C""",21,"""E2461D15B4E1CF00"""
-"""B2FBF6B3164332D4_EB4878DCAE7504F2_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=CC(=C2)OC""",21,"""E2461D15B4E1CF00"""
-"""CC027234412A4A1B_043070264F5E9B24_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CSC(=N2)C(C)C""",21,"""E2461D15B4E1CF00"""
-"""BE900E1B1D84076F_D391F276853DA473_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=C(S2)C)OC""",21,"""E2461D15B4E1CF00"""
-"""7F41F0243EA4147F_4BF3A8BA8FE5A14C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=CC(=C2)C)C""",21,"""E2461D15B4E1CF00"""
-"""C3DB98E5D4F84901_FB797D3DEC11AF52_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C[N](CCF)N=C2""",21,"""E2461D15B4E1CF00"""
-"""6F1FB96C11012D11_85A67B5CBBD5AC4F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=CC=CC(=C2)F""",21,"""E2461D15B4E1CF00"""
-"""A951D86D77013710_087338C87FA48005_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC(COC)COC""",21,"""E2461D15B4E1CF00"""
-"""14F9B3647032B1A2_20F49E4E822250B7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=C(C)C=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""A20C1B0B6E58C001_AE50DB52B6EAD0D0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=CC=C(F)C=C2""",21,"""E2461D15B4E1CF00"""
-"""C58D31C9DCDB7F3F_293DD75B4C5F7D76_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2CCCCC2""",21,"""E2461D15B4E1CF00"""
-"""EA13FD7C06DFF7CB_E863F489D0FBD5A0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2CC3CCC2C3""",21,"""E2461D15B4E1CF00"""
-"""CD5C1E2009755C1C_920621080EEE5A9E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC3CCC2(COC2)O3""",21,"""E2461D15B4E1CF00"""
-"""B6314A5CD3CADDE3_6B42CFA20C179990_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(F)C=NC=C2F""",21,"""E2461D15B4E1CF00"""
-"""E3FAE83F7913C7CC_38B3BDB956355DF1_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CCC2(C(O)=O)CCC2""",21,"""E2461D15B4E1CF00"""
-"""1846F5F3B5B16549_D44D54E466C2C6F4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(CF)C=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""15F106CA4868E9A7_53A208310F0FC6A7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOC2CCSCC2""",21,"""E2461D15B4E1CF00"""
-"""2A98FB5B0E4AE4E4_0B59C660CC61B154_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C(OCC)=O)(F)F""",21,"""E2461D15B4E1CF00"""
-"""DDE5615A1AD0525E_560ADDC93FD47EB7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CON=C2C(C)C""",21,"""E2461D15B4E1CF00"""
-"""B0F017199A17D5C1_AD999C4CAFAD08C3_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CON=C2C3CC3""",21,"""E2461D15B4E1CF00"""
-"""0648FCCE0F37ED89_27E94F61BCE4D811_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=CN=CC(=C2)F""",21,"""E2461D15B4E1CF00"""
-"""F6167449B48ADBFB_02B4D031E486D817_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2OCCC23CCC3""",21,"""E2461D15B4E1CF00"""
-"""D634CF9D9E156730_9AF998483B626015_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C=C(C)C=C2)F""",21,"""E2461D15B4E1CF00"""
-"""955E9D41777D1076_D82C17E9C61A5465_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)C2CCCCO2""",21,"""E2461D15B4E1CF00"""
-"""20079E1FAC0761A9_41D8BEE460031077_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)C2=CC=NC=C2""",21,"""E2461D15B4E1CF00"""
-"""E014F91ED41A1976_C297999306779C8F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2N(C)[S](CC2)(=O)=O""",21,"""E2461D15B4E1CF00"""
-"""A2AB94C037E3C86F_164A1095B54D1637_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOC2(CCC2)C#N""",21,"""E2461D15B4E1CF00"""
-"""A1C643BC450C0EFA_9732A064C56856BA_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2NC(CC2(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""1BF434F2D28B1818_0627F7983615E83D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2OCC3CCOC23""",21,"""E2461D15B4E1CF00"""
-"""1051A6A49B0FE9A3_F95215B82E3B510C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2COCC(C)(C)O2""",21,"""E2461D15B4E1CF00"""
-"""14F0A9BC10DE486B_C7E10DADA7AFFFE8_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC2OCCC23CNC3""",21,"""E2461D15B4E1CF00"""
-"""326F758893E107E0_75C74E05E28E527F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)C[C@@H]3C[C@H]2COC[C@H]2O3""",21,"""E2461D15B4E1CF00"""
-"""3D773904F23A949A_FBA36B64CBCF487A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC#CC2CCCCC2""",21,"""E2461D15B4E1CF00"""
-"""DE9155CB51B1ED13_6E89A3E50B208F2F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCSC2CCOCC2""",21,"""E2461D15B4E1CF00"""
-"""04712BB36EB96DBD_A788FFB62343AF73_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=C[N]2C(C)C""",21,"""E2461D15B4E1CF00"""
-"""7E7DEF27B68102C8_27F4F6A7122566D8_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC(OCC)OCC""",21,"""E2461D15B4E1CF00"""
-"""9136C795DD106875_BE85F63B08E5571E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2CCCC(C)C2""",21,"""E2461D15B4E1CF00"""
-"""79F491C9FBEC06C9_379265B141D59912_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=C(O2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""7A2CDCAD35708E4F_F35702CD2FEB43B1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=NC=C2)OC""",21,"""E2461D15B4E1CF00"""
-"""02FC02DD6A3CAB6C_B07C41478DDF815D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(CC)[N]2C""",21,"""E2461D15B4E1CF00"""
-"""C82F29B77D34477E_678967BDB951ACF7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CN=C(N(C)C)S2""",21,"""E2461D15B4E1CF00"""
-"""C196FD0CEB0BD4B7_3E96B1A586F56827_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)NC2=NN=N[NH]2""",21,"""E2461D15B4E1CF00"""
-"""D97F1857EDAD0106_6D06DD001548DCF7_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CCC2CCCNCC2""",21,"""E2461D15B4E1CF00"""
-"""4106E1BDE12030E1_C9E778B6295D62E5_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOC(NC(N)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""164583DAC61104B8_9C99DAE1AC22DCAE_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=C(CC)C=C2""",21,"""E2461D15B4E1CF00"""
-"""07F27C37BF066494_F1209E3A2EF33590_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)N2CCCCC2""",21,"""E2461D15B4E1CF00"""
-"""BAB4383831CAE8BC_157CF3B722444C18_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC(C)(C)C(F)(F)F""",21,"""E2461D15B4E1CF00"""
-"""2D90A5882B2D2CDD_0537F9B0BE06D9F0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(F)C(=NC=N2)Br""",21,"""E2461D15B4E1CF00"""
-"""F3AA5F9C93FCAA60_581496BC306C8A75_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CSC3=CN=C[N]23""",21,"""E2461D15B4E1CF00"""
-"""7BD4D8116CD437F2_8C911E1FFE4403F0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=C[NH]2)C(O)=O""",21,"""E2461D15B4E1CF00"""
-"""2F7254F4E56289D4_30A86F673618A6DB_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2CC(F)(F)C(N2)=O""",21,"""E2461D15B4E1CF00"""
-"""2365D765911E3FB2_915094E487C97CF0_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=CO2)C(O)=O""",21,"""E2461D15B4E1CF00"""
-"""1BBC9164A11A51BD_81ED5109D374FA57_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC(NCCC)=O""",21,"""E2461D15B4E1CF00"""
-"""B8B9889296FAF8E4_AFCF7DFF6B34B947_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=NO2)C(F)F""",21,"""E2461D15B4E1CF00"""
-"""55A353A6FDC2A283_DB954B1EF4C97D40_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C[N](N=N2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""EF14254CFB68475E_BC20013C2C9B6ADF_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=NOC(=C2)C)=O""",21,"""E2461D15B4E1CF00"""
-"""D50039F0013FB251_58F35484C47E2769_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC2=COC(=N2)[C@H](C)N""",21,"""E2461D15B4E1CF00"""
-"""852E93216C2CDB2D_763C8BE7C5AB5C8B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C(F)F)OC=N2""",21,"""E2461D15B4E1CF00"""
-"""9717988BA6EC89E6_79BBCBDB3E64428F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C(C)C=CO2)=O""",21,"""E2461D15B4E1CF00"""
-"""AFB2673923A4695A_539ED3C857D02183_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C(C)C=CS2)=O""",21,"""E2461D15B4E1CF00"""
-"""28C94DFDC128C60F_CBDFC86D8A73D694_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(COC)O2""",21,"""E2461D15B4E1CF00"""
-"""00CFE98D1F43277A_EED069A66DDF6B3E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=CC(=CS2)C)=O""",21,"""E2461D15B4E1CF00"""
-"""D2CB99EB01E63AE0_51C345E5EAB8A86B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=CON=C2C)=O""",21,"""E2461D15B4E1CF00"""
-"""109F449C3489C626_EE22B6CD06A96F97_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NOC=C2C(O)=O""",21,"""E2461D15B4E1CF00"""
-"""39E267908BEB0B5B_913617AFF2DEBDB7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCO[P]2(=O)CC=CC2""",21,"""E2461D15B4E1CF00"""
-"""882BE4D48BC03BD4_021EF4E8AD0E9B73_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC2=COC(=N2)[C@@H](C)N""",21,"""E2461D15B4E1CF00"""
-"""CE817EF944DC676B_FCB542BB69B2B18C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2(CCC#C)N=N2""",21,"""E2461D15B4E1CF00"""
-"""56D7ECD74546E7FE_BB51380504E3912A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2CCCC(=O)O2""",21,"""E2461D15B4E1CF00"""
-"""6F9C147682E9AD86_166C52CE90B71D5D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2CCCCCC2""",21,"""E2461D15B4E1CF00"""
-"""9718FC746291BDF4_D21D5607A9810E53_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C(C)N=NS2)=O""",21,"""E2461D15B4E1CF00"""
-"""BE6A034A7B8F1067_39A4F8EF5B08F7D7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C(C)N=CO2)=O""",21,"""E2461D15B4E1CF00"""
-"""9F8A99E9665B3B31_2753E5A5D1DA5686_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C(C)OC=C2)=O""",21,"""E2461D15B4E1CF00"""
-"""135B6B2E6B2E8FBE_E8EF35BE6401CAD6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NOC(=C2)C(O)=O""",21,"""E2461D15B4E1CF00"""
-"""B907A364408674B4_3AB6A4C42A41C332_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C(C)N=CS2)=O""",21,"""E2461D15B4E1CF00"""
-"""4EA5517BA6032B08_A52A6E371D861CC4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(F)C2=CC=CC=C2""",21,"""E2461D15B4E1CF00"""
-"""BC4FD6AA6543F078_941B21E8627F8F39_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CON=C2COC""",21,"""E2461D15B4E1CF00"""
-"""4CE99A63C1AB40BF_DA126A877C8F87C5_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CN=CC(=N2)OC""",21,"""E2461D15B4E1CF00"""
-"""A7755D5EF055FCA9_EABB351644E03652_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2OC(CC2(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""0BB2B07C37BAE6BB_7AA6487FECA48F40_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(CCCCCC)=O""",21,"""E2461D15B4E1CF00"""
-"""920E3605C3F20C02_09C0B527337F54B6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=CC(=C2)F)F""",21,"""E2461D15B4E1CF00"""
-"""E366878F407FCBF0_9E1227BF87AE9621_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=C[N](CC)N=C2""",21,"""E2461D15B4E1CF00"""
-"""0E0E71B2F5E73FB2_84DE3E99E59A0E89_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC3CC2(CC2)C(=O)O3""",21,"""E2461D15B4E1CF00"""
-"""5A8D4702239454E4_B78B4E8B112A9EE4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCCC[S](Cl)(=O)=O""",21,"""E2461D15B4E1CF00"""
-"""71AB0B77FC0CF2D3_7EC43F84BA88C9CB_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC3CC2COCC2O3""",21,"""E2461D15B4E1CF00"""
-"""D31257324D84661B_42E3F915C7274F2D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CN=C(C(C)C)S2""",21,"""E2461D15B4E1CF00"""
-"""1DB454CCC966884A_BA0E5539CFD84685_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(CC[S](C)(=O)=O)=O""",21,"""E2461D15B4E1CF00"""
-"""DC200D8D2268B68F_516794D075C6DC3A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=C(C=C2)F)C""",21,"""E2461D15B4E1CF00"""
-"""025BF8CBB2628019_13CEC1456919F84B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2N(C)CC(C2)(C)C""",21,"""E2461D15B4E1CF00"""
-"""1D08248E42306DA7_FE83CC60E48FB66A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2CC(F)(F)C2)=O""",21,"""E2461D15B4E1CF00"""
-"""844DB4E9C52F6757_83E900F7F668FC20_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=C(C=C2)C#C""",21,"""E2461D15B4E1CF00"""
-"""BA9B815AE9FF3B46_4D0806133AD37B2D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC(=O)N2CCCC2""",21,"""E2461D15B4E1CF00"""
-"""4695083E95D43093_2D6152776061E30B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=CC=C2)C#C""",21,"""E2461D15B4E1CF00"""
-"""095F3DF9D45BBC90_805DDDDB85B8841C_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC([C@@H](N)C(C)(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""55DD4485B392E399_3DA786287E2A8CC0_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CCCN2CCNCC2""",21,"""E2461D15B4E1CF00"""
-"""F34973201E8C2C7C_BFB72220343B2887_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NOC(=C2)COC""",21,"""E2461D15B4E1CF00"""
-"""48993353D1B51361_0C46BCB335D926C6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2OCCCC2(C)C""",21,"""E2461D15B4E1CF00"""
-"""940753CFB02307A9_83A7CB08537270F9_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2(CC2)[S](=O)(=O)Cl""",21,"""E2461D15B4E1CF00"""
-"""746844E88A9CAE18_BCB40BB4CF948D0B_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CCOC2CCNCC2""",21,"""E2461D15B4E1CF00"""
-"""7512F8228D10713C_BAF9EE2170C3142E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC(N(CC)CC)=O""",21,"""E2461D15B4E1CF00"""
-"""20EC627D09190C21_E51042177D9640E1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(NC(CC)(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""A49FAF1B1BBD151C_6A18432D58403C97_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=C[N](CC)N=N2""",21,"""E2461D15B4E1CF00"""
-"""3C6E5AB26A29F1A9_A24CC5757E5B695B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=CC=CC(=C2)C""",21,"""E2461D15B4E1CF00"""
-"""1E87B74647668A75_271142D3E3F49940_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN(C)CC(F)(F)F""",21,"""E2461D15B4E1CF00"""
-"""6D2F7D911CCE4FF2_E17DAEA6BE64CF9C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2CC(C(C)C2)C""",21,"""E2461D15B4E1CF00"""
-"""63F996F9E6B45471_F3DC0F1E287B9D36_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=N[NH]C(=C2)C(C)C""",21,"""E2461D15B4E1CF00"""
-"""42E1516BC19699B8_2FC938F5EB5689E1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2C[C@H]([C@@H](C)C2)C""",21,"""E2461D15B4E1CF00"""
-"""466592BF324F0393_949FC4CF7F5723EC_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C[N](C)C=N2)=O""",21,"""E2461D15B4E1CF00"""
-"""70023E66C928A5A1_171E47D92F78FCD2_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(OC)C=CC=N2""",21,"""E2461D15B4E1CF00"""
-"""FE45AFA207E7D32D_DF036B3FE011A498_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(N=CC(=C2)C)F""",21,"""E2461D15B4E1CF00"""
-"""CD9FADF1D4B7C228_E3A787A30FDB9D9B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2CC(F)(CC2)F""",21,"""E2461D15B4E1CF00"""
-"""7ED297D5135FA514_E2FE2C90DEABD17C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=NC=C2)C#N""",21,"""E2461D15B4E1CF00"""
-"""C5560B1BDEE25F97_D7E3E176CBC9E7E4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOC(C)(C)C(=O)O""",21,"""E2461D15B4E1CF00"""
-"""B6DEC7EC571C35D1_EB8762C0FC8F25FD_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC3CC2OCCC2O3""",21,"""E2461D15B4E1CF00"""
-"""B76003D2C9E4497A_7E0D32DB9CCBD6B8_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=CC=C(C)O2)=O""",21,"""E2461D15B4E1CF00"""
-"""AB6E96080ED41612_18A2562B25A13658_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2(C(O)=O)CC2""",21,"""E2461D15B4E1CF00"""
-"""CD4A81B577034366_D347D8F30687BFDE_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(COC)OC=N2""",21,"""E2461D15B4E1CF00"""
-"""E426600F3883102D_A58E87E2B9231603_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2CC(C)(C)OC2""",21,"""E2461D15B4E1CF00"""
-"""9889E19DD088BE1F_AF55183C0D8E2219_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2NC(=O)NC2=O""",21,"""E2461D15B4E1CF00"""
-"""9EE7049CDB0C9685_67A2C5A9DDE635FB_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NO[C@@H]3COC[C@H]23""",21,"""E2461D15B4E1CF00"""
-"""E213C0AC344989CF_53EE55596C995198_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2CCCNC2)=O""",21,"""E2461D15B4E1CF00"""
-"""0381405136F45F7D_C0998F7F19CCD49B_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=NO2)COC""",21,"""E2461D15B4E1CF00"""
-"""7D05AF48A9AB5F29_A6A8628566E97972_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NOC(C(O)=O)C2""",21,"""E2461D15B4E1CF00"""
-"""B2F9781AD3DC807B_9792E80DBBB73F65_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC(=NC=N2)OC""",21,"""E2461D15B4E1CF00"""
-"""F9CFB8BF84BF2DD6_A1EFEDEFA2BE8D2B_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(CCN)OC=N2""",21,"""E2461D15B4E1CF00"""
-"""180EF534273D48D3_C4F11E192A96A6C8_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2=CN=C(C)C=C2""",21,"""E2461D15B4E1CF00"""
-"""B42E99DEBF9FF259_325EDA51D9B0CF90_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(C)C=C(N=C2)F""",21,"""E2461D15B4E1CF00"""
-"""EAA7C55DD01D9489_EAAE47AD7ED72277_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC2CNC(CO2)(C)C""",21,"""E2461D15B4E1CF00"""
-"""C643F20AA443548E_7BEB68B3AD36A89E_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2CCNCC2)F""",21,"""E2461D15B4E1CF00"""
-"""9C1290FC2DED35EC_CEEF50999D0AF8EB_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOC(C#N)C2CC2""",21,"""E2461D15B4E1CF00"""
-"""EDB0180F9BD2B436_7DAE06BE33DCD6B7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2CC(=NO2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""F82464B6492A2A63_C0E87FF66EE56C72_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CC=NC(=N2)OC""",21,"""E2461D15B4E1CF00"""
-"""29A0DF0283CB493C_4B906B06A0FE67F6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(ON=C2OC)C""",21,"""E2461D15B4E1CF00"""
-"""3E063E20A01A8468_7EBBF429793D2D11_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOCC(OC)OC""",21,"""E2461D15B4E1CF00"""
-"""AEDA4AAB44F9B31C_40B95D556A7466D3_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC(=CC=C2)C#N""",21,"""E2461D15B4E1CF00"""
-"""FAF20677BA3D3C79_2E9F28AA34CE6427_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NNC(=O)NC2=O""",21,"""E2461D15B4E1CF00"""
-"""9CCB1C22E828E0C1_CDDBB281B5E96DAC_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=N[NH]C3=C2CCC3""",21,"""E2461D15B4E1CF00"""
-"""A991AD5773D8EDCB_BBD2C08C7DB1C53D_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2CCN(C)CC2""",21,"""E2461D15B4E1CF00"""
-"""2E082AB54CB417C0_B6B268C8CE9F72C8_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NOC(=C2C)CC""",21,"""E2461D15B4E1CF00"""
-"""3CC29BB5C3F155CD_462CF7288A7A96DB_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)C[C@H]2CNCC(O2)(C)C""",21,"""E2461D15B4E1CF00"""
-"""D1F3D4D0BABD7CA7_20A1B8294E6A4E9F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NOC(=C2)C(F)F""",21,"""E2461D15B4E1CF00"""
-"""9004B17D8C9B1459_5A8197FB9E0BCEC7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(F)C2CCOCC2""",21,"""E2461D15B4E1CF00"""
-"""6B8E09611983E5DF_4C39B52FA34939BF_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)C[C@@H]2CNCC(O2)(C)C""",21,"""E2461D15B4E1CF00"""
-"""A88D371D1C1B3D21_CF03D3B830342CB4_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2=C(C)OC=N2)=O""",21,"""E2461D15B4E1CF00"""
-"""F50917B05B88E20F_F692B70D167B86DA_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=N[N](CCF)C=C2""",21,"""E2461D15B4E1CF00"""
-"""C87061CECB165B8F_A1E86FDAB3377DA8_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=CN=C(O2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""76B58266B2CC7366_CE60773FD2D06BE1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(N(CC)C(C)C)=O""",21,"""E2461D15B4E1CF00"""
-"""D296B448BC2A3220_9B488384C1233D8F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C3[N]2CCC3""",21,"""E2461D15B4E1CF00"""
-"""22EC4AAFCDB78996_9D14F2E3FD05FC7A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCOC2CCOC2""",21,"""E2461D15B4E1CF00"""
-"""4927DC8ABE99C8ED_818E5455EE906C60_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2CCC(F)(F)CO2""",21,"""E2461D15B4E1CF00"""
-"""FBDE53519BB42F17_E33D3AE164166D9E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(OC)C2CCCC2""",21,"""E2461D15B4E1CF00"""
-"""0A10FBA21687FDB1_34B68D625C7E02F1_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2CC[S](=O)(=O)C2""",21,"""E2461D15B4E1CF00"""
-"""566948E89497ABD3_564E5A940CACA31E_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NN=C(C(C)C)O2""",21,"""E2461D15B4E1CF00"""
-"""7905B23FD9A4005A_A8E5D0E5F3B95861_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NC=N[N]2CCF""",21,"""E2461D15B4E1CF00"""
-"""6946F49114C1517F_D05D54E53F9A281A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCCC(C)(C)C#N""",21,"""E2461D15B4E1CF00"""
-"""ED202A1710A1E9C0_3377A867661A3EA6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=C(CC)ON=C2C""",21,"""E2461D15B4E1CF00"""
-"""D7CF623886F01EE4_022C9A96D495EBD7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC(=O)C2COCCO2""",21,"""E2461D15B4E1CF00"""
-"""EF9DED9C56D40294_175D321A373C11C6_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2CCCC2(F)F""",21,"""E2461D15B4E1CF00"""
-"""A559A046F0D1A093_136C2CE7AB3B35C4_6039_DP""","""O(CC1CCCC(C1)C(F)(F)F)CC(C2CCNCC2)=O""",21,"""E2461D15B4E1CF00"""
-"""F859FAE6A91F5FC9_D743F15866A223E2_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2OC(=O)CC23CC3""",21,"""E2461D15B4E1CF00"""
-"""EEDF05634E306E9C_7734F1285A2514CB_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2CN=C(O2)C3CC3""",21,"""E2461D15B4E1CF00"""
-"""77143C68BF2ED928_350F0DBF6596612C_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCCC2=CC=NC=C2""",21,"""E2461D15B4E1CF00"""
-"""169E36DE8C4A6D0E_A1E43FC9B3E0068A_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2N=C(C)OC2=O""",21,"""E2461D15B4E1CF00"""
-"""3BA925C15DD3E9DE_242BDD67028304DA_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCC2CCC(C)CC2""",21,"""E2461D15B4E1CF00"""
-"""FEB7275C95BC60DD_C154112F5A4DA08F_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CC2=NO[C@@H]3CCC[C@H]23""",21,"""E2461D15B4E1CF00"""
-"""36A582F0767880C7_F8BDC3D529FF08FD_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCN2C3CCC(C2)C3""",21,"""E2461D15B4E1CF00"""
-"""7198E0B9AAAC0961_63B051C1B31B6AC7_6039_UN""","""O(CC1CCCC(C1)C(F)(F)F)CCOCCOCC#C""",21,"""E2461D15B4E1CF00"""
-"""E8941DA0A5B029E0_83FD70AFC3350152_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCCCCCC""",21,"""55F494B59E408B31"""
-"""A1E54C6C4B360DC1_3A4E3E81123CE84F_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(=O)C3=CC=C[NH]3""",21,"""55F494B59E408B31"""
-"""B83BC3A59AE2274E_3DE8F3205A3FB9CD_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(NC(OC)=O)=O""",21,"""55F494B59E408B31"""
-"""1C3C622D2F48CAD7_93CEDCA40CB686A4_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(NNC(C)=O)=O""",21,"""55F494B59E408B31"""
-"""584F75EFBDB81ECA_3D2D1877E0AD216D_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCOCC(F)(F)F""",21,"""55F494B59E408B31"""
-"""E407802CECED3AB0_8C5901C0C4F743B3_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCCOC(C)=O""",21,"""55F494B59E408B31"""
-"""FE864B3545882CFC_AF561F75A003273E_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(C(OCC)=O)=C""",21,"""55F494B59E408B31"""
-"""9205C77BEF9748E4_FD09CD0D78A001CC_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=CSC(=N3)CC""",21,"""55F494B59E408B31"""
-"""E8F376A2ABFBFAC5_5378187B56788531_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NC(=NO3)CC""",21,"""55F494B59E408B31"""
-"""735D9660836648AD_1350F69EFCE90488_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(N(C(C)C)C)=O""",21,"""55F494B59E408B31"""
-"""EB9989DFB11000F8_E881893F9D53EDA4_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(NC(NC)=O)=O""",21,"""55F494B59E408B31"""
-"""9F6E2E79941FE7BC_4491BE64AFD84803_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC(NC(C)C)=O""",21,"""55F494B59E408B31"""
-"""C884A07DF1175D5F_E14EF339C50CB488_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCN3CCCC3=O""",21,"""55F494B59E408B31"""
-"""DFB204B9207425C4_72E7DAB3F24F8D17_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCOC3CCCC3""",21,"""55F494B59E408B31"""
-"""7141CA006FE73D6C_F820C33EA2E83ED5_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCC(N(C)C)=O""",21,"""55F494B59E408B31"""
-"""8355F8735943C3AF_7C653D030E76C4E0_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NOC(=N3)CC""",21,"""55F494B59E408B31"""
-"""3BCA889C0D94FCC9_B1825EBA5A0613D1_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCN3CCCCC3""",21,"""55F494B59E408B31"""
-"""BE971F5F281EB6A7_8AF7641C50F1632A_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC[N]3C=CC=N3""",21,"""55F494B59E408B31"""
-"""B283EEC8036A91DB_B20B75BC1DBF094B_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC[N]3C=CN=C3C""",21,"""55F494B59E408B31"""
-"""FEF853DF5C229CE8_200C502C16B4E366_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NC(=C(O3)C)C""",21,"""55F494B59E408B31"""
-"""F74C1A9C15D15851_B32C90076D13AE1F_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCOCCC(C)C""",21,"""55F494B59E408B31"""
-"""47FB91B902F1B82C_8D2595808AF97BE1_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCN3CCCC3""",21,"""55F494B59E408B31"""
-"""371A05E56057A766_787A1CACAAB49E8D_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC[S](CCC)(=O)=O""",21,"""55F494B59E408B31"""
-"""C6D2DCE5AB30485A_0256C687A237B295_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=C(C)SC(=C3)C""",21,"""55F494B59E408B31"""
-"""4002BBF678E43E0C_65466BF308C664DD_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3COC(C)(C)O3""",21,"""55F494B59E408B31"""
-"""13C4A0C6F040265D_E9572EE21D0CB017_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3OCCN(C)C3""",21,"""55F494B59E408B31"""
-"""6059C82511FA35DC_26AAEEAF9879CFB6_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=[N](=O)C=CC=N3""",21,"""55F494B59E408B31"""
-"""D54CF37637FA593B_D8D22A303ADBC839_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3=C(C)N=CS3""",21,"""55F494B59E408B31"""
-"""1C6FC07EBBA6C297_8CB097610A275446_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCN3CCOCC3""",21,"""55F494B59E408B31"""
-"""C0C4D57635858A0F_819E9C5F53EF63BE_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCN[S](CC)(=O)=O""",21,"""55F494B59E408B31"""
-"""0F1FBD85AFCC400B_9ED0FA773DED9338_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=CN=C(C)C=N3""",21,"""55F494B59E408B31"""
-"""81B0778D717A1DE5_D97F20A67D039C89_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC(OC(C)C)=O""",21,"""55F494B59E408B31"""
-"""A33A89455138A818_288CD39F8C7A25D3_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NC=C(CC)O3""",21,"""55F494B59E408B31"""
-"""0038DE9B67A051F7_B76781A77797CEA5_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3ON=C(CC)C3""",21,"""55F494B59E408B31"""
-"""29ED6FBEEFCC24B2_CC3F9C27798CE258_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3NC(OC3)(C)C""",21,"""55F494B59E408B31"""
-"""54B96D9220FB5FA2_72BBF1E6A294F34A_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC[S](CC)(=O)=O""",21,"""55F494B59E408B31"""
-"""37D4D6863E8754E9_A0BBFB38D7C40830_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCNC(=O)C3CC3""",21,"""55F494B59E408B31"""
-"""80A605DD81DCBF32_CF5332EFC542F646_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3CCOC3=O""",21,"""55F494B59E408B31"""
-"""5FA5DB86AC9FE5E1_0D485921273AE564_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3CCCCC3""",21,"""55F494B59E408B31"""
-"""2EAFDA6C1EAE561D_6C33FFCCBEE55DA9_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCC(OC)OC""",21,"""55F494B59E408B31"""
-"""0D5C7A8A593C5B1C_98B979226938BC8A_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=C(C)OC(O3)=O""",21,"""55F494B59E408B31"""
-"""2BE185288B0459F0_3AC89AB412F461BA_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(N(C)C3CC3)=O""",21,"""55F494B59E408B31"""
-"""06D6F09558DC6307_91A7FEB6C7847AF1_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCN(CC)CC""",21,"""55F494B59E408B31"""
-"""E084173F88F14F88_25C9D2308B1B4BE8_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3=C[N](C)N=C3""",21,"""55F494B59E408B31"""
-"""7B5A834E453532A4_F33C4C1C91843E92_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=CN=C(C)C=C3""",21,"""55F494B59E408B31"""
-"""03CE706B1CB1DD58_025DE3D161097538_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCC[S](C)(=O)=O""",21,"""55F494B59E408B31"""
-"""E52986EA4A5F2162_96F246ACBFEF21C0_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=CC=CC(=C3)N""",21,"""55F494B59E408B31"""
-"""9B751588D9A10938_13F268E3E8C6A9A3_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3N(C)CCC3""",21,"""55F494B59E408B31"""
-"""E40C49C721A91212_A0BB881FBFFD9AFE_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCN3CC(C)CC3""",21,"""55F494B59E408B31"""
-"""FEC6917B3B0B552C_364DA567D1436AD9_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCN3CCSCC3""",21,"""55F494B59E408B31"""
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-"""36BC87C9F622FCCB_57EAE6787C267258_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3CCCCCO3""",21,"""55F494B59E408B31"""
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-"""C40B244D98B0E69C_0BBC6A4FDE8D1117_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3N(C)CCCC3""",21,"""55F494B59E408B31"""
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-"""408FC21E702B67BB_AC367DAFD367AD72_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCC[S](N)(=O)=O""",21,"""55F494B59E408B31"""
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-"""8AF5948B04FD8CC2_E98CF9ADBEF9144E_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCCCC3CC3""",21,"""55F494B59E408B31"""
-"""0987534BC2C66558_423DB7AD9F2AC365_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3CCCCO3""",21,"""55F494B59E408B31"""
-"""0606EEEB3B24E232_7BE11B910EF39BDD_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCC3=CON=C3""",21,"""55F494B59E408B31"""
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-"""575EBF93CD3BD0C0_4845CD24C985D504_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCC3=CSC=C3""",21,"""55F494B59E408B31"""
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-"""1D432B7747F2B529_B9464CD96D775FCB_6039_UN""","""C[C@@H]([C@H](OCC(NOC)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""037C4AD519B363E1_06C3C5619F5AC4AD_6039_UN""","""C[C@@H]([C@H](OCCC(OC)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""C790D5FE7D3592A7_83C49E49D1E1E21C_6039_UN""","""C[C@@H]([C@H](OCC(OC)OC)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
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-"""DD6F2C336DD3FEB3_0A4BD37600335CDF_6039_UN""","""C[C@@H]([C@H](OCC1OCCO1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
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-"""19EF22D942941C66_922278FBA51A8ACC_6039_UN""","""C[C@@H]([C@H](OCCC(NC)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""2ADF7EC1E65BBF86_CFC57CBFC0A6029C_6039_UN""","""C[C@@H]([C@H](OCCCN=C=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""809F7B558B62B252_3BBF17FC14183AF8_6039_UN""","""C[C@@H]([C@H](OCC1=NC=NO1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
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-"""DE7211C02D9BC0BF_254440CDECE4A78A_6039_UN""","""C[C@@H]([C@H](OCC(CCC)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""B3FC67FAEC9172B6_AD30066271230A1E_6039_UN""","""C[C@@H]([C@H](OCC(C(C)C)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""2C4C95C9642EE5A2_B79DCE81FD971079_6039_UN""","""C[C@@H]([C@H](OCCCCOC)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""1FAFC0698477429E_6C639E9FAEBA9436_6039_UN""","""C[C@@H]([C@H](OCCCN(C)C)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""A356B6A1065279B3_A7D24832F1F45F89_6039_UN""","""C[C@@H]([C@H](OCCCOCC)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""A1B9C101EAB9E181_8C6E4D9982E90A9F_6039_UN""","""C[C@@H]([C@H](OCCCC(C)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""7E3701BC7AE4E843_4ED929D0CFF8434A_6039_UN""","""C[C@@H]([C@H](OCC1=NOC=N1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
-"""452366D72474128C_14DF3EA0DC39FC43_6039_UN""","""C[C@@H]([C@H](OCCC(C)(C)C)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""64F1C05E38C2B187_A1F2108716244397_6039_UN""","""C[C@@H]([C@H](OCC1=CSC=N1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
-"""AC4B465053CFE657_3BFCD3EF650DC5DA_6039_UN""","""C[C@@H]([C@H](OCC1=NN=N[NH]1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
-"""9DBAE8F6276EC688_3C6B2D99A1A131DC_6039_UN""","""C[C@@H]([C@H](OC[CH]=[C]1C[CH2]C1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
-"""B7AAAFEC7BF2D2AF_304E71B3E7362CA4_6039_UN""","""C[C@@H]([C@H](OCC(N(C)C)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""18727FDD9931BF92_3E55D93B77022719_6039_UN""","""C[C@@H]([C@H](OCC#CCOC)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""9D9D4CA858FB6356_8A90C153676C4598_6039_UN""","""C[C@@H]([C@H](OCCC(Cl)(Cl)Cl)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""E40964238C71B1E6_15EF211CF46E84D0_6039_DP""","""C[C@@H]([C@H](OCCCC(O)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""B8BC4217FB26C554_BAFBB3B8CE8A5098_6039_UN""","""C[C@@H]([C@H](OCC1=C[NH]C=N1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
-"""8039D2F350F833BD_1D38BFD8FD30E5EC_6039_UN""","""C[C@@H]([C@H](OCCC=CCC)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""BAE0FDD4E7241FBD_75C95869007A32DF_6039_UN""","""C[C@@H]([C@H](OCCCC(C)C)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""3836EC6CCA3CC52D_9544E5A8E7A63FF1_6039_DP""","""C[C@@H]([C@H](OCCOCCN)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""19E407F626FF2F9A_3D9A3FF5ECEF3632_6039_UN""","""C[C@@H]([C@H](OCCC(NO)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""89763BC49C588B17_B7AE80DE5006A6F5_6039_UN""","""C[C@@H]([C@H](OCC1=C[NH]N=C1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
-"""A84145743CDEFF7B_AC73EEE7E94E6A96_6039_UN""","""C[C@@H]([C@H](OCC[S](C)(=O)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""51DEC9AE1E26C14B_7F0CD0AD93620770_6039_UN""","""C[C@@H]([C@H](OCC(COC)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""AC04F327E5F4C494_EDDBA28F9C834EFA_6039_DP""","""C[C@@H]([C@H](OCCC1CNC1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
-"""256C88F4E50FD550_E02163CF53C5351C_6039_UN""","""C[C@@H]([C@H](OCCCCCF)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
-"""AEE5FF33BB12B740_BE0686CAFE5A2BE4_6039_UN""","""C[C@@H]([C@H](OCCSC(C)C)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
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-"""812CDB0309C7B560_A998FFFE0D35E7F2_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NCCCC2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""9B416B528256261E_90278D5FDA8912C5_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=CC(=C2)C(F)(F)F)=O""",21,"""51FDEB95E816E7B6"""
-"""41F307BB6F58DBAB_37D7FAB69F93CB12_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NN=C(C2=CC=C(C)C=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""E93520954C2990B3_7E5200DAE00C3EA9_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(C(C)(C)C)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""7804D4497CBA8849_3CF32CA0FFF773B7_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NCC2=CC=CC(=C2)OC)=O""",21,"""51FDEB95E816E7B6"""
-"""70BEB24BC867643C_2666A7F6171786B7_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(OCC)C=CC(=C2)C(=O)C""",21,"""51FDEB95E816E7B6"""
-"""ADAD464D7F36775B_4DC02DE9EE1B01C3_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC2=C(C(=C(C)S2)C)C(N3)=O""",21,"""51FDEB95E816E7B6"""
-"""A5756DB7E6C992AD_D9EF01A61FB4C4AA_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC(=O)NC2CCCCC2""",21,"""51FDEB95E816E7B6"""
-"""5EB4F06BBF9D96FD_DBC885DABA370C12_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC(=C(OC)C=C2)OC)=O""",21,"""51FDEB95E816E7B6"""
-"""15963896AB3931D6_07804F07C11B7938_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=NN=C(CC(C)C)S2)=O""",21,"""51FDEB95E816E7B6"""
-"""26452D42116AB28E_19B8F0267FE4B675_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(CNC(C)=O)O2)=O""",21,"""51FDEB95E816E7B6"""
-"""C8058C2B768FD3F6_C99B65027AB488B8_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C)[N](C(=C2)C)CC=C)=O""",21,"""51FDEB95E816E7B6"""
-"""2F4C624CEB52151E_9D213A1C822F1D7A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C)[NH]C3=C2C=CC=C3)=O""",21,"""51FDEB95E816E7B6"""
-"""ACB2E5F0A7C54865_56AD1780709F9513_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C=C(OC)C=C2)OC)=O""",21,"""51FDEB95E816E7B6"""
-"""BB22F6E96D9FC43A_A24FDA601730EFDF_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NNC(=O)C2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""31512A32C25BCE59_024E736BF113DD4E_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(CCCC)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""7643F9895116B4DA_0058D1EAA8590FAA_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(CC)CC(=O)NC(C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""56E4CEB0BDF6A046_0EE5B35DA633337C_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(NC2=CC=C(OC)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""BC5C7C998059283D_41A6E3B1C39B59D6_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=CC=C(C(C)(C)C)C=C2""",21,"""51FDEB95E816E7B6"""
-"""783BAC020EE2B107_EAED7A7E46DDFAD2_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NCCC2=C(C)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""6EB8F5C1E5C3F6C2_2722A854DDA12230_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=CC(=C2)C(O)=O)=O""",21,"""51FDEB95E816E7B6"""
-"""5C497FDE028D6DB3_251320C5CBA07016_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC(=O)NCC2=CC=CS2""",21,"""51FDEB95E816E7B6"""
-"""2C984726871F257B_6624FA60D45EF5DF_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC(C)C2=CC=C(C=C2)F)=O""",21,"""51FDEB95E816E7B6"""
-"""8412BE25A25CB503_AB03C27150F434DF_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2CCN(C(C)=O)CC2)=O""",21,"""51FDEB95E816E7B6"""
-"""91356BFC00092DC2_840F7CF8EA5EE419_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C(F)(F)F)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""9E01371981880773_A75FFBD9907D1697_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=CC(=C2)OC(F)F)=O""",21,"""51FDEB95E816E7B6"""
-"""8537D95668F9A183_CC7AE3433D489452_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=CC(=C(C(C)C)C=C2)C""",21,"""51FDEB95E816E7B6"""
-"""ADCE399EA0A1436E_7DEB520674EA6451_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC2=CC=C(C=C2)CC#N""",21,"""51FDEB95E816E7B6"""
-"""03A5EEA9D11EE799_5D75933BB7F7C5F6_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C=CC(=C2)CC)CC)=O""",21,"""51FDEB95E816E7B6"""
-"""79A5481051659A32_5A121A6842EDCCA6_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(C)C2(CCCCC2)C#N)=O""",21,"""51FDEB95E816E7B6"""
-"""1622DE317EE91F11_5B48142FC0158D03_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C)C=C(C=C2C)C(C)(C)C""",21,"""51FDEB95E816E7B6"""
-"""5401890214E33B03_4B7B714434F6562C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C(=C(C)C=C2C)C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""22CE29A2FED9CFBD_1C0C01AE0A0CFAA4_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=NO2)C3=CC=C(C)C=C3""",21,"""51FDEB95E816E7B6"""
-"""C5DA1D84034F85A7_5B73F39DBDD3CD58_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=CC(=C2)[S](N(C)C)(=O)=O""",21,"""51FDEB95E816E7B6"""
-"""ADE239D1786EC789_52C807FBD1A9232E_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C)[N](C(=C2)C)C3CC3)=O""",21,"""51FDEB95E816E7B6"""
-"""CB911C2CE94812F0_5A5F2F79FDDD310F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NN=N[N]2CC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""CEAA5D82888E9985_E4FD7834F1E94F20_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(C)CC2=CC(=CC=C2)F)=O""",21,"""51FDEB95E816E7B6"""
-"""DEEAE7333772D0E1_DABD932C76D15810_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C)OC(=N2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""13D81B19B2ADF267_21AA3C81CBE8BF9D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC3=C([N]2C(F)F)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""BF1537FBEAD657FF_26FD16E2F49E7184_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=COC(=N2)C3=CC=C(C)C=C3""",21,"""51FDEB95E816E7B6"""
-"""2AD992CC600E5A41_3CE13842D9F95B0C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(CC(OC)=O)S2)=O""",21,"""51FDEB95E816E7B6"""
-"""5223371EAC80AE8B_F76F6E0325CA18E9_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=COC(=N2)C3=CC=C(F)C=C3""",21,"""51FDEB95E816E7B6"""
-"""3A88531875E90351_CB4813FE8737F58D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC=C[N]2CC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""740F78DFF9395F98_694E35C4A468919E_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NCCSCC2=CC=CS2""",21,"""51FDEB95E816E7B6"""
-"""76550972C1D810C7_54FC95B505C76F3C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(C(=C(C)O2)C)C#N)=O""",21,"""51FDEB95E816E7B6"""
-"""34FF26875969FB5C_9B8CE7A7E5CAD382_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(=O)NC2=CC=C(C=C2)C#N""",21,"""51FDEB95E816E7B6"""
-"""35460022CCA59757_8F77D8B48CA08549_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(=O)NC2=C(C=CC=C2)C#N""",21,"""51FDEB95E816E7B6"""
-"""2840E6F432141E3E_0CCFC8A481A293B1_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(NC2=C(OC)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""819ECF32DE432637_E0499752AB197F2F_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(=O)NC2=CC(=CC=C2)C#N""",21,"""51FDEB95E816E7B6"""
-"""C18250A4C99C47CA_1D31117B52689C9A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N2CCCC2C3=CC=CS3""",21,"""51FDEB95E816E7B6"""
-"""0454C17EF5E5F1FE_74A954170084D9EA_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(C)CC(=O)NC(C)(C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""D2C2DFE6CD339780_B861B4331ACEE591_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(OC2=CC=C(OCC)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""30ABA643598469A0_02686609992F8B4D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C([S](C)(=O)=O)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""DD3C2F28A11C5781_33266D4E62C4E60F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(CC)C2CC[S](=O)(=O)C2)=O""",21,"""51FDEB95E816E7B6"""
-"""C717AEFDE715A620_C943D3290338F6B3_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NN=C(C2=C(C)OC(=C2)C)O3""",21,"""51FDEB95E816E7B6"""
-"""1D8699730CBE5BE2_8135E2BDE43BC853_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(CNC(C)=O)S2)=O""",21,"""51FDEB95E816E7B6"""
-"""02C721DF2622E5D2_0C068D04DE38CEBD_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NN=C(C2=C(F)C=CC=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""95D36C4402AB6A66_F9CBFDEF8AAC3006_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=C(C(=C2C)C(C)=O)C)C""",21,"""51FDEB95E816E7B6"""
-"""629D7F0255FA6EE8_9549A57CC61B2599_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NCCSC2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""2F30299EFD6E43C1_65AA3E1AE2EE4F0C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(CC)C2=CC=C(C=C2)F)=O""",21,"""51FDEB95E816E7B6"""
-"""63661F5B026C5EDE_14ED72E24C097F29_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(=O)N2CCC3=C2C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""23A28394A7EA6EDE_E4BAC6B26A3B48B3_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC=C(C2=CC=C(F)C=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""D2652480736ACC6D_3DE40089D0CF00E0_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(NC2=C(C(N)=O)C=CS2)=O""",21,"""51FDEB95E816E7B6"""
-"""43D97FE0B1606684_DCED941EC1D2C1FB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC(=C(C(=C2C)C)C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""5BC053877BF6CEDD_B9B12B9D767D1AA2_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(C(CC)C)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""D532E073535C2A89_CCBD4527AC93B151_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C)C3=C(S2)C=CC=C3)=O""",21,"""51FDEB95E816E7B6"""
-"""2FEC84D8C42E2998_905C18C581AF1172_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C2=CC3=C(C=C2)CCCC3""",21,"""51FDEB95E816E7B6"""
-"""C20FA8CB934B6641_B779DC9A6BD3687B_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=C([S](C(F)F)(=O)=O)C=C2""",21,"""51FDEB95E816E7B6"""
-"""255669A47652ABB4_1351BD73905C75FB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(C)CC2=C(C=CC=C2)C)=O""",21,"""51FDEB95E816E7B6"""
-"""C2666159050249F6_4DE4BD20D9C911C1_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N(CC#N)C2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""1480974E8D1842CC_0B2FA6882EBF7143_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=C(OCC(F)(F)F)C=C2""",21,"""51FDEB95E816E7B6"""
-"""C3FE930D3AB05CF8_652866E66171F46E_6039_UN""","""O(CCC1CC1(Cl)Cl)CCSC2=CC=CC(=C2)C(F)(F)F""",21,"""51FDEB95E816E7B6"""
-"""DEBB05D839F3816C_20642547EB05E0C0_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NCC2=CC(=CC=C2)C#N""",21,"""51FDEB95E816E7B6"""
-"""980C1E461EE4A4BA_2A2F73EF809F324B_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=NO2)C3=CC=C(F)C=C3""",21,"""51FDEB95E816E7B6"""
-"""1FA72D2B8526EDFF_0BEE525558E8D176_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N2CCCC(NC(C)=O)C2)=O""",21,"""51FDEB95E816E7B6"""
-"""2E7A486DAF6E063A_AFD16064048F412B_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N=C2C=CNN2CC(C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""6285DED065E72545_C0D0A60DDBCEBCFD_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(CC(C)C)CC(F)(F)F)=O""",21,"""51FDEB95E816E7B6"""
-"""7331DAA3A9172609_769F9D47AF58862B_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=CC(=C2)OCC(F)(F)F""",21,"""51FDEB95E816E7B6"""
-"""DAB4E1D0870AEE51_38C8C38B43656C13_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N2CCCC(C(F)(F)F)C2)=O""",21,"""51FDEB95E816E7B6"""
-"""96D2755D06D6C33D_2E514AD8AE19F4D9_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N2CCC(C(NC)=O)CC2)=O""",21,"""51FDEB95E816E7B6"""
-"""5149B4FE44E453EC_C396AB4854622374_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N2CCC3(CC2)OCCO3""",21,"""51FDEB95E816E7B6"""
-"""984D578820DA7016_7A50EDF53512E4E4_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N2CCCC2C3=CSC=C3""",21,"""51FDEB95E816E7B6"""
-"""9EC945DEBA61CADA_E954D57831D464B4_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC3=NC2=C(CCCC2)S3""",21,"""51FDEB95E816E7B6"""
-"""AA5733D01825EF7B_73A8288D1D2A994A_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC3=C2C=CC=CC2=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""21992CBA52240C3B_4BB6C59FE1C16EC5_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CSC(=N2)CC(OC(C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""4EB05BD79D868DDD_D379C4F017D6E7D4_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC[S](C2=CC=C(F)C=C2)(=O)=O""",21,"""51FDEB95E816E7B6"""
-"""5E0ADB5E3AABCAB3_2A0BE8D300BB64F7_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC2CCN(CC2)C3CC3""",21,"""51FDEB95E816E7B6"""
-"""514782DFE9867064_14BBFF5077E67237_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C[NH]C3=CC=CC(=C23)C)=O""",21,"""51FDEB95E816E7B6"""
-"""A7A45BD7DD7B3B29_72CAC9E562DC1D77_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCOC2=CC3=C(C=C2)OCO3""",21,"""51FDEB95E816E7B6"""
-"""96087A45866E49E0_ED2BFA84C027D219_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N(CC2=CSC=C2)C3CC3""",21,"""51FDEB95E816E7B6"""
-"""16C9AC80D875CFB5_E674A06750FDA0A4_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=CC=CC(=C2)C(OC)=O""",21,"""51FDEB95E816E7B6"""
-"""9E5F6080D21667F5_11C77B27CA85560C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC(=CS2)C(N(C)C)=O)=O""",21,"""51FDEB95E816E7B6"""
-"""4C6A01EDA35D3CB0_981D3BE348E15BFB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NN=C(CC2=CC=CC=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""E3903CD479B37C03_0DD9D37DE80D751F_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCC2=CC=C(C=C2)[S](=O)(=O)Cl""",21,"""51FDEB95E816E7B6"""
-"""DDFE616F5DDE0909_E42F7A39D74D6CB2_6039_UN""","""O(CCC1CC1(Cl)Cl)CC[S](C2=CC=CC(=C2)OC)(=O)=O""",21,"""51FDEB95E816E7B6"""
-"""139F9050B8E2CB33_C325DF2A920213A2_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NCC(=O)C2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""0F254DF9CDB31FD9_9BC12390526C9F6C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC2=C(C=CC=C2)[S](=O)(=O)N3""",21,"""51FDEB95E816E7B6"""
-"""A52E6018262F39C6_9B20875D7553C7AE_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CSC(=N2)C3=C(F)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""36900EA5760C488F_F8EE20B93214FDC1_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2CN(C(=O)O2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""10C72CEB0F42A98A_D872DF5BF8C07400_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCC3=C2C=CC=CC2=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""7C426F00960ADA8C_01FEFACA9AA6FE45_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=C(C=C2)[S](=O)(=O)C)OC""",21,"""51FDEB95E816E7B6"""
-"""2CC77A6FCF9D7C98_DB1090EA48D71015_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2CCN(C(C)C)CC2)=O""",21,"""51FDEB95E816E7B6"""
-"""CB45BB7041EF22C1_888AAAA7930B8E54_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=C(OC)C=C2)[S](=O)(=O)C""",21,"""51FDEB95E816E7B6"""
-"""8D088D200FE188C3_EF7325C93F3D3E61_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(NC(N)=O)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""40286877C78E5983_CAE0A56AFA55F3DC_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=C(OC)C=C(C=C2)C#N""",21,"""51FDEB95E816E7B6"""
-"""DE5D0D3F78717982_419F050533F36B77_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=C3C(=CC=C2)C=CC=N3""",21,"""51FDEB95E816E7B6"""
-"""17A78563F85AF7FC_B11DFE42DD0E7AF4_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NN=C(C2=CC=CC(=C2)F)O3""",21,"""51FDEB95E816E7B6"""
-"""3F008D60B699F221_F866FE4EC22D1272_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=CC=CC(=C2)[S](C)(=O)=O""",21,"""51FDEB95E816E7B6"""
-"""E918A633D2F7928F_7D403380FF377FE8_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=NO2)C(OCC(C)C)C""",21,"""51FDEB95E816E7B6"""
-"""E9E4BD0D0DDEF074_A9AFC2A46D9F8C70_6039_UN""","""O(CCC1CC1(Cl)Cl)CC[S](=O)(=O)C2=CC=C(C=C2)C#N""",21,"""51FDEB95E816E7B6"""
-"""065BEF3F2CF64A84_A8A244D30D09689C_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCC2=CC=C(C(F)(F)F)C=C2""",21,"""51FDEB95E816E7B6"""
-"""CA66A24E604D5532_31062E015C39BBA0_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=CC(=C2)SC(N(C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""86A75B014E2D5C74_EA2A54A2CC491EAA_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC2=C(C=CC(=C2)[N](=O)=O)O3""",21,"""51FDEB95E816E7B6"""
-"""A03AE181AB4AC5AD_07554EEBEE22224B_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=C(SC(N(C)C)=O)C=C2""",21,"""51FDEB95E816E7B6"""
-"""619C053FB97215FA_55A71424581F034F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC[N]2N=CC(=C2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""71ADEC4861F64AD6_F65CE18243DC6AD5_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC3=C(N(C)C2=O)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""B27EEA51E1CF6BCD_E1D9A48799595FD6_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=N2)C3=C(C)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""3FCF22A698B6C8BB_72E00C224FAEE66E_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CN=C(OCC(F)(F)F)C=C2""",21,"""51FDEB95E816E7B6"""
-"""EE2806DF633EBC0D_FC37E4EB3CD119F9_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=NN=C(C(C)(C)C)S2)=O""",21,"""51FDEB95E816E7B6"""
-"""A4D24D603C394997_44B79933048AF167_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NN=C([N]2C)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""1637850660F89F02_04AE915F73F69894_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC2=CC=CC(=C2)OC(F)(F)F""",21,"""51FDEB95E816E7B6"""
-"""46B16CE2C6ACBB55_4B853D8EE5820F4F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=NO2)C3=CC=C(F)C=C3""",21,"""51FDEB95E816E7B6"""
-"""972DDDD768C3C714_66F3339EC74031E3_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C(=C(C)[NH]2)C(C)=O)C)=O""",21,"""51FDEB95E816E7B6"""
-"""73D61FEB377BB4E2_BB9311DE7B7725A7_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N2CCSC3=C2C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""A39760221C472D2B_1693D68E4EF7F233_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=C(C(N)=O)C=C2)[N](=O)=O""",21,"""51FDEB95E816E7B6"""
-"""F3207A2EA2FAFBBC_1344953B12D6E489_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(=O)NC(=O)NC2CCCC2""",21,"""51FDEB95E816E7B6"""
-"""126D03F07F80164F_23E4E1E36CD34767_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC(=O)CC2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""E91543836F4CA7A3_641E0AAEBA700367_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC(=C(C)C=C2)[N](=O)=O)=O""",21,"""51FDEB95E816E7B6"""
-"""7FD4ADF19DC14A42_E85BDEB9B5E1B550_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=CC(=C2)C(C)=O)=O""",21,"""51FDEB95E816E7B6"""
-"""777C3356F03EFA7E_544D3A89C7203976_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC(C(OC)=O)CC(C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""CB106370F2E87427_201D9A1794DFF01C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N=C2N=C(SCCC)NS2)=O""",21,"""51FDEB95E816E7B6"""
-"""8B9B1C15142F544C_E6B41F46AAE4B975_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC2=CC3=C(C=C2)CCC3""",21,"""51FDEB95E816E7B6"""
-"""C28B7FEC62D8F63A_0D413FB7AA1F7B56_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC2=C(C=C([N](=O)=O)C=C2)[NH]3""",21,"""51FDEB95E816E7B6"""
-"""8F9ED6A77BA9A0DE_4BC6B3BFB2B187DD_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(=O)N3CCC2=C(C=CS2)C3""",21,"""51FDEB95E816E7B6"""
-"""749973EF01CF7713_48B9F550B91A740F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C2=CC3=C(C=C2)OCCO3""",21,"""51FDEB95E816E7B6"""
-"""DBD9108B59640CC1_DA55A87B357C7A59_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCN2C(=O)OC3=C2C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""7907F2D832FFA85D_EA56AE4C4E23F844_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC(=O)NC2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""1F96D4F65B34209B_6392BBB9F32043A5_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(CC(C)C)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""664793A1AA484CF6_16CF0F39A358C798_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C([S](N)(=O)=O)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""9A48305E2B059A40_D77F76CDE693B596_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(C(O)=O)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""65CA81CA1A73B426_636F17853F8F5BE8_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N(CC2=CC=CS2)C3CC3""",21,"""51FDEB95E816E7B6"""
-"""6519EB89BB04A6B6_2920F29DCB4D151F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=C([N](=O)=O)[N]2C=CC=CC2=N3""",21,"""51FDEB95E816E7B6"""
-"""723ACF5EA7D70313_A029443F70465294_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC2=C(C)C=CC=C2C(N3)=O""",21,"""51FDEB95E816E7B6"""
-"""BDC6AFAF3366EDF4_EBEA8BD47671477D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC2(CCCCCC2)C#N""",21,"""51FDEB95E816E7B6"""
-"""B28A9596B52275ED_9594851CAAA7ED72_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC(=NO2)C(C)(C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""7A008CAB9C0B27CF_32B1F9D3E50DE0E6_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C)C3=C(O2)C=CC=C3)=O""",21,"""51FDEB95E816E7B6"""
-"""7A838C0913AABC87_26D3F158793D605A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C=CC(=C2)OC)OC)=O""",21,"""51FDEB95E816E7B6"""
-"""B56A3CD9C21DD150_5FD6598E553339E3_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=NO2)C3=C(C)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""C28DE16E19087901_1100CB0CC3F59F15_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC[Si](OCC)(OCC)OCC""",21,"""51FDEB95E816E7B6"""
-"""A4D9022756E4E102_7ED4DCBAF328DE45_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N2CCCC3CCCCC23""",21,"""51FDEB95E816E7B6"""
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-"""F5643A3173D41A61_2AF23747F7EBF573_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC(C)C2CC3CCC2C3)=O""",21,"""51FDEB95E816E7B6"""
-"""DC4247AAAF983990_1B3E953B83F5A6AA_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=C(C=C2)C3CCCCC3""",21,"""51FDEB95E816E7B6"""
-"""0A7C74AD8256DA4B_9227D13037B2D57D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=NO2)C3=CC=CC(=C3)C""",21,"""51FDEB95E816E7B6"""
-"""38FE5347A7229821_1412A832AD09BB07_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=CC(=C2)C(C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""FFDAADB90E6A3E61_3FBDB6DEBA210155_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(NC2=CC=CC(=C2)OC)=O""",21,"""51FDEB95E816E7B6"""
-"""16BED3EC989F9F4F_A1D4D5BBC09A0234_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=N2)C3=CC=C(F)C=C3""",21,"""51FDEB95E816E7B6"""
-"""8FD33D4E76F081DE_191BF4F090DEA9A8_6039_UN""","""O(CCC1CC1(Cl)Cl)CCN3C(=O)NC2(CCCC2)C3=O""",21,"""51FDEB95E816E7B6"""
-"""02CB1A7A866CD2DA_2BAD8B42499ED32E_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=NO2)CC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""9E67B2864655EA8A_0F93ABBEAB427DA9_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NCC2=CC=C(C=C2)C#N""",21,"""51FDEB95E816E7B6"""
-"""980233CCE91243E8_8C06C8EFDF76082A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(NC(C)=O)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""0579DD14057C2DF7_0010DDF243A80225_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC=C(C2=C(F)C=CC=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""2F751600ED840594_6C67A31CD0B418D0_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=C(C(OC(C)C)=O)C=C2""",21,"""51FDEB95E816E7B6"""
-"""BA81655BC5AB1E9D_3A7FD71B05AE0810_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CSC(=N2)C(OCC(C)C)C""",21,"""51FDEB95E816E7B6"""
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-"""738B04B063A6C95F_894072F8A0F49DC5_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=CC=CC(=C2)C(C)(C)C""",21,"""51FDEB95E816E7B6"""
-"""6443EC493D7A9E78_690F1EAC44C2328C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C[S](=O)(=O)C2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""816BDF53E250E606_FB5D7237CF588515_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=N[N](C2=CC=C(F)C=C2)C=C3""",21,"""51FDEB95E816E7B6"""
-"""5D3A626A5963549B_F968B4C8D91F6025_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NN=C(C2=C(C)C=CC=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""F189925DCB82E3A7_A9E3818095B37D0C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC=C(C2=CC=C(C)C=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""7CD141FAE0AF224F_7C27C955339BA61D_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC2=CC=C(OC(F)(F)F)C=C2""",21,"""51FDEB95E816E7B6"""
-"""6F5BFBED35CBBA73_2032BCEEB09BE2EB_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCN2CCC(C(OC)=O)CC2""",21,"""51FDEB95E816E7B6"""
-"""7442126FCF3FAED6_A28AC798D96EE51A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=C(C(OC)=O)C=C2)OC""",21,"""51FDEB95E816E7B6"""
-"""2F9B76D02456D434_BAA11687EEEAE16B_6039_UN""","""O(CCC1CC1(Cl)Cl)CCN2C(=O)COC3=C2C=CC=C3""",21,"""51FDEB95E816E7B6"""
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-"""9A5F89E479A73B69_01AB4AAE55B5E642_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C(O)=O)C=C(C=C2)[N](=O)=O""",21,"""51FDEB95E816E7B6"""
-"""FCB71CDDB1EC625F_1F6D4B91B9583641_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=CC(=C2)C(OC)=O)=O""",21,"""51FDEB95E816E7B6"""
-"""4A754BF142A5151E_9650724CF764113B_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=C(C(O)=O)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""EE5823F7E630A234_A6DCB196ADCAFD1D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=CC(=C2C#N)C(OC)=O""",21,"""51FDEB95E816E7B6"""
-"""FFE9AD1969240F83_78B7919A8429944A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=C(C(C)C)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""E98C5381ECB59AAC_42EAABBE0B251812_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C[N](N=C2)CC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""4B45E6A9A5EA92CA_381C9CACB0DA314C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(OC)C=CC(=C2)C)=O""",21,"""51FDEB95E816E7B6"""
-"""F32172623950066D_C9B185B435767280_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(C=C(C)C=C2C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""410DB215341EBC99_FCF429B531FD16AA_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=C(OCC)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""AC69A8A9F3CF0CA4_DA3F18CE3B013161_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(CC)C=CC=C2C)=O""",21,"""51FDEB95E816E7B6"""
-"""C80A870AD683AA54_BB6059E3C301DD6E_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C2=CC3=C(C=C2)NC(=O)N3""",21,"""51FDEB95E816E7B6"""
-"""3693022E0A8486D9_1EE8D0DBF6BC0D17_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(C(=C(C)S2)C)C#N)=O""",21,"""51FDEB95E816E7B6"""
-"""ACA7DE3189494A2D_C724C9FBEA6C5EDF_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=C(C=C2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""9F3B82D98CD3D669_30906DD3880B89BC_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(C(N)=O)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""2887D679C7379FE9_138D14E975424ADB_6039_UN""","""O(CCC1CC1(Cl)Cl)CCN3C(=O)C2=C(C=CC=C2)C3=O""",21,"""51FDEB95E816E7B6"""
-"""7B7B9244E4E2F7F4_AEC6F0C48727241A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NCC2=C(OC)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""80ECA7F77F4C34B3_FE1540C82DD3089F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC(CCC)(C)C(=O)OC)=O""",21,"""51FDEB95E816E7B6"""
-"""1415DA2F15A8015F_B9D92A444B445D61_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=C(C(OC)=O)C=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""F7425FD3A57675EC_D16908CB17F53F6E_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C([N](=O)=O)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""E3808FC6B885CFFF_50CF7A5FF32A6A41_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C2=CC3=C(C=C2)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""8244D9F1A390B247_7809AA95D6075A06_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(OC(F)F)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""DF8AA359FC29667A_EE4399106177C018_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=C(C(C)=O)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""38E2D379C29DB375_7C19500321D104A2_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=C(C=C2[N](=O)=O)F)OC""",21,"""51FDEB95E816E7B6"""
-"""FBB5F78C3CE65B28_55366E608B30BC8A_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCCCCCCCCC(O)=O""",21,"""51FDEB95E816E7B6"""
-"""2829BBFC49AA1547_1A6E1B5B1BCF2448_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=C([S](N(C)C)(=O)=O)C=C2""",21,"""51FDEB95E816E7B6"""
-"""C9CF6093EF878AB0_75CCE3F72A307951_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(C(C)=O)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""13A1E77254701BAB_3132184EAA84213A_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC[S](C2=CC=CC(=C2)C)(=O)=O""",21,"""51FDEB95E816E7B6"""
-"""EF934659CA95C45D_A823121277CDEA16_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCC2=C3C(=CN=C2)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""C554A075F9A72480_632AF835BA48134E_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=NO2)C3=C(C)[N](N=C3)C""",21,"""51FDEB95E816E7B6"""
-"""5ADB1624C089BBB4_1AA894AAAC0E7E5A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(C(OC)=O)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""2F15EF582733F5B2_2E028EBB7956A9FC_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCC2=NC3=C(C=C2)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""D01CB48A00A0D0FF_A7153110512DD90D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=N[N](C2=C(F)C=CC=C2)C=C3""",21,"""51FDEB95E816E7B6"""
-"""6275DED15A2AE813_678E0B699E6B19CB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C3COC2=C(C=CC=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""FB6BE2DD08C9A250_061422DF1E01E9A4_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C)C=C(C=C2)[N]3C=NC=C3""",21,"""51FDEB95E816E7B6"""
-"""8239DBC42EBB0B19_945086122F16B06F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NN=N[N]2CC3CCOCC3""",21,"""51FDEB95E816E7B6"""
-"""53248F47222EED46_1E275BF5473EDABF_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=C(C=C2)[N](=O)=O)OCC""",21,"""51FDEB95E816E7B6"""
-"""5501D27FFF21BCE1_F6EE9DC382DF0FFD_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=CC2=C(N(C)C(=O)CC2)C=C3""",21,"""51FDEB95E816E7B6"""
-"""4B9E5B80D58A3600_E846DB1F7DF6D85C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=C([N](=O)=O)C=C2)[N](=O)=O""",21,"""51FDEB95E816E7B6"""
-"""709E1349B53CC29B_0C08B44AF20A2C08_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=CS2)C3=CC=C(C)C=C3""",21,"""51FDEB95E816E7B6"""
-"""0C0FEA631E39D9FA_11A129E072458763_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC3=C(C)N=C2SC=CN2C3=O""",21,"""51FDEB95E816E7B6"""
-"""A7CD3883BB35D22E_730757D912029D19_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=NC=C(C(F)(F)F)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""1A09C1B9FBD58AC7_B4805AA3A59C3C1F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C3=C2C=CC=CC2=CC=N3""",21,"""51FDEB95E816E7B6"""
-"""4358D80C6525360E_520BA29A676C9A9A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CN=C([S](C)(=O)=O)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""EF631374C61FE4BC_D83B206CE3936A9A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC(=NC=C2)C(F)(F)F)=O""",21,"""51FDEB95E816E7B6"""
-"""95BEC400D7EB50CF_3B10682E3447E88F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(F)C=C(C(=C2)F)C(F)(F)F""",21,"""51FDEB95E816E7B6"""
-"""6E3751B5253D5789_098F31A48D69E937_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NN=N[N]2C3=CC=C(F)C=C3""",21,"""51FDEB95E816E7B6"""
-"""B0FDFE9C1EEB49E3_59F45A4A3F2DD836_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=C2)C3=CC=C(F)C=C3""",21,"""51FDEB95E816E7B6"""
-"""8052D61FCDAC707C_331DBB7F39B2200A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=C2)C3=C(F)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""3B42D06967B17709_03082C0F881A36D6_6039_UN""","""O(CCC1CC1(Cl)Cl)CC#CC2=CC=C(C(F)(F)F)C=C2""",21,"""51FDEB95E816E7B6"""
-"""8323CB39BED0AC34_BD62933C8135120E_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NN=N[N]2C3=CC=C(C)C=C3""",21,"""51FDEB95E816E7B6"""
-"""18140877D60FEBE3_A76F707E6B623618_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N2CCN([S](C)(=O)=O)CC2)=O""",21,"""51FDEB95E816E7B6"""
-"""E290097315271CB5_888B00A8546DED7D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=C(C(C)C(F)(F)F)C=C2""",21,"""51FDEB95E816E7B6"""
-"""26D6F9D6D7D8D53C_D74EB859D6500BD8_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2CN(CCO2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""CC95FF39F0966122_269F14F1D11FFD2C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=CC2=C([N](C(C)C)N=C2)N=C3""",21,"""51FDEB95E816E7B6"""
-"""0EFE9834190A37B2_7A5AEA41319AA0C0_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC(=O)NCC2=CC=CO2""",21,"""51FDEB95E816E7B6"""
-"""4EB978FA90539EE4_49C50172ADC4752B_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C([N](C(C)C)C(=C2)C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""DC6EDDAA788114EA_47B26A1AE344776A_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(NC(NCC(F)(F)F)=O)=O""",21,"""51FDEB95E816E7B6"""
-"""ED1657A86D2B68E9_307BC3614FDB4201_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(C(C)C)C2CCCCC2)=O""",21,"""51FDEB95E816E7B6"""
-"""8C6416F9D00DF83D_DFD40A7F7DCF409B_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C2CCCC3=C2C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""F24F5FDF45560562_60E9353434F8FD87_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=NO2)C3=NC=CC(=C3)C""",21,"""51FDEB95E816E7B6"""
-"""BCB206C853C9A6FB_1AF09CFF54B41317_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N(CC=C)CC2=CC=CS2""",21,"""51FDEB95E816E7B6"""
-"""1771D48CDAA6AD93_22F3236F1B76C9D5_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3ON=C(C2=CC=C(F)C=C2)C3""",21,"""51FDEB95E816E7B6"""
-"""3C2D4024AC0B8D84_42662CF01A23A698_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=NO2)C3=C(F)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""B16D03C986D2C779_F4AEC962A18E0DEF_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(C)CC2=CC=C(C=C2)F)=O""",21,"""51FDEB95E816E7B6"""
-"""66CF34F0952D041F_D025A1A9DC7A5669_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CSC(=N2)C3=CC=C(F)C=C3""",21,"""51FDEB95E816E7B6"""
-"""998A6D25E4605156_03466F4B02C0ABA2_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=CC=C([S](N)(=O)=O)C=C2""",21,"""51FDEB95E816E7B6"""
-"""72365841A79878C0_7C0396A640D1F8C6_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=CC=C([S](Cl)(=O)=O)C=C2""",21,"""51FDEB95E816E7B6"""
-"""DE42950F0F69B1BE_63B787AC4346BF4A_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC2=NC=C(O2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""6276910ADD0E93E0_74E3F82608E1E2E9_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC=C(C2=C(C)C=CC=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""25D0AEDB8AFCA0CB_1B704E3836475459_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(=O)NCCC2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""361F3BD51CBDCF89_0EC2EC72A92370DA_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=N[N](C2=CC=CC(=C2)F)C=C3""",21,"""51FDEB95E816E7B6"""
-"""6AD0AA95607AE385_DD471041DDBDB8FC_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(OC(C)C)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""6029F779BCB6CF88_4C3ED96828DB8B5F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""51FDEB95E816E7B6"""
-"""1056800800051CDD_80F4A77288321505_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(CC)C2=C(C=CC=C2)C)=O""",21,"""51FDEB95E816E7B6"""
-"""5AB88271C2DB638A_B4FDCAFA314BAE41_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=COC(=N2)C3=CC=CC(=C3)F""",21,"""51FDEB95E816E7B6"""
-"""0E6E51265CCB356F_1113A4F233D2E9A5_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=NC(=CC(=O)N2)OC)=O""",21,"""51FDEB95E816E7B6"""
-"""F88920EF26A2F11B_35565E1D825BC08B_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NCCCC2CCCCC2""",21,"""51FDEB95E816E7B6"""
-"""0A37C22DC25291F6_5CAD5881CDB37BC0_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NCCCN(C)[S](=O)(=O)C)=O""",21,"""51FDEB95E816E7B6"""
-"""CB7FCDA4877B053C_059968F6C23B52E4_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""51FDEB95E816E7B6"""
-"""6F57E33CA95786AE_A51123D4BBD88180_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC=C(C2=CC=CC(=C2)F)O3""",21,"""51FDEB95E816E7B6"""
-"""251DB88C101400DE_77EF273E45C928C2_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=CC(=C2)C(C(F)(F)F)=O""",21,"""51FDEB95E816E7B6"""
-"""E7651382A1A020E6_D93357757DFFFA3F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CN=C(C=C2)C3=NC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""C5DF2A0DFF5BB19F_480766D3495FE7BF_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(F)C=C(C=C2)C3=NC=CO3""",21,"""51FDEB95E816E7B6"""
-"""53D2B81274B6813C_C154EA4E0E5C7DC5_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC3SC2=C(C=CC=C2)NC3=O""",21,"""51FDEB95E816E7B6"""
-"""691CD8EB404157BA_3D326314B13EB016_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3CN(C2CCCCC2)C(=O)O3""",21,"""51FDEB95E816E7B6"""
-"""8721440D0FDB7F42_410FC0E6F1E50A34_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(C(OC)=O)C2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""EDE9424623CD3FF9_9EB319DA4C43B436_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NN=C(OCC(F)(F)F)C=C2""",21,"""51FDEB95E816E7B6"""
-"""35F7DD0375C28906_F027CF600249872D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=C(C(O)=O)C=C2)[N](=O)=O""",21,"""51FDEB95E816E7B6"""
-"""336E6710696E7C1F_4D447C6D9A2DE883_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC2=C(C=CC(=C2)C(O)=O)[NH]3""",21,"""51FDEB95E816E7B6"""
-"""773C5456669A96D8_11D354B94C074143_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CN=C(N=C2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""1AC500B60143E468_F0B342FFCAD71396_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NN=C(C2(OC)CCOC2)O3""",21,"""51FDEB95E816E7B6"""
-"""27B4524929C2FF20_08FAC8AA201460EB_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC3=CC2=C(OC(F)(F)O2)C=C3""",21,"""51FDEB95E816E7B6"""
-"""F8776761C4A62D63_8B1FB5DB258D4D50_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C[NH]C3=C2C=C(F)C=C3)=O""",21,"""51FDEB95E816E7B6"""
-"""D6530942C7D41A36_29C7DAEEF1612035_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C(OC)=O)C=CC=C2OC""",21,"""51FDEB95E816E7B6"""
-"""28DEBFD1359695CB_48C83EB7A9AD22B0_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C=C([N](=O)=O)C=C2)F)=O""",21,"""51FDEB95E816E7B6"""
-"""B83A83A80521A959_74DA55F60AFD16AB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=C2C=CC=CC2=C(OC)N=C3""",21,"""51FDEB95E816E7B6"""
-"""EC0000468F76E47A_C6E80CB499A936F5_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=COC(=N2)C3=C(F)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""62ECA0B5815A4722_73D4138B776BBF17_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2CCCC(C(F)(F)F)C2)=O""",21,"""51FDEB95E816E7B6"""
-"""FE355255521B4669_273B1CAE74133A5D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C)[NH]C(=C2)C(OC)=O)=O""",21,"""51FDEB95E816E7B6"""
-"""50B2C6A1EF5B0AE0_F05E2CEA6EF0A9EF_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC2=CC=CC3=C2OC(F)(F)O3""",21,"""51FDEB95E816E7B6"""
-"""7760B09F91B04452_3B4FA113FC50E5BB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C(OCC)=O)C(=CC=N2)C""",21,"""51FDEB95E816E7B6"""
-"""678F40B3579C67B7_8EF13320D5D9CB29_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCOC2=CC=C([N](=O)=O)C=C2""",21,"""51FDEB95E816E7B6"""
-"""19BFB104A939E7C0_3C359A7CE9DE730C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C)C=CC3=C2C=CC(=C3)C""",21,"""51FDEB95E816E7B6"""
-"""CD0717FF03AEFF7D_06E5FB4F19D18B5E_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC3=C(O2)CC(C)(C)CC3=O""",21,"""51FDEB95E816E7B6"""
-"""93A150A8A3CE8C81_2DF9D5670485C405_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C)N=C(O2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""9544A3F02EDFC986_1EC2439D8332BD92_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2CCCC(O2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""C5A111C7457F4990_99CA245EB3F2B95F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=CC(=C2)C(OC)=O)OC""",21,"""51FDEB95E816E7B6"""
-"""289E227FD1C0AD6A_5E1F24E9316C60B3_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(OCC)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""1EC15D55E9FCEEE9_1C77F76982129242_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=C(C(N)=O)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""610BE42CF7066B25_9DF882AD1DC8C73F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(CC)C=CC3=C2C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""E424B1CCA4B59534_E40B19F099D95757_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=CC(=C2)[N](=O)=O)=O""",21,"""51FDEB95E816E7B6"""
-"""B71C164BA777416C_A1AE0850ADC5E8B1_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C2=CC3=C(C=C2)NC(=O)C3""",21,"""51FDEB95E816E7B6"""
-"""43BE5B49ED34E495_DC57BC8E75D05817_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NCCC2=CC=C(F)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""7BE79C035B2B4952_290E159FDE6C5498_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=C([N](=O)=O)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""75E2C249B0B8C1C6_63ADA3D7924F1CAD_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NC2=CC3=C(C=C2)OCO3""",21,"""51FDEB95E816E7B6"""
-"""EF049BEAB9482045_3066EF5DE3E541FD_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N2C3=C(CC2C)C=CC=C3)=O""",21,"""51FDEB95E816E7B6"""
-"""9A02F3093552C240_06FD6D37478842FC_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N2CCCC3=C2C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""B5ECE35BC0ED6F2C_AC5FBE03A08A77E1_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(C(C)C)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""5F08670F56F1B196_8527FF68FA819523_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(C(=C(F)C=C2)F)F)=O""",21,"""51FDEB95E816E7B6"""
-"""8F5183A9CDECF3C0_7C598A04C88394C7_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=C(C=C2)N3CCOCC3""",21,"""51FDEB95E816E7B6"""
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-"""702EC62A371E6A0A_4DA70B2E2A0DF913_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC2=NN=N[N]2C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""651D278A222B1A52_218EF6C5054C25EA_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=CC(=N2)C(OC)=O)=O""",21,"""51FDEB95E816E7B6"""
-"""DCBF70AC406D6768_C75E957CED96CED3_6039_UN""","""O(CCC1CC1(Cl)Cl)CC4CC2(CC3(C2)OCCO3)CO4""",21,"""51FDEB95E816E7B6"""
-"""7B093D2DBA11B94E_1B36965E2BE320B1_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=N2)C(OCC)OCC""",21,"""51FDEB95E816E7B6"""
-"""52D4BCE1A91A9F35_4007EE4D87925B39_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N2CCO[C@@H]3CCCC[C@H]23""",21,"""51FDEB95E816E7B6"""
-"""DE9F7EB5CB7E494A_547102B908611709_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3OC(=O)C2(CCC2)C34CCC4""",21,"""51FDEB95E816E7B6"""
-"""009DB1A9D7A6B708_25D308D2397241EB_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOCCOCC2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""921A2AA301081978_D5C5954C1732997C_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(OC(O2)=O)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""6DCAF3F9CAC8EA95_E61FABF685B28A5C_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC3NC(=O)C2=C(C=CC=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""1BDFD56F1B32B584_E83B069F2AD544BD_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NCC=CC2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""AB52AF807C096446_FDB55FB03EF47C44_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C34CC2CC(CC(C2)C3)C4""",21,"""51FDEB95E816E7B6"""
-"""9BBBA3A3057FDA1B_6C92F1044C12F55F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C([N](CCC)C(=C2)C)C)=O""",21,"""51FDEB95E816E7B6"""
-"""4551089BC0558EA3_F62D96F7C6876192_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NCC2=CC=C(OC)C=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""91CAA7F60C83F243_BE2061D297E486B0_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)C2=CC3=C(C=C2)NC(=O)O3""",21,"""51FDEB95E816E7B6"""
-"""D209107919006AB0_C269B0FE538D9678_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(C)CC2=CC=C(C=C2)C)=O""",21,"""51FDEB95E816E7B6"""
-"""EF3A14C8FC330B7B_38E0E646ACCACA83_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCC2=CC=CC(=C2)C(F)(F)F""",21,"""51FDEB95E816E7B6"""
-"""46598396096C4470_D1BB35139A7D71F0_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C(=C2C=CN(C)C=C2)C#N)=O""",21,"""51FDEB95E816E7B6"""
-"""DA411E73A1E2972D_6490A7DE2CC8FB43_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C[N](C)C3=C2C=CC=C3)=O""",21,"""51FDEB95E816E7B6"""
-"""1B9FFEED491FE440_41946EA5FB746B7D_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=CC3=C(C=C2)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""109C23D21BFE4E3F_5D497C58B99A9685_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=C(C(OC)=O)SC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""398373D000C8679C_067F9D4CC4FFD2F7_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC(C(CC)C)C(=O)OC)=O""",21,"""51FDEB95E816E7B6"""
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-"""2B9E48BB4A6E22EB_289383CECEAFD61F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=N2)CCCC(OC)=O""",21,"""51FDEB95E816E7B6"""
-"""A5C74E9866D414A0_5D9A719EF0A5F4C6_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=N2)CC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""34C7D8AEE26DDD0E_FB3EC79C4B655BD4_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NN=C(C2=CC=C(F)C=C2)O3""",21,"""51FDEB95E816E7B6"""
-"""EF622C127EA24066_228395BD0BE7AB8B_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=C(C=C2)OC(F)F)OC""",21,"""51FDEB95E816E7B6"""
-"""D28328E215C3FABC_F84EECAEF4B045EA_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CSC(=N2)N(C(C)=O)C3CC3""",21,"""51FDEB95E816E7B6"""
-"""23369563BC2D1EBA_3D92624F47EC9228_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCC2=NC(=NO2)C3=CC=CS3""",21,"""51FDEB95E816E7B6"""
-"""3B8DA0EC1C933C90_C8115A2F3DDE7FF8_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2(NC(C(F)(F)F)=O)CC2)=O""",21,"""51FDEB95E816E7B6"""
-"""9847752EB7C7FADD_1EB5FCB9E23E54EA_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(C(F)(F)F)N2CCOCC2""",21,"""51FDEB95E816E7B6"""
-"""D51C81DE5D70AE98_57B52952227B0B7D_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=CC(=C(OC)C=C2)OC""",21,"""51FDEB95E816E7B6"""
-"""4163F02FD0BBA73C_9EC63186BB7BE6A4_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=CC=CC(=C2)C(N)=O)=O""",21,"""51FDEB95E816E7B6"""
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-"""56BE611FDB02A3B0_F747D49A3445329A_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCN2C(=O)NC3=C2C=CC=C3""",21,"""51FDEB95E816E7B6"""
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-"""263E418AFCDAA5D7_1007BD86009ACE97_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=CC=C2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""39FB8DB9162C154F_73AD68A46F668586_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=C2C=CC=CC2=C(C=C3)C#N""",21,"""51FDEB95E816E7B6"""
-"""CEA7FEACB351A121_72B27C298F070FA8_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC2=C(OC(F)(F)F)C=CC=C2""",21,"""51FDEB95E816E7B6"""
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-"""19F084AED785F32C_89FAF8C733758C2F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=CC(=C2OCOC2=C3)C4CC4""",21,"""51FDEB95E816E7B6"""
-"""37CB56036CC18648_7EC8EBB602221584_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=CC(=C2)[N](=O)=O)[N](=O)=O""",21,"""51FDEB95E816E7B6"""
-"""4E15BABB1EFDC7C3_F5C49DE55A66FF7A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=CC(=C2)C(OCC)=O)F""",21,"""51FDEB95E816E7B6"""
-"""492DE22D3CAF0FDC_5B3E874886CD74EB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=N[N]2CCCC2=C3C(OC)=O""",21,"""51FDEB95E816E7B6"""
-"""13A5576C3F5B5100_225D9454CA1465DB_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC2(C(OCC)=O)CCCC2=O""",21,"""51FDEB95E816E7B6"""
-"""38B174E698D68D13_8539FBE23A1E8D22_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(C)CC2=C(C=CC=C2)F)=O""",21,"""51FDEB95E816E7B6"""
-"""32FD8CB6CEB742FD_4F1B0DB8371FE07D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC3=C([N]2CC)C=CC=C3F""",21,"""51FDEB95E816E7B6"""
-"""7F3B497BEF041227_016F0AEA793E1939_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCCCCOCCOCCC""",21,"""51FDEB95E816E7B6"""
-"""AC1F7E36F3C72FD6_5E237CC2D6409E25_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=C2)CC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""BAB17B5A8ABFE7DA_4BAF44636ACFC3DE_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=COC(=N2)OC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""9FCDBC41E1D6CB7B_49044E1C82F8E659_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CN=C(N=C2)C3=CN=CN=C3""",21,"""51FDEB95E816E7B6"""
-"""52D6E35EF50EDCA1_E22BE32051C08557_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=C(C=C2)C#N)C(OC)=O""",21,"""51FDEB95E816E7B6"""
-"""FCA740EC570E08E9_555D5145395D0864_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)N(C2CC2)C3=CCCCC3""",21,"""51FDEB95E816E7B6"""
-"""46B32C67B59D3EA8_9CD58A1DDEA203C9_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3CCC2(CCCCCCC2)O3""",21,"""51FDEB95E816E7B6"""
-"""B9B90570ACE3FDA2_85FD235B1911DE6D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=N[N](C=C2)CC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""98AC0998593A6A5F_5ECF87A794663A06_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=COC(=N2)CC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""E64D2248BA66B7ED_576F4CA6D20E5656_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=CC(=C2)OCC(OC)=O""",21,"""51FDEB95E816E7B6"""
-"""0F31D8BA72182BE0_BEFBB5E46C0D547A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=CC(=C2)[S](CCC)(=N)=O""",21,"""51FDEB95E816E7B6"""
-"""C80BEC64282448B6_07B5C2C972436AB9_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C(OCC)=O)C=NC(=N2)C""",21,"""51FDEB95E816E7B6"""
-"""3187885EF4138758_79A38695EC09E3E6_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=N[NH]C(=C2C)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
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-"""AA4E49ED9418E8CB_2BF38F2320745616_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2(O)CSC(=N2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""59546D79B8737A22_9C0D470E371269CB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=C(CCC(OC)=O)C=C2""",21,"""51FDEB95E816E7B6"""
-"""EFB05FFCB6E69CE8_C1F30E0D6EA771B1_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(C(C)C)C2=CC=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""A98B08055EC897BB_D7E0265EBD4374BA_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOCCO[Si](C(C)(C)C)(C)C""",21,"""51FDEB95E816E7B6"""
-"""A00612458ED06740_827E8C7037851FAF_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=CC(=C2)OC)[S](=O)(=O)N""",21,"""51FDEB95E816E7B6"""
-"""B511E72319940862_0FED000EE66B2866_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=N[N](C2=CC=C(C)C=C2)C=C3""",21,"""51FDEB95E816E7B6"""
-"""AE6BA5630EC46EEC_D31CB7A5A9E473A0_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=CC(=C2)OC)[S](=O)(=O)F""",21,"""51FDEB95E816E7B6"""
-"""B912BFAA6E9211D1_60B88E3CF786BFE5_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C)N=C(S2)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""50FE579187AE35ED_60ABD4631C1D0AD2_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=CC(=C2)OC)[S](=O)(=O)Cl""",21,"""51FDEB95E816E7B6"""
-"""B08381DD77C9EF39_4D249D4E8F465165_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(F)C=C(C=C2F)C(F)(F)F""",21,"""51FDEB95E816E7B6"""
-"""D28A73A7B9262581_017DDC5E4C1D0F34_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC=CC(=C2[N](=O)=O)C(O)=O""",21,"""51FDEB95E816E7B6"""
-"""421CB57F02ADB6FE_3D5D3FD75AE89897_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC3=C([N]2CC)C=CC(=C3)F""",21,"""51FDEB95E816E7B6"""
-"""EAE5598387F7E2B2_394AAD9B4F47AE38_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=N2)C3=CC=CC(=C3)F""",21,"""51FDEB95E816E7B6"""
-"""D0DE16EAA43D100D_A742ABFC294BFC7F_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=N2)C3=C(F)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""6A0AA4E1948B88A6_06D29E7EF7848060_6039_UN""","""O(CCC1CC1(Cl)Cl)CC([C@@H]2CC[C@H](C(F)(F)F)CC2)=O""",21,"""51FDEB95E816E7B6"""
-"""6B581D7220B2399F_EAD031FE68490605_6039_UN""","""O(CCC1CC1(Cl)Cl)CCOC2=CC=C(C(F)(F)F)C=C2""",21,"""51FDEB95E816E7B6"""
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-"""9A3D901A3AE98CA4_631BB1CFB260FE71_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=CC(=N2)C(OCC)=O)C""",21,"""51FDEB95E816E7B6"""
-"""F0B3F76D65DC0AED_EE74FE4065927635_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CC(=NO2)C3=CC=C(C)C=C3""",21,"""51FDEB95E816E7B6"""
-"""E0C8997807090D92_CC27B36ED4B6D7AB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CSC(=N2)CC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""20919E00264D4701_A725C5394B806022_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCC2=CC3=C(C=C2)C=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""646E51488CF16D79_34C9C2155416CD00_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=NC2=C(C=CC=C2)C(N3C)=O""",21,"""51FDEB95E816E7B6"""
-"""5A1F2D41D0571BF5_F7BEB1DE084D70F7_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NCC2=CC(=C(C)C=C2)F)=O""",21,"""51FDEB95E816E7B6"""
-"""8B19501F8B44A949_30A17D8027EFCD61_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(NC(C)C2=CC=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""D1F3AE4D4772C4B5_35F27F99EF124273_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC(NC2=CC(=C(F)C=C2)F)=O""",21,"""51FDEB95E816E7B6"""
-"""39C27DD9D15E1A96_54E3884088943EB4_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=NN=C(CCCC)S2)=O""",21,"""51FDEB95E816E7B6"""
-"""44B2A3E5F1F0A846_083F769893EE1D36_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(=O)NCC#CC2=CC=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""7017EFE99297E684_C7703F5C60F5B3EF_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=N2)C3=CN=CC(=C3)C""",21,"""51FDEB95E816E7B6"""
-"""B0784B748945C92B_D1B85705B5762ABB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(OC(F)F)C=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
-"""C2ECB03913942D8C_5F976B73079E30E9_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(OCC(F)(F)F)C=CC=C2""",21,"""51FDEB95E816E7B6"""
-"""A77AD579AF1FD7DD_63519C5EDD96E982_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N2CCC(C(OC)=O)CC2)=O""",21,"""51FDEB95E816E7B6"""
-"""B0455F534270E05E_F0BE730AA89C7808_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(OC(F)F)C=C(C=C2)C#N""",21,"""51FDEB95E816E7B6"""
-"""852188C397E5764B_9C30659AD7E03F33_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CN=C[N]2CC3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
-"""D855A0361EEA592D_F2BE0355FE7E3834_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=N[N](C(=C2)C)C3=CC=CC=C3""",21,"""51FDEB95E816E7B6"""
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-"""F0243B9B6AE5895F_3BF22EF2A1978DCB_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CN=C(C(F)(F)F)C=C2)=O""",21,"""51FDEB95E816E7B6"""
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-"""7761BF605BA87317_50AF6185AC3BF720_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCC(=O)NC2CCCC2""",21,"""C173893D9103EF78"""
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-"""F1898DBBD33F111F_8C60532B32F9FC3D_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC[S](CCC(N)=O)(=O)=O""",21,"""C173893D9103EF78"""
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-"""5FC18D02D4220713_B165D9CFC5021701_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCCC(N(CC)CC)=O""",21,"""C173893D9103EF78"""
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-"""DE5B673F2A30AA57_F57F3EC9E9AE37A2_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NC(=NO2)CCCC""",21,"""C173893D9103EF78"""
-"""BAD5084340720290_A2A819D83BA53075_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=C(C(OC)=O)C=CO2""",21,"""C173893D9103EF78"""
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-"""48522B38AD673B20_BBA1C9225E21C181_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCCCC[N]2N=CC=C2""",21,"""C173893D9103EF78"""
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-"""06B9791137607FB3_E466045297923992_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC=CC(=N2)OCC""",21,"""C173893D9103EF78"""
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-"""AF06F6126D8BE73E_885BFE1DECC4B998_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NC(=CS2)C(C)(C)C""",21,"""C173893D9103EF78"""
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-"""6761A4FECC7DF3A7_04B9BA33155EE740_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC[N]2C=C(C(O)=O)C=N2""",21,"""C173893D9103EF78"""
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-"""4AEDAB81A76C9636_E3F5020D05ADA0B1_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCNC(=O)C2CCCC2""",21,"""C173893D9103EF78"""
-"""13547805FF9C7615_7E319134AC20DE85_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC=CC3=NSN=C23""",21,"""C173893D9103EF78"""
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-"""16C74C0D7FB9FB46_CDC133F238B16408_6039_DP""","""CC(C)(COCC(N[C@H](C(C)C)C(=O)O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
-"""389A6B4B505AD830_E29409B71718A74C_6039_UN""","""CC(C)(COCC1=CN=C(C(F)(F)F)N=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
-"""3E95C13A744F4369_E5C5FA2D6BA30050_6039_UN""","""CC(C)(COCCC2=NC1=C(C=CC=C1)[NH]2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
-"""EA110C63BE0EF723_209DB16DB538DFF1_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)C(C)(C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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-"""C9E396AF35FA6EB0_7697E71DD2925181_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C[N]4C(=N3)C=CC=C4""",21,"""D5F4CEDDBB594CA3"""
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-"""8F7E45DCDD260713_2353F54D549640D0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCSC3=CC=C(C)C=C3""",21,"""D5F4CEDDBB594CA3"""
-"""F5F83DCF8A7C97B2_5658917DADDEE5F7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC(=O)NC3CC3""",21,"""D5F4CEDDBB594CA3"""
-"""ACFD9828B0CCF613_F00BFA9F99BF3AF8_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(C=CC=C3)O4""",21,"""D5F4CEDDBB594CA3"""
-"""49334619DD599CBA_98E714CB18A35FE6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC[S](CCC(N)=O)(=O)=O""",21,"""D5F4CEDDBB594CA3"""
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-"""DD4F3365A03406FF_A5E29E2FEF58B4DA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCC(N(CC)CC)=O""",21,"""D5F4CEDDBB594CA3"""
-"""39F18796677D16D2_110E6E798DAB468A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCCC(OCC)=O""",21,"""D5F4CEDDBB594CA3"""
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-"""B31BE303ED92268F_35640AFACCE05175_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(F)C=C(C=C3)C#N""",21,"""D5F4CEDDBB594CA3"""
-"""58FBB9885B23719E_65951DEB3B397DB8_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(C=CC=C3)[NH]4""",21,"""D5F4CEDDBB594CA3"""
-"""FE0A4A5C4AAD3F58_CADDF2137FDECF18_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=NO3)CC(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""268B31F00D9EAC6F_8BDBED04E93F42BC_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C=C(C)C=C3C)C""",21,"""D5F4CEDDBB594CA3"""
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-"""543FB888E600D0AB_79A0F8578E7BE029_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCOC3CCCCC3""",21,"""D5F4CEDDBB594CA3"""
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-"""9348DD94D046DD2E_3C9FC8E134BCA810_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC4=C(C=C3)CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""4A6D58E51A1FEC56_4ADF9DB6CD40B79D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOCC3CCCCO3""",21,"""D5F4CEDDBB594CA3"""
-"""074B96C50952B44D_6C278AEA5E776E84_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3OCCN(C(C)C)C3""",21,"""D5F4CEDDBB594CA3"""
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-"""913FC1CB8B08ACC4_F0E143B2BDC89A49_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=N3)OCC""",21,"""D5F4CEDDBB594CA3"""
-"""BC27AEFDFF826860_C45E253B47294F7E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=NO3)C(OC)C""",21,"""D5F4CEDDBB594CA3"""
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-"""3DEBCEF00BC3690C_EE0A3633C7AE822D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3ON=C(C(OC)=O)C3""",21,"""D5F4CEDDBB594CA3"""
-"""4D3C1EFD3396CF45_9CDCB9FDC69E1A43_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=CS3)C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""DB5B23065CD2CBC4_1CA43E00C4339383_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(N=CC=C3)[NH]4""",21,"""D5F4CEDDBB594CA3"""
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-"""7D540F631A4E8B96_777D5803E4EAB2FE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3)COC""",21,"""D5F4CEDDBB594CA3"""
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-"""4F96E148A3D95C94_59BDB6FD754D6E20_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3CCSC3=O""",21,"""D5F4CEDDBB594CA3"""
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-"""3C30A0765A1CE02E_0CC69C59A89136F1_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCC[N]3C=CN=C3""",21,"""D5F4CEDDBB594CA3"""
-"""0D332D9123637701_B3631E6AEE60B898_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCOC(NC(N)=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""5EF73D5FEAC2993F_58B85C27ABA6D114_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCC[N]3C=CN=C3C""",21,"""D5F4CEDDBB594CA3"""
-"""5B538096B8CF43AD_698A59460B932937_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=NO3)C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""61F1A61E1B3B19D2_00940D33928C46AA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC(N(C)CCC#N)=O""",21,"""D5F4CEDDBB594CA3"""
-"""DA91F51AC4B89AA8_1BBE20DF192782C2_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N(CCCC)CC)=O""",21,"""D5F4CEDDBB594CA3"""
-"""59394C8BCD85FA5C_A8596405C28DA120_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC(=O)N3CCCCC3""",21,"""D5F4CEDDBB594CA3"""
-"""3EC1B16466FEEB9F_AAD0F57C2DB88CBB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(OC)C=CC(=C3)F""",21,"""D5F4CEDDBB594CA3"""
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-"""EDF9501FD6F3BA3B_A703B862B57727E5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=CC3=C(C=CC=C3)O4""",21,"""D5F4CEDDBB594CA3"""
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-"""C2440F161D38D0CC_03F33DF08EE17611_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3CC(CC(C)C3)C""",21,"""D5F4CEDDBB594CA3"""
-"""E329E77F9549791F_FA831FCF4F15DD20_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C(N=C(C)O3)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""94788CCE78591336_D194CCBC1548D5F9_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3=NC=CN=C3""",21,"""D5F4CEDDBB594CA3"""
-"""38420C6235051C2D_90792A1DC53DF766_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3=CN=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""39B2C2034E334E00_C02A42102733F61E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=N3)N(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""2703C7717476D397_6DFE6FAC6ED28052_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C(C)[N]3C4CC4""",21,"""D5F4CEDDBB594CA3"""
-"""5BB865686ABA08A2_FFEFD5472A26304B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=CC3=C(C=CC=C3)S4""",21,"""D5F4CEDDBB594CA3"""
-"""9D199BE54E7EEF7B_C6B1858B1F336A0E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3CC4CCC(C3)O4""",21,"""D5F4CEDDBB594CA3"""
-"""DFC9B88919CFEA9A_C5103CA9DCC3CAEA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CSC(=N3)C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""63D82865E1C9B40E_CA4C229B5B912FBE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC(=N3)C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""8DCCA5666AB2588A_BCB47E32148D78D2_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=N3)C(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""C1CB7967FDF39412_D7B02214B9ABE372_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3F)C#N""",21,"""D5F4CEDDBB594CA3"""
-"""56B3F1C02D79E7F4_54D9F0D0C806160B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C([N]3CCC)C""",21,"""D5F4CEDDBB594CA3"""
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-"""280F5F4A61001DA2_9F60C9AAAA2E8DAE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC=C([N]3C)[N](=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""9F31D39D39873B7D_03EB5C48734F7369_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(N=CC=C3)S4""",21,"""D5F4CEDDBB594CA3"""
-"""EA75DCDD10591286_8540D691D61EF113_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(CCC)C=C3""",21,"""D5F4CEDDBB594CA3"""
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-"""8C3AE13976BFB2A3_0361B9A8D20CBB0D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCOC3CCCCO3""",21,"""D5F4CEDDBB594CA3"""
-"""E4DA284DFADB9047_2F3597CF7763AE65_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
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-"""E8553ECC9EDD6F2D_FF5A7F1A459FC29A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=N[N]3CC4CC4""",21,"""D5F4CEDDBB594CA3"""
-"""7A86F4A1A83633B1_E4D8D4021BDF282C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3)[N](=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""D8FD877D0A86EBD4_F1ADD130F58AB2BC_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C([N](=O)=O)C=C3""",21,"""D5F4CEDDBB594CA3"""
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-"""F8D8718E3A548685_D559CB229E8B78A1_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C([S](C)(=O)=O)S3""",21,"""D5F4CEDDBB594CA3"""
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-"""5492814C06B6F38E_8BF22A360887F331_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(OC)=O)C=NO3""",21,"""D5F4CEDDBB594CA3"""
-"""275FA17B731C517D_A06C5A4E75E2F4D7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C4[N]3CCOC4""",21,"""D5F4CEDDBB594CA3"""
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-"""D6DEE2E3C95D3FD5_247F5FA252C98C88_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=NC=CC(=C3)C)=O""",21,"""D5F4CEDDBB594CA3"""
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-"""EE189CB9301FD492_39A5376B93372DAF_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC(=N3)CCOC""",21,"""D5F4CEDDBB594CA3"""
-"""F589F00AC6F79C46_B8FCEA2D6AE7EDE0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=CC3=NON=C3C=C4""",21,"""D5F4CEDDBB594CA3"""
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-"""5DB3CE0118759C55_FF417038245BD94F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=N[N]3CC(F)F""",21,"""D5F4CEDDBB594CA3"""
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-"""32377CDA3C9213FC_8A7A01E4FC01179A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CSC(=C3)C(OC)=O""",21,"""D5F4CEDDBB594CA3"""
-"""B168173FD043F987_D17EA86B342B023D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(CC(C)(C)C3CC3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""4C4572D56054C881_CAEB660608DFEC9F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)C3CC[S](=O)(=O)C3""",21,"""D5F4CEDDBB594CA3"""
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-"""B67EB8B2D4832314_5926FD53536B34F6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)N3CCCCCC3""",21,"""D5F4CEDDBB594CA3"""
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-"""C1A22C9D8A9005A3_901C025BE74A7822_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N3CCCCC3C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""D04B1B0FF8B754CB_1A85B44527DE80F1_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3)C(C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""514A27FC8C6ABACA_DBE2268ED0AA1586_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(O)=O)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""C7BB665683FDCE70_E06E3FCC02457121_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=CO3)C(OC)=O""",21,"""D5F4CEDDBB594CA3"""
-"""9BCA744031271845_016BDE4EE44D20F5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NCCCCCC)=O""",21,"""D5F4CEDDBB594CA3"""
-"""71647A9F45D721FD_DCAF1BCDAC128351_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NCCCOCC)=O""",21,"""D5F4CEDDBB594CA3"""
-"""2646B77B4C465F3D_72E2C03C33CCDA7C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC[S](=O)C3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""D6F01A66192BE748_10742BD6F1F415A2_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NNC(C(C)C)=O)=O""",21,"""D5F4CEDDBB594CA3"""
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-"""E78B008551E58FA2_838E76B49DEE928C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCC3=C(C)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""4C0C9F8AFFE653BE_716C9A0F9D344BBA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C(F)C=NC=C3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""6143936C9D93B338_C57C3E1F176FB2F8_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=CO3)C(OC)=O""",21,"""D5F4CEDDBB594CA3"""
-"""29108265600F43B7_ED6B5BCA614A7698_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=CS3)C(OC)=O""",21,"""D5F4CEDDBB594CA3"""
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-"""AC3EF1B1119A586A_26D1236FB5CC9779_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)N3CCNC(=O)C3""",21,"""D5F4CEDDBB594CA3"""
-"""8525596B21D93F43_2C69107FAEFA0EE4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C([N](=O)=O)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""A211A5ABDF1E890E_DAEF814EBC602339_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)CC3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""ABAA0A53A2783B38_5EB54A7473D219D0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(N=C(CCC)O3)C""",21,"""D5F4CEDDBB594CA3"""
-"""483AFF3D8AA54A27_99354DF12297E916_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC4=C(C=C3)COC4""",21,"""D5F4CEDDBB594CA3"""
-"""F52647A316876956_4A5EE63D16B98CC3_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCC3=CC=CC(=C3)F""",21,"""D5F4CEDDBB594CA3"""
-"""F0CACEC99BAFC7FA_B5A2BEA6E79EACDC_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C(ON=C3C)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""CB1CB9C4F52C2B07_3A3B8E68B31BAC1E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3=CC=CC(=C3F)F""",21,"""D5F4CEDDBB594CA3"""
-"""0B2784A748FCA6D4_F17CCC0EA18C1C5E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCN3CCN(C)CC3""",21,"""D5F4CEDDBB594CA3"""
-"""446B6A3D18D6FD9F_7475F5A2DBAAD32E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCNC(NC(C)(C)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""8F97928DCD94385B_AF295FBA938C3289_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=CN=CC(=C3)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""D204C3D8E30DEE85_2DC4FB5B230A1C07_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C(O3)C4CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""40A0BED6EB003ADF_E75FE8B3F573A34E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC(=O)C3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""48DA33DE840A9151_5C888C95354F0A7D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CSC4=NCCCN34""",21,"""D5F4CEDDBB594CA3"""
-"""2F0E95DD9E111E36_8754D2431C125220_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCC[N]3N=CN=C3""",21,"""D5F4CEDDBB594CA3"""
-"""62E141243C839B37_FB30D6EFECCD472F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C=CC(=C3)F)C#N""",21,"""D5F4CEDDBB594CA3"""
-"""180198C28610E982_B4F79D2B9A9563E0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(N(C)C)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""D61B3B966918FDFE_E453D75CED8B606F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C(C)=O)C=C3""",21,"""D5F4CEDDBB594CA3"""
-"""91FADC2B0D170CEB_CCDC76A5A26B6AAA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CSC(=N3)C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""BA0323DB8EC88B2D_FC4A1A7D6A6C6B28_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOC3=CC=CC(=C3)F""",21,"""D5F4CEDDBB594CA3"""
-"""53183FF9E101BEA5_16C58FDC927078B0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC[N]3N=C(C)C=C3C""",21,"""D5F4CEDDBB594CA3"""
-"""2CA4033C1D006C8C_E2620C16DBD29F24_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=NO3)C(N)(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""E953C750ED824E31_1B1DEB193A5E801A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC(=N3)C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
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-"""E9141EE49B71B3DB_2EF5601FA17F5509_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CN=C(N(C)C)C=C3""",21,"""D5F4CEDDBB594CA3"""
-"""E93FB6E89B6342D7_A2FC53B6AFEB6FFA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C(OC)=O)O3""",21,"""D5F4CEDDBB594CA3"""
-"""AEBE1C5945903303_91FCDA54FBBC50AE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3C(NC(C)C3=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""CA4FA78B53C84F8C_E11E4EA553057BB4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C=C3)N=[N]#N""",21,"""D5F4CEDDBB594CA3"""
-"""765A3011AAD78BF3_695049D0B50CD077_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCC(NCC(C)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""97B01DAD2909820B_14FC9E9C4BD800AB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CSC(=N3)C(OC)C""",21,"""D5F4CEDDBB594CA3"""
-"""0FAF83660F197679_8449DC67FB31A927_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CN(C3CC3)C(=O)O4""",21,"""D5F4CEDDBB594CA3"""
-"""62BB423CAB64793C_760BAE81CCFA7B83_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3(CCCCC3)C#N""",21,"""D5F4CEDDBB594CA3"""
-"""157E279A326F801C_84AA1B33134FCE6D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCCCCC(O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""9D0D420437ECF05E_C72834C9E533CD6D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3CC(OC(C)C3)C""",21,"""D5F4CEDDBB594CA3"""
-"""0CECD03F4D60B916_830F1FDB4FC626B9_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C=C3)CC#N""",21,"""D5F4CEDDBB594CA3"""
-"""76B1643D8078F68E_F9149E6B4AD29CF6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C(C(F)(F)F)S3""",21,"""D5F4CEDDBB594CA3"""
-"""D5B4A05CCF7BE873_DAD291EC87FED623_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3CC(C)CC(C3)C""",21,"""D5F4CEDDBB594CA3"""
-"""7F3071A873E23239_EB9D68435C7CE2B8_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3=C(F)C=CC=C3F""",21,"""D5F4CEDDBB594CA3"""
-"""88E60562C49431CE_4E96CDB98A28C456_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=N[N](CC)N=C3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""58F4443DB0421991_CCECF5BFC275AF26_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=N[N](C(C)(C)C)N=N3""",21,"""D5F4CEDDBB594CA3"""
-"""082DB779863495FE_6732D6AF5EBADC6A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3NC(=O)C=CC3=O""",21,"""D5F4CEDDBB594CA3"""
-"""33A9553E016A063A_94E17457B0DEBC80_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3(C(OC)=O)CC3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""7D03AA46E39CEA39_DABC50379A38A4AB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3C(CN(C)C3=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""DD7C0F45AB217264_F2D8B462E10832B9_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=N[N]3CCCCC3=C4""",21,"""D5F4CEDDBB594CA3"""
-"""E86C42BFDA23457D_2065EDE4AD3DF7C3_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3CN=C(C(C)(C)C)O3""",21,"""D5F4CEDDBB594CA3"""
-"""0306B9A4CFEFFBD8_FB1F7D39B7198E5A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C[N](C(C)(C)C)N=C3""",21,"""D5F4CEDDBB594CA3"""
-"""E35ACED9510D7B75_B5C4C707C6CAECFC_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC4=C(C=C3)C=N[NH]4""",21,"""D5F4CEDDBB594CA3"""
-"""85EC1AFF6572F923_DF47F368F1578415_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCSC3=CC=CC(=C3)F""",21,"""D5F4CEDDBB594CA3"""
-"""471FAF545E7D7FB3_21BD533DD6403323_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOCC3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""3DCD3FA8A2AC8206_C14B1039389BBCEE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC[P](N(C)C)(=O)N(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""E83EEC00EB55AC49_E397EC74E0F38115_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N=[S](N(C)C)(=O)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""BB00063FB1C32F3E_63585E0E2A22BCBD_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCSC3=CC=CC(=C3)C""",21,"""D5F4CEDDBB594CA3"""
-"""1B383A3E7B0B7453_BC6FA63555942E55_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=N[N]3C)C4CC4""",21,"""D5F4CEDDBB594CA3"""
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-"""5540C185A365DC40_FC586F4BD4B3900C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(OC)C3CCCCC3""",21,"""D5F4CEDDBB594CA3"""
-"""B9C22C17681E2390_65D55C64237F7A0B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=C(C=N3)C)OC""",21,"""D5F4CEDDBB594CA3"""
-"""0ABC914F83C801F6_A5F137E14ED05D80_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=NO3)C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
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-"""AFB1282ABBF85915_A3285D872EAF20F6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=COC(=C3)[S](C)(=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""9526F5C107475CCF_2D049A990515FF45_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC#CC3=NC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""D94A9A31D41387BF_6D287C48BC8A793C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=CC=C3)N=[N]#N""",21,"""D5F4CEDDBB594CA3"""
-"""CC187E9532F889FF_6353FEEFCEF091E3_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=NO3)C4CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""F5192CF0D2072068_6DB893FBB9721A39_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=C(C)C=C3)C#N""",21,"""D5F4CEDDBB594CA3"""
-"""628BA7F37A5FFD3F_9F7A7AB5DF260B19_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(N=C(C)C=C3C)C""",21,"""D5F4CEDDBB594CA3"""
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-"""D7156AF9F0D2E00A_AB29454C1F43E8B7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(OC)=O)C=CS3""",21,"""D5F4CEDDBB594CA3"""
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-"""2D3725D9CD6B8F6C_7358B072E6A249C1_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CC3(CCCC3)CO4""",21,"""D5F4CEDDBB594CA3"""
-"""DE3F0B04CE7C6B60_BFE1FCEB1F27CE7C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C(F)C=CC=C3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""D63C4C566A852D2F_44B9AFFF236643B7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=CS3)C(OC)=O""",21,"""D5F4CEDDBB594CA3"""
-"""93C64BB244F95086_C78774EA3E09AF65_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(CCOC3)O4""",21,"""D5F4CEDDBB594CA3"""
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-"""A043B5C59A7C420A_3136C204824B90A9_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(CCCC3)O4""",21,"""D5F4CEDDBB594CA3"""
-"""B40A27690E9722A9_59BCBBF4898D31BA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C([N](=O)=O)N=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""544D721045DA575E_1C3E15AA21FF4FFF_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC(=N3)C4CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""42D5FD0F2A8CA3F9_65728C43E74D0B87_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC=C[N]3CC(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""92F83EF29C6C3E1F_10B1CFC1C9337EBE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CCC3(CCC3)CO4""",21,"""D5F4CEDDBB594CA3"""
-"""AA00AD35F082432A_208B4092F6D20586_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CN=C(N=C3)C4CC4""",21,"""D5F4CEDDBB594CA3"""
-"""64C18CB66D49A55D_DD89662EEB46E6C7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=COC(=N3)C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""6E9FB6B0BB315D76_908BC333FD6F7EA4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3=NC=CC=N3""",21,"""D5F4CEDDBB594CA3"""
-"""24A6D27DAE7B950A_EFF72D304162863C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=C(OC)C=C3)F""",21,"""D5F4CEDDBB594CA3"""
-"""C0DB566AE33F4F3F_D61B94315C6A99A0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC4=C(C=C3)[NH]C=N4""",21,"""D5F4CEDDBB594CA3"""
-"""FCF01A9659C2CED2_D7B02667644B2AC5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOC3=CC=C(F)C=C3""",21,"""D5F4CEDDBB594CA3"""
-"""A31AD6BBA95C8F23_6B6D648D22CBE2A5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=CC=CC(=C3)F)=O""",21,"""D5F4CEDDBB594CA3"""
-"""96589A5AF4F44542_534B1D11698AF22D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=COC(=N3)C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""F4EE62C9CD2FD62B_25704DDFE5AA3696_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC4CC3(CNC3)C(O4)=O""",21,"""D5F4CEDDBB594CA3"""
-"""A4C06CB4D7EA1099_1123360D56F4E756_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCSC3=C(F)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""5F7A29D29CA5865A_670C72435FB8F50A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3CCC(C(F)(F)F)O3""",21,"""D5F4CEDDBB594CA3"""
-"""FCCF51D2D3CBB665_68FD830B5299EDC0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=CC(=C3)C#N)F""",21,"""D5F4CEDDBB594CA3"""
-"""A7895690CEDA283D_6B6498FD84297EDF_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3CCCCC3""",21,"""D5F4CEDDBB594CA3"""
-"""3FA1BDFA2A6A2E9C_BE878323A63BB890_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOC3=C(F)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""C767A195F6AC8049_3A2AE2ED86C10A46_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOC3=CC=CC(=C3)C""",21,"""D5F4CEDDBB594CA3"""
-"""1E563335CB51EE2C_C72CC6A8C05A4ACE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(SCC)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""B5FD0B0727636377_16A06D62419CF5E2_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=CO3)C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""2844CDB2E3DE3547_457524080A22F91E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C[N](C(C)C)N=C3C""",21,"""D5F4CEDDBB594CA3"""
-"""5CC6E9CEABF28783_602AFDBF6F3FFF81_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CCCC3(CCC3)O4""",21,"""D5F4CEDDBB594CA3"""
-"""64E35967A839B801_707BB15F52254991_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC4=C3COCC4""",21,"""D5F4CEDDBB594CA3"""
-"""340483CD8DB2E4C5_ECD2A88BBF3C53CF_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(B(O)O)C=C3""",21,"""D5F4CEDDBB594CA3"""
-"""7B54659BC3CBE473_FB22A3B97DDB16BE_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC4OCC3(CCNC3)C4""",21,"""D5F4CEDDBB594CA3"""
-"""16903854D4DC841E_F13CE2F6C59EA254_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=N[N]3C4CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""409555EDC644C16E_C7ED2805A4CE36CF_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(C)C)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""8F2DEFBA7178D53B_17A4D488D502B021_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)C3=CC=CNC3=O""",21,"""D5F4CEDDBB594CA3"""
-"""1F8A7DED82B2813B_92B8EBC5F3E7B793_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C(N=C(C)S3)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""A657B6DF774108BA_193579477244A760_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCC3(CCC3)C#N""",21,"""D5F4CEDDBB594CA3"""
-"""04F369C389F748CC_A307CFF2AC551B47_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(ON=C3C)C4CC4""",21,"""D5F4CEDDBB594CA3"""
-"""59D66B7D9624BB7B_ADC0FF6359AA1E89_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC3OC(CC34CNC4)=O""",21,"""D5F4CEDDBB594CA3"""
-"""C0DFEA3ADE711C51_BD1AF6BF486D2616_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3OC(=O)CC34CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""926D051DCDE29793_7277FAB1BB275F19_6039_DP""","""O(C2CCC1(CCCC1)CC2)CCC3(C(O)=O)CCOC3""",21,"""D5F4CEDDBB594CA3"""
-"""54B90ED478336956_3099FE196B5959AE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(CC(OCC)=O)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""63F0FC5EB950E14B_90FD551C18D314D6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(CCC)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""5D4DF1ADCB7F1DC8_5E2192B91AB54731_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3CCC(F)(CC3)F""",21,"""D5F4CEDDBB594CA3"""
-"""A33A42BEEC6C50DB_692868FDED43220A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3=NN=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""6985712ED2DE64A0_0711FE03FBA2F2C7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=N[NH]C4=C3COCC4""",21,"""D5F4CEDDBB594CA3"""
-"""5B7B417B3E6924A7_0AA811D0F344A744_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(F)F)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""6D20E16A2C41469C_4EDCF89742E439A4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CSC(=N3)COCC""",21,"""D5F4CEDDBB594CA3"""
-"""E345213B8D574AED_F89D46B5E8A0C1B2_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=C3C=CC=CC3=NO4""",21,"""D5F4CEDDBB594CA3"""
-"""B7BC65B04AB19D6C_9210C15B450B9B57_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC4=C(C=C3)[NH]N=C4""",21,"""D5F4CEDDBB594CA3"""
-"""DCE24C7A98B736AC_CD70439A98FAF702_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC34OCC(C)(CO3)CO4""",21,"""D5F4CEDDBB594CA3"""
-"""831E9785DDD1241E_FECC3DCB374B0B8B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C([N](C)N=N3)C(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""C2047F5D487B94B7_93187AE9DF74485E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=NC=C3)OCC""",21,"""D5F4CEDDBB594CA3"""
-"""165EED02249075C7_4486174D308B8A92_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=NO3)C4CNC4""",21,"""D5F4CEDDBB594CA3"""
-"""6624DCE969B387D7_931810AD954301D5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC[S](CCC(O)=O)(=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""36025E0E6D49B234_4DA2618E387B8037_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC3=N[NH]C4=C3C=CC=C4""",21,"""D5F4CEDDBB594CA3"""
-"""E6F905ADBCB2799F_DC76B0BB85541432_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCO[S](C(F)(F)F)(=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""DBD0E833A898802B_991164750B6D94A6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=C3SC=CC3=CC=C4""",21,"""D5F4CEDDBB594CA3"""
-"""9DCCBDE0114795AF_6CEC933069526FEC_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC4=NC=N[N]34""",21,"""D5F4CEDDBB594CA3"""
-"""E27374EC4606DD8F_7EC988842DEB8294_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3CCC(F)(F)C(N3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""EB5B8BAF5661A1A2_63FCCBA4146B8AF5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C[N]4C3=NC=C4""",21,"""D5F4CEDDBB594CA3"""
-"""E3DAA2F20B98F2E9_C1FCABAB5FCC9328_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CC3COCCC3O4""",21,"""D5F4CEDDBB594CA3"""
-"""FDD2C3C4892CB24B_B874C8A6D3141899_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)CCC3CCCC3""",21,"""D5F4CEDDBB594CA3"""
-"""268A35832603F138_10A9B9B4357D0E12_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C(C)SC(=C3)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""08DCB36833FD0F9F_A0D69316DB77549C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC[S](CCOC)(=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""CEF4E2573DAE01FE_DB4F82FF1AA7889B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CSC(=N3)NC(C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""280A1FA95A0CFEBB_2EFFB1AA25CF3969_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=N[N]3C4CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""AF55D2E811BF49EC_1029BD97BEC61AA9_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC(=N3)CC(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""B4FC89F15ED51BC8_A79DD845E3502494_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOC3=C(C)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""0A0199DF75E439A8_0C11BC6A93FE706D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=N[N]3CCCC""",21,"""D5F4CEDDBB594CA3"""
-"""96CED1F1E170F51C_3B71B0B4DC0102D0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C(C(F)(F)F)O3""",21,"""D5F4CEDDBB594CA3"""
-"""2B0B76F0AC824E57_C737691CD4DECB50_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=C(F)C=C3)C#N""",21,"""D5F4CEDDBB594CA3"""
-"""D6355F8207AC1DA1_E8CD5B7376C188A2_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C([S](C)(=O)=O)SC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""A4B3DD70B8175CC0_955A335AFF0EE259_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C([S](C)(=O)=O)O3""",21,"""D5F4CEDDBB594CA3"""
-"""98114B85724018D1_CD7A75BA8AB15D9D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NSC4=C3C=CC=C4""",21,"""D5F4CEDDBB594CA3"""
-"""FB8F08A0A8E31EFE_A92E6EA621462A3E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(OC=N3)C4CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""54CAF03066745178_9A84F772E17B6552_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOC3(CCOC3)C#N""",21,"""D5F4CEDDBB594CA3"""
-"""3417215BA3CB020B_0B4E5D7514059C05_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3C4CCN(C3)CC4""",21,"""D5F4CEDDBB594CA3"""
-"""C434F2F624E42E47_795777FC38FA0276_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=CC3=NC=N[N]3C=C4""",21,"""D5F4CEDDBB594CA3"""
-"""BA153F80684D4030_DD41A604EEA2F202_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=NO3)C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""D19A177F99C728AA_3D1C8E16F1B81F20_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3NC(=O)CC34CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""D6EF80BB0680A62E_A8B3E39BB431DEBB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(CCCC3)[NH]4""",21,"""D5F4CEDDBB594CA3"""
-"""CB31430F2478E061_34CD17720A00D61D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3CCCC(O3)C4CC4""",21,"""D5F4CEDDBB594CA3"""
-"""7F6342048946AA77_DFB6173B434A0D0B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(CCCC3)S4""",21,"""D5F4CEDDBB594CA3"""
-"""FDB9D0439A056C0B_7F029D810E2AC484_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=CC3=NSN=C3C=C4""",21,"""D5F4CEDDBB594CA3"""
-"""096DDF98DC2906D9_2B46C8DCE396E0BA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=CC=C3)C4CC4""",21,"""D5F4CEDDBB594CA3"""
-"""E5E05E41A0B8DFBE_0F8F754F41F0B01E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(OC)C3CCCOC3""",21,"""D5F4CEDDBB594CA3"""
-"""54E264FD40C60D59_64BFC27F0805701E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=N3)CCC""",21,"""D5F4CEDDBB594CA3"""
-"""88C3F0C292B610D5_64EC67015ADF5D9F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CN=C(OC)C=C3C""",21,"""D5F4CEDDBB594CA3"""
-"""9D9A081155BF47C9_CCFAA24734BD164D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC4=NC=C[N]34""",21,"""D5F4CEDDBB594CA3"""
-"""0D80F866F9C24AC3_12DAF44F6E97AA7E_6039_UN""","""O(C2CCC1(CCCC1)CC2)C[C@@H]3O[C@H]3C4=CC=CC=C4""",21,"""D5F4CEDDBB594CA3"""
-"""E31411376BD295E9_9C22668D83474684_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=CC(=NC=C3)F)=O""",21,"""D5F4CEDDBB594CA3"""
-"""456C54249419A07B_14381A574056D0E4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3=CC=CC(=C3)OC""",21,"""D5F4CEDDBB594CA3"""
-"""882942F5A8B7826B_A3A22597716CD32E_6039_DP""","""O(C2CCC1(CCCC1)CC2)CCOC3=CC=C(O)C=C3""",21,"""D5F4CEDDBB594CA3"""
-"""05FE6B3CBB051B9C_86E696901DFBDEBB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4[N]3C=CN=C3CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""50C492F178A4D111_146DA8941405B051_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3ON=C(C(C)(C)C)C3""",21,"""D5F4CEDDBB594CA3"""
-"""FED2284428AC01CE_B0B9D3DDDE2DAF93_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CCC3(CCOC3)O4""",21,"""D5F4CEDDBB594CA3"""
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-"""688689B00F1FB961_CDE5F0256E91DB06_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(COCC3)S4""",21,"""D5F4CEDDBB594CA3"""
-"""855B974B76589441_750C4CC9817CE681_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3CC(C)(C)NC3=O""",21,"""D5F4CEDDBB594CA3"""
-"""7476B90D66E46B11_E8AA1963FC950C51_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3=C(OC)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""2987D72B66CDD74B_1D90BBB9E8E548D1_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N(C)C3CCCC3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""55BB8845C33836AD_0339155573F6B3CC_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C=CC(=C3)OC)F""",21,"""D5F4CEDDBB594CA3"""
-"""635F7EDF711D9C6A_53D7EAB09B096D47_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC=C(C(O)=O)C=C3""",21,"""D5F4CEDDBB594CA3"""
-"""9BC09BF70B4508D2_ABB6B5F85D211453_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3C(C)(C)C3(C)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""4D6D2028E0F1F0DA_5B44D2A51E4433F6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=CC=C3)CC=C""",21,"""D5F4CEDDBB594CA3"""
-"""F1DD1F2BDFC600AA_FBFCE55707837C09_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C=CC(=C3F)C)F""",21,"""D5F4CEDDBB594CA3"""
-"""B5D722A28E07BFFA_9C8BACDF70C936C3_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(C)C)ON=C3C""",21,"""D5F4CEDDBB594CA3"""
-"""8831A24E6856D80D_03AA4F408900074D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCO[Si](C(C)(C)C)(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""15638A65BA9E01BB_B21C80B461E146F7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC[S](C(C)(C)C)(=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""36E0CFF18530A156_00E54F06FBADE076_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(OC)C=CC=C3F""",21,"""D5F4CEDDBB594CA3"""
-"""B038868C1D682043_A0283D39543D622B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C[N](CC)N=C3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""1C997F7A506512D7_2A0D60D3706AB38B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOC[P](OC)(=O)OC""",21,"""D5F4CEDDBB594CA3"""
-"""854316B0F6AE5F7F_23DBF3BAF7CE7B06_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC4CC3(CCN3)C(O4)=O""",21,"""D5F4CEDDBB594CA3"""
-"""9ADCEACD8BC1F863_ACCADBAF809D0FB6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(F)(F)F)OC=N3""",21,"""D5F4CEDDBB594CA3"""
-"""0B48F58F3C12F129_FB325C2CDEDC0682_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=CC(=N[N]3C)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""EC77EA1C877F1B0E_3FAA4B81D3D39E8B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)C3=CNC(C=C3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""95BE3FA8DC36C0E8_34B9A10031380F43_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C=C(OC)C=C3)F""",21,"""D5F4CEDDBB594CA3"""
-"""733E2212E7BEA1C9_90C0A2CE38796754_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3=C(C=C(C)C=C3)C""",21,"""D5F4CEDDBB594CA3"""
-"""DE24FFF73003A122_F0AC75A4D984E778_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=NO3)C(C)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""FCF5184B4FC49819_9C5A9F5DD011EBF5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CC3CCCCC3O4""",21,"""D5F4CEDDBB594CA3"""
-"""5E64E15CE21E934A_E1CD3C68734A3191_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CON=C3C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""068F6A288BC702F5_E8A57D1D2C3916AC_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC4=C(C3CNC3)OC=N4""",21,"""D5F4CEDDBB594CA3"""
-"""14B88ECB31B00C82_4E87962B3E3D5C23_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCN3CCOCCC3""",21,"""D5F4CEDDBB594CA3"""
-"""9FD1C1700CA559CE_C88C8B9A2E6E755C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4COC3=CSC=C3O4""",21,"""D5F4CEDDBB594CA3"""
-"""2DA2EF217D178A4C_DA09B72DD5C973E3_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C=CC=C3)CC=C""",21,"""D5F4CEDDBB594CA3"""
-"""01DCEDCFE742F137_2132C243160B250A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CON=C3C4CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""2734ABC32B67272A_11DD1673DD755324_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC=CC3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""7D8A58A6D8E21E28_07FF3672DB2B6A3C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCN[S](=O)(=O)C3CC3""",21,"""D5F4CEDDBB594CA3"""
-"""B4CD56A0A77960D4_5CF0F839B1630C05_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C[N](C(C)(C)C)N=N3""",21,"""D5F4CEDDBB594CA3"""
-"""8A4FC0C7ECDEEA36_5940A78DCC743A32_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C(C)C=CC=C3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""1BE31A7290CACE42_5895321451227B21_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC4CC3(CCNCC3)O4""",21,"""D5F4CEDDBB594CA3"""
-"""C49561E7B4386DB6_A70598C5D6699F6D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3(C(F)(F)F)CCC3""",21,"""D5F4CEDDBB594CA3"""
-"""07423A1F3C707C7A_184959D3AEE75DC7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CSC=C3C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""FC1B8A16E5BFA9F8_1EB31EB1F2FAAE30_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3C(C)(COCC3)C""",21,"""D5F4CEDDBB594CA3"""
-"""45D64FC29868AD0F_0B2362B65D7F494F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C([S](C)(=O)=O)C=CS3""",21,"""D5F4CEDDBB594CA3"""
-"""70068EF742A2B171_BB9E2D68B10D4947_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(OC)C=CC(=N3)C""",21,"""D5F4CEDDBB594CA3"""
-"""9F687DA5348B1515_5228171255CF83AE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3CC[S](=O)(=O)CC3""",21,"""D5F4CEDDBB594CA3"""
-"""D66AD385AD2CECC4_4AB244E98B6AF687_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NSC(=C3)C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""6A137E3B97FF2CF7_E409B3DD9369A5A2_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(N=C(OC)C=C3)C""",21,"""D5F4CEDDBB594CA3"""
-"""DF120E9EDC3924C0_D7A4D3120A2CD1F3_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CSC(=C3)C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""8B01F1EC3FA4F59A_503626B295336BBC_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCCC3OCCO3""",21,"""D5F4CEDDBB594CA3"""
-"""D0F5B3B1E74D2F8D_671AA6768C342C5D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CC3(CC3)[S](=O)(=O)N4""",21,"""D5F4CEDDBB594CA3"""
-"""C1442FE996A82D57_DAE793B5E05A7EA7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC4=C(C=C3)N=N[NH]4""",21,"""D5F4CEDDBB594CA3"""
-"""B8BECD25E57D66DF_00571EF33B91C377_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC4=CC=N[N]34""",21,"""D5F4CEDDBB594CA3"""
-"""8C225C84D34C3898_0FB37E9034731812_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(COC)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""6AD03E0C39B6E9BC_F420BD43A1125709_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCC3=C(C)C=CN=C3""",21,"""D5F4CEDDBB594CA3"""
-"""7919F1223974ABC4_27F0DE99F05B5488_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(C(OC)=O)CO3""",21,"""D5F4CEDDBB594CA3"""
-"""C7EECB50A107BDE6_A8287F00D8F43AE6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=CC=C3)CC#N""",21,"""D5F4CEDDBB594CA3"""
-"""7DCDBBEF1BFA44F2_15F854187F1765EF_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=CS3)C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""DCFE3C70D761821F_25E11F403A9A0004_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=N[N](C)C=C3[N](=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""6F05D345E6677268_3E4793759D541980_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=NO3)C4CNC4""",21,"""D5F4CEDDBB594CA3"""
-"""BD6470C411225666_5B839D9C1C032A10_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC4=C(C=C3)C=CO4""",21,"""D5F4CEDDBB594CA3"""
-"""0DB85309DAB9A645_9C2DA3818CC6CADA_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC(N3CCNCC3C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""BAAEBC8A29DC4F37_8D1A8256E3A5BD69_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC(NC3CCNCC3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""646CF6182DA37081_627ED3B32717F4BA_6039_DP""","""O(C2CCC1(CCCC1)CC2)CCC3(CCNCC3)C#N""",21,"""D5F4CEDDBB594CA3"""
-"""C42A09AEC30932EF_DAB8C6CB540CD97A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C4C=CC=N[N]34""",21,"""D5F4CEDDBB594CA3"""
-"""B2F5B8BEB8CAB306_E3B393A18CD83DA0_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC4=CC3=C(CNC3)C=C4""",21,"""D5F4CEDDBB594CA3"""
-"""CFEC3BA24B45686D_FBFEA4FF3C3EEB19_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NCC(C(OC)=O)O3""",21,"""D5F4CEDDBB594CA3"""
-"""89F0E6B2204BE601_909E0546876EF781_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCNC(=O)N3CCCC3""",21,"""D5F4CEDDBB594CA3"""
-"""50262BDFD86F03B5_807F18B424790967_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC(=C3)CC(C)C""",21,"""D5F4CEDDBB594CA3"""
-"""5FD3FB9BEA7FC577_33308AF1A2BF186D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=N[NH]C(=C3)C(OC)=O""",21,"""D5F4CEDDBB594CA3"""
-"""45A11D1A8E530F19_3B9FAD1E2F392AC0_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC(N3CC(C)NCC3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""CD1B539383E04A18_EF1D772325BF475B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=CC3=C(C=CC=N3)S4""",21,"""D5F4CEDDBB594CA3"""
-"""4FC571AFDF3751DC_668EA0A1EB0C423F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=NC(=C3)C)OC""",21,"""D5F4CEDDBB594CA3"""
-"""F0B1F3C8D4BE364F_22D62C327FA4E274_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC3CNCC4(O3)CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""A556275E8C1D97F3_28C91645147538C9_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=NC(=N3)OC)C""",21,"""D5F4CEDDBB594CA3"""
-"""EFC03C52DF5DD653_0DBDB42717665221_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3CCCO[P]3(N)=O""",21,"""D5F4CEDDBB594CA3"""
-"""96E97E091662DFF3_CADAB8FFFADBDF1A_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC3=N[NH]C4=C3CNCC4""",21,"""D5F4CEDDBB594CA3"""
-"""96775DC625155B26_0DB27B2EA221CC58_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C4C(=N[NH]3)CCCC4""",21,"""D5F4CEDDBB594CA3"""
-"""E3B7074E69A16055_B700E4EB0DB6B958_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3=C([N](N=C3C)C)C""",21,"""D5F4CEDDBB594CA3"""
-"""799EEEE84520C437_0239A7C85F637601_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(OC)=O)SN=C3""",21,"""D5F4CEDDBB594CA3"""
-"""6594ABC82A53A76E_04731D04C8CB1003_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(F)F)C=NC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""01DD12248AA6639B_88BDDA2DC3E80611_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(F)(F)F)SC=C3""",21,"""D5F4CEDDBB594CA3"""
-"""D36FF416332537AF_116B9220FBA130BB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3(C(F)(F)F)CC3)=O""",21,"""D5F4CEDDBB594CA3"""
-"""D985645102437536_21A16C7C24B4D71D_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC3CNC4(CO3)CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""179FD31B92ADB080_65D2CE24CD8AB2A5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(C)(C)C)OC=N3""",21,"""D5F4CEDDBB594CA3"""
-"""7CF2746C45855BB7_65DDED265598BF5D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOCCOCCOC""",21,"""D5F4CEDDBB594CA3"""
-"""58D65147D0CCD2DE_AD1558403D2B219E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C(C(F)(F)Cl)S3""",21,"""D5F4CEDDBB594CA3"""
-"""C3A12022DCE2F340_8F04130FA0C88B2D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC(C(OCC)=O)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""589D299D5EBB257C_E3D02B580D459431_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(SN=C3OC)OC""",21,"""D5F4CEDDBB594CA3"""
-"""AA9A743EECD46E65_ECB274085CEDAB25_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC(=C3)CC4CC4""",21,"""D5F4CEDDBB594CA3"""
-"""DA3E6574848BDC96_AD759B935C2199E6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC4=C(C=C3)OCO4""",21,"""D5F4CEDDBB594CA3"""
-"""0C637B244E38225C_C6FCFFDE8B043C1C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=C[NH]3)C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""2F829B032DBC8B1A_BFFD7412723161B3_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NO[C@@H]4CCCC[C@H]34""",21,"""D5F4CEDDBB594CA3"""
-"""2D501BCB41DA6AAF_32F4F76F3E3929A9_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=NC(=N3)COC""",21,"""D5F4CEDDBB594CA3"""
-"""FF61E25F59D9A239_A6E1EB2C8F37DB46_6039_DP""","""O(C2CCC1(CCCC1)CC2)CCC4CC3CCC(N3)C4""",21,"""D5F4CEDDBB594CA3"""
-"""B400F176D3056779_06FFFD0814AFBFF7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3)C(N)=O""",21,"""D5F4CEDDBB594CA3"""
-"""5453F4B5A85A7531_C3975A9FE414878C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C(OC)=O)S3""",21,"""D5F4CEDDBB594CA3"""
-"""3594C98B7C98E6F5_DB478D89723AB89C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NCCCC(O)=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""18E0185664C845A4_B30759F43C40F2FA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NCC3=CC=CS3""",21,"""D5F4CEDDBB594CA3"""
-"""E8E4FDF1622C5306_F94B8143E3427532_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC4=NON=C34""",21,"""D5F4CEDDBB594CA3"""
-"""3DE8266958B25838_E9A3801D8287C712_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=C[N]3C=CC=NC3=N4""",21,"""D5F4CEDDBB594CA3"""
-"""6EB18A7A5305F244_7631FEDD4E21A397_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOC3CCCCC3C""",21,"""D5F4CEDDBB594CA3"""
-"""06441DC4EF63A568_A48F5E28BC450D3D_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC4=CC3=C(C=C[NH]3)C=C4""",21,"""D5F4CEDDBB594CA3"""
-"""1A85C58EB74435CD_23F570CEDEBE43EA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(=NO3)C)[N](=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""002441F4BA9DA4C0_C5FD1B54EB12C2B1_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOC3=CC=C(C)C=C3""",21,"""D5F4CEDDBB594CA3"""
-"""861A5AA5C2C3516F_CE7FAAFB22E9DFAA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOCC(C(F)F)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""71C6AB8C7AF6544A_289BDDE05DA534C2_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NC(NCCC)=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""3177605252577F4B_8E88BBAA9755A814_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C([N]3C)C4CC4""",21,"""D5F4CEDDBB594CA3"""
-"""8A564A0D4C64749D_D9E2F66A62349C9B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C(S3)C4CCC4""",21,"""D5F4CEDDBB594CA3"""
-"""3605EAD2A2505905_12D75F1A27BF96B9_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3)C(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""50360A6C7E7CBBBB_AB9D15E0C93AB4EC_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=C(C=C3)C)OC""",21,"""D5F4CEDDBB594CA3"""
-"""FFE8423C88C485DB_B3AA2580210340B3_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C=CC=C3)C4CC4""",21,"""D5F4CEDDBB594CA3"""
-"""6473D4CC72636CF6_A9717CF8E6648DAE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CC3(CCC3)C(=O)O4""",21,"""D5F4CEDDBB594CA3"""
-"""6591903E6AA73701_91FF3A35D43A2F45_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NCC(C(C)C)=O)=O""",21,"""D5F4CEDDBB594CA3"""
-"""35FD8481C0668F5A_14E462B6D1F1082F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(C=CC=N3)O4""",21,"""D5F4CEDDBB594CA3"""
-"""C6F3C137DF614364_A9C25D66DE7B21F4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3=CC=C(C=C3)C#N""",21,"""D5F4CEDDBB594CA3"""
-"""372462175B15128B_FBCF74A9297B544D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=C(C=C3)C#N)C""",21,"""D5F4CEDDBB594CA3"""
-"""B437FB514BEE2D68_9286F211E53D7C52_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCN3C(=O)CNC3=O""",21,"""D5F4CEDDBB594CA3"""
-"""B711426338ACC022_E2598682466935AB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C=C3)C4CC4""",21,"""D5F4CEDDBB594CA3"""
-"""B346EFA4E7F8CAF7_C80E7CB692FC1BA9_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC=N[N]3CC(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""FF934E7AB9F58146_80629D3F490EC45D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=C(OC)N=C3)C""",21,"""D5F4CEDDBB594CA3"""
-"""2F22718FDBD99527_2E9C23B875E65F3B_6039_DP""","""O(C2CCC1(CCCC1)CC2)CC4=NN=C(C3CNC3)S4""",21,"""D5F4CEDDBB594CA3"""
-"""0D5CF434E6827F97_F144455893C993ED_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C(C)[N](N=C3)C)=O""",21,"""D5F4CEDDBB594CA3"""
-"""2267F40D55807808_ED45945D5C133DAD_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C(F)(F)F)S3""",21,"""D5F4CEDDBB594CA3"""
-"""962F12DF53B91B98_CD186707FD74084C_6039_UN""","""O(C2CCC1(CCCC1)CC2)C[C@H]3CC[C@@H](C(OC)=O)O3""",21,"""D5F4CEDDBB594CA3"""
-"""760F864D0836945C_B22189302D215864_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CON=C3C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
-"""A36CB53BDA1DAA57_596376F5D1546C33_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC(=N3)C4=CSC=C4""",21,"""E32042D8467CE435"""
-"""615C9C956CB413B1_984C5E09927F4EB1_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CSC(=N3)C4=CC=CO4""",21,"""E32042D8467CE435"""
-"""5D7C3679F5838778_6DD90C73C39FC2DF_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CSC(=N3)C4=CC=CS4""",21,"""E32042D8467CE435"""
-"""AC9CA32AAADBFA7A_22CA70DC3FEB6F09_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=CC=CC(=C3)CC""",21,"""E32042D8467CE435"""
-"""E07EA2FBBD23FD9E_CA378BDF753B25F1_6039_UN""","""O(CC12CN(CC1)CCC2)CCC(C3=CC=C(F)C=C3)=O""",21,"""E32042D8467CE435"""
-"""1206BD6357A3C3BE_E8E501227E263392_6039_UN""","""O(CC12CN(CC1)CCC2)CCCOC3=C(C)C=CC=C3""",21,"""E32042D8467CE435"""
-"""2973F4D582ABAE61_A66B8DA2ACE89B29_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=CC(=CC=C3)C#N""",21,"""E32042D8467CE435"""
-"""DB39CE9506FD220C_8CF36EA377F8C488_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC(=C(C)C=C3)C)=O""",21,"""E32042D8467CE435"""
-"""F7C0464BB6F7F790_5E3687134FF33EB6_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC(=C(F)C=C3)F)=O""",21,"""E32042D8467CE435"""
-"""0FD701C4DEE2A8DC_43E0519AC189FD15_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=CC(=CC(=C3)C)C""",21,"""E32042D8467CE435"""
-"""2E86867977DA38FB_E1B8C29DA9C1AE2B_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(NC(C)(C)C)=O)=O""",21,"""E32042D8467CE435"""
-"""CAFC1CE5AD983340_73B1B00A5141ACD3_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NC3CC[S](=O)(=O)C3""",21,"""E32042D8467CE435"""
-"""81116829B6A479E8_7E902DC1DE9FDE8C_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3=NN=C(CC)S3)=O""",21,"""E32042D8467CE435"""
-"""A2BD66B7FF50FCF5_C5066187EA971211_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(OCC)=O)C=CO3""",21,"""E32042D8467CE435"""
-"""1C1EE81491B6281B_0A1DE7FA6C6D61A4_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=CC=C(OC)C=C3""",21,"""E32042D8467CE435"""
-"""892FC2A96D0936EC_D16DDF73473C235B_6039_UN""","""O(CC12CN(CC1)CCC2)CC(CC3=C(F)C=CC=C3)=O""",21,"""E32042D8467CE435"""
-"""897B6B15DC2DDF77_DD9F84732E1905CF_6039_UN""","""O(CC12CN(CC1)CCC2)CC(CC3=CC=C(F)C=C3)=O""",21,"""E32042D8467CE435"""
-"""ADC601C2B686C401_038908B19D70DD95_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3=C([NH]N=C3C)C)=O""",21,"""E32042D8467CE435"""
-"""9B50EEFAA1B25E60_5E0CAF2C5831D674_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(C(F)(F)F)C=C3""",21,"""E32042D8467CE435"""
-"""5654B900D4C43653_0E69A0175CDD0ED2_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C=CC(=C3)OC)OC""",21,"""E32042D8467CE435"""
-"""11299A73A97088D6_E30E629E4E3D173D_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(C)C3=CC=CO3)=O""",21,"""E32042D8467CE435"""
-"""0A86799F00C73B55_0EFA05042E555251_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=COC(=N3)C4=CC=CS4""",21,"""E32042D8467CE435"""
-"""F449F64E56CB5B94_D0793BE262AAD6D1_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)C4=CSC=C4""",21,"""E32042D8467CE435"""
-"""F666B740A5ECA4A2_34FFA1BE217A6137_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC(=N3)C4=CC=CS4""",21,"""E32042D8467CE435"""
-"""A84D241A6053A04F_BA4A9A92E9655BED_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(CCC(C)C)C)=O""",21,"""E32042D8467CE435"""
-"""D936563AF1FBBE56_91A0D5F9F945F466_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=CC=C(C=C3)C#N""",21,"""E32042D8467CE435"""
-"""112BB29EB5B29D85_231DE2F7EF1AB85E_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NCC3=NC=CC=C3""",21,"""E32042D8467CE435"""
-"""C4704AABFD47C434_F037D747300255C4_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC4=C(C=C3)C=CC=C4""",21,"""E32042D8467CE435"""
-"""1039194CB11A2998_C25405A28031847D_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=C[N]3C=C(C)C=CC3=N4""",21,"""E32042D8467CE435"""
-"""BFDC704C0C18C162_D56991CE726E9518_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=C[N]3C=CC=C(C)C3=N4""",21,"""E32042D8467CE435"""
-"""9E695292BF8AA9E3_7CC18E305B80E863_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC4=C(C=C3)C=CC=C4""",21,"""E32042D8467CE435"""
-"""7998EF37EC4DAC50_610772DC703434AC_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)C(OC)=O""",21,"""E32042D8467CE435"""
-"""B04119E62A2894EA_0186BC044EEB43CB_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC(=C[NH]3)[N](=O)=O)=O""",21,"""E32042D8467CE435"""
-"""337076FE80CD98CE_3E8AEA826DC10F39_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NN=C(O3)C4=CC=CS4""",21,"""E32042D8467CE435"""
-"""A9CEC6ACE1C41DA1_C5AE5639117C0580_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=C(C=C(F)C=C3)F)=O""",21,"""E32042D8467CE435"""
-"""7B8FA1F9A144B806_5D1BF2B637AE71F4_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=C(C=CC(=C3)C)C)=O""",21,"""E32042D8467CE435"""
-"""01E9F1BEEE73B816_F5B528FE67F8E6A6_6039_UN""","""O(CC12CN(CC1)CCC2)CCCCOC3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""8AB6884C2746C4E1_0690D90C4AE961EE_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)C3=CC=C(C=C3)C#N""",21,"""E32042D8467CE435"""
-"""949F4FED01C9DDC3_DE561A38F54BCB72_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=C3N=CC=CC3=CC=C4""",21,"""E32042D8467CE435"""
-"""497C30F05054B410_6006836F7880191C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=N)NC(=N3)N(C)C""",21,"""E32042D8467CE435"""
-"""7E7C09CC750543C5_B73B19E0AEFDB118_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(C)C3=CC=CS3)=O""",21,"""E32042D8467CE435"""
-"""027D816140520E14_4D32469A324EB6ED_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC=C(CC)C=C3)=O""",21,"""E32042D8467CE435"""
-"""6A0D5E29F3CED6E5_FD82DAA96760A931_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NC(=O)C3=CC=CS3""",21,"""E32042D8467CE435"""
-"""ABD4367091E42B8C_337B38CA907EE1F9_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC(=N3)C4=CC=CO4""",21,"""E32042D8467CE435"""
-"""4F2E02C13125FB86_8C38CA82077A03BC_6039_UN""","""O(CC12CN(CC1)CCC2)CCC(=O)NC3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""BFB6A5E0DA7413CB_B043913E96A16628_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)OCC3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""A734F54A36D3FAA6_E72882DB0D68A858_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NCCCC(OC)=O)=O""",21,"""E32042D8467CE435"""
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-"""7B16C245D56663A7_6E6C9BAE119F23DC_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC(=C3)C4=CC=CO4""",21,"""E32042D8467CE435"""
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-"""E23FC126C46693B9_16D93D8B95C5D48B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(C(OCC)=O)O3""",21,"""E32042D8467CE435"""
-"""880B1DF36AB8A60F_18EA80A2CCB65A48_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=C(OC)C=CC=C3""",21,"""E32042D8467CE435"""
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-"""56D65D8240AF3153_290E58BD9559A668_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NCCC3=CC=CS3""",21,"""E32042D8467CE435"""
-"""37978A5293FF314A_F5D154DDE920F07E_6039_UN""","""O(CC12CN(CC1)CCC2)CCN3C(NC(C)(C)C3=O)=O""",21,"""E32042D8467CE435"""
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-"""E12B10137FD44219_CBD20D597C439040_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=NC3=C(C=CC(=C3)F)O4""",21,"""E32042D8467CE435"""
-"""F9F0A2C15530C473_A87428C640B9F647_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(C(C)C)(C)C#N)=O""",21,"""E32042D8467CE435"""
-"""615724AEECC958E7_D5C1C5C21E457258_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C([N](=O)=O)C=CC(=C3)F""",21,"""E32042D8467CE435"""
-"""88613377B556A37E_54B1D28D33A6CF88_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CSC(=N3)CC(NC)=O""",21,"""E32042D8467CE435"""
-"""30D5A03E1A8F2914_8C7848290E1EB4AD_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(N(CC)C)C=C3""",21,"""E32042D8467CE435"""
-"""94A88C731DF3BB6C_37610D718F819A07_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CSC(=N3)N(C)C4CC4""",21,"""E32042D8467CE435"""
-"""7B5C0BE4851F7DDC_7E9F654C74EB22E9_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=N[NH]3)C4=CC=CS4""",21,"""E32042D8467CE435"""
-"""8D45F4F7AD01ED2C_D44AB10D0F30D66E_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C)SC(=C3)C(OC)=O""",21,"""E32042D8467CE435"""
-"""FA86BAAE5FD0EB65_6DFF918A21D557E4_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NNC(=O)C3CCC3""",21,"""E32042D8467CE435"""
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-"""A75A29A73A78D24D_553C86EDC7D4A54F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C=C([N](=O)=O)C=C3)F""",21,"""E32042D8467CE435"""
-"""A0F11DE0447FF68D_42108194ED16540D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(OC)C=C(C=C3)C#N""",21,"""E32042D8467CE435"""
-"""CB91935555D7B24A_C8ED18A41FBE6C94_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CSC(=N3)C4CCCO4""",21,"""E32042D8467CE435"""
-"""27FA05E580267D04_950DC050451A4111_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NCC3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""08F00F9EEF0D5358_310FFADF8FFB35D5_6039_UN""","""O(CC12CN(CC1)CCC2)CCCCCN3CCCCC3""",21,"""E32042D8467CE435"""
-"""4C3530402244345E_8C3F28FA2CAC2FB2_6039_UN""","""O(CC12CN(CC1)CCC2)CC3OC(=C(C(OC)=O)C3)C""",21,"""E32042D8467CE435"""
-"""EA3CC35C47E1FC49_4AD4125EE149831F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(ON=C3)C4=CC=CO4""",21,"""E32042D8467CE435"""
-"""E1F0E1E66A5B6606_19CBD83A065AE2FE_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C4C(=CN=C3)C=CC=C4""",21,"""E32042D8467CE435"""
-"""B7CA6780927BCAE9_6C70003BC6F63CAD_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N(C)C3=CC=CC=C3)=O""",21,"""E32042D8467CE435"""
-"""D0C680C3A09E04FC_BF58E7EAA715052D_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3=CC=C(C)C=C3)=O""",21,"""E32042D8467CE435"""
-"""9BA41B9ABD29231B_4FEDA71DDB238A0D_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3=C(F)C=CC=C3)=O""",21,"""E32042D8467CE435"""
-"""C7948BA01DFBFCFD_93BF18AC219BCDED_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3=CC=C(F)C=C3)=O""",21,"""E32042D8467CE435"""
-"""3E1F83264F97BBC5_BABD99F86BEE8F2B_6039_UN""","""O(CC12CN(CC1)CCC2)CCC(C3=CC=C(C)C=C3)=O""",21,"""E32042D8467CE435"""
-"""DAAB03B3B71B3E81_AA9B9AB16D438718_6039_UN""","""O(CC12CN(CC1)CCC2)CCCOCC3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""44CB20679EAB234D_26B9FFE711048EFF_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N3CC(C)OC(C3)C)=O""",21,"""E32042D8467CE435"""
-"""CC56F7C92F89A604_D29534A6BA55963C_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3=CC=CC(=C3)C)=O""",21,"""E32042D8467CE435"""
-"""C703DAA5EB1866BD_4412C8E181811490_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(SC(C)C)C=C3""",21,"""E32042D8467CE435"""
-"""97600BF19175668B_A9038DABA52AE6DD_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=C(C=CC(=C3)F)F)=O""",21,"""E32042D8467CE435"""
-"""66F7670895859C8A_8A60B895D32126D1_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NN=C([N]3C)C4CCC4""",21,"""E32042D8467CE435"""
-"""C7F41BA970819650_35459C1199C0DFB3_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3=C(C)C=CC=C3)=O""",21,"""E32042D8467CE435"""
-"""8042BCBA5CD04865_C5833FBCCABACC95_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(C(C)C)C(=O)O)=O""",21,"""E32042D8467CE435"""
-"""45DE193F5C838D63_275AD442A8DE316D_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=NC3=C(C)C=CN=C3[NH]4""",21,"""E32042D8467CE435"""
-"""F316DA822E4CF051_3C02C6A6600C4C4F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(N=C(C)S3)C(F)(F)F""",21,"""E32042D8467CE435"""
-"""AE3CDA7D22B44D92_0207A1D2A934B680_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC4=C(C=C3)[NH]C(=N4)C""",21,"""E32042D8467CE435"""
-"""212DCAE5387F3E8F_D596599F042A7AF7_6039_UN""","""O(CC12CN(CC1)CCC2)CC[N]3C=C(C(OC)=O)N=N3""",21,"""E32042D8467CE435"""
-"""2D38374EDE1FF28E_6D29B59AF49D5047_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3=CC=CC(=C3)F)=O""",21,"""E32042D8467CE435"""
-"""E438AB579613F466_0FB96273BF1683B6_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC=CC(=C3)OC)=O""",21,"""E32042D8467CE435"""
-"""7517CEE22F8D6D5F_D178AF1FB901246B_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3CCCCC3C)=O""",21,"""E32042D8467CE435"""
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-"""428D4CBE6CD823D1_A7DA6B2531C10FF6_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N3C(CCCC3C)C)=O""",21,"""E32042D8467CE435"""
-"""2E90BF00B67D2323_7CBA617829434841_6039_UN""","""O(CC12CN(CC1)CCC2)CCC4COC3(CCCC3)O4""",21,"""E32042D8467CE435"""
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-"""F522CDEBFC480260_8CB820F9F1B0882D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(C(NC)=O)C=C3""",21,"""E32042D8467CE435"""
-"""7FCC1FFD3043180B_FE7C3B0D55CC627B_6039_UN""","""O(CC12CN(CC1)CCC2)CC[N]3C(=CN=C3C)[N](=O)=O""",21,"""E32042D8467CE435"""
-"""33D6DE4D34DE1F9A_72F70947CEEF5C6C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC=CC(=C3OC)OC""",21,"""E32042D8467CE435"""
-"""903E8C34CC43E41E_5B9C5B128A678970_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=C(OC)C(=C3)F)F""",21,"""E32042D8467CE435"""
-"""90C17F86A8010159_C242942427F86380_6039_UN""","""O(CC12CN(CC1)CCC2)CC4CCC3(CCCCC3)O4""",21,"""E32042D8467CE435"""
-"""1462479C36E31269_D02ECBA02FA238CD_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3CCC(F)(F)CC3)=O""",21,"""E32042D8467CE435"""
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-"""43667EFA4BA6A7F5_BA7E26849D4BF31C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C([Si](C)(C)C)C=C3""",21,"""E32042D8467CE435"""
-"""D5F31E0D3F6D5006_BDEF8E78A3A45BBF_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NN=N[N]3CC(F)(F)F""",21,"""E32042D8467CE435"""
-"""71C46C7BE3DE36CB_F660CB0C0332628F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=N[N](CC(F)(F)F)N=N3""",21,"""E32042D8467CE435"""
-"""B49F2F459C1CE676_44FBF34C5E720E53_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(C=C3)C4CCC4""",21,"""E32042D8467CE435"""
-"""F47D2EF8E0794A38_CC82041D509958DC_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NN=C4[N]3CCCCC4""",21,"""E32042D8467CE435"""
-"""B635E824010FAF95_E1F250237C790A70_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=N3)C(OC)=O""",21,"""E32042D8467CE435"""
-"""F225E74130E5E6C2_1285A2C21A724A6B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C([S](N)(=O)=O)C=CC=C3""",21,"""E32042D8467CE435"""
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-"""18212EAAFF475B33_AF4100750935DC02_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C([S](Cl)(=O)=O)C=C3""",21,"""E32042D8467CE435"""
-"""7C02A857EC5955A9_530A7B3BD2833D6C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC4=C(N=C3)C=CC=C4""",21,"""E32042D8467CE435"""
-"""F68E1D20FD48A385_C72D2F325F8560A0_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C([S](C)(=O)=O)C=C3""",21,"""E32042D8467CE435"""
-"""15161DA0DED1C07B_7FE30DC75AFEC357_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C=CC=C3)[S](=O)(=O)Cl""",21,"""E32042D8467CE435"""
-"""63E9ED4E5F70A3D3_4FE82A959C13BF3D_6039_UN""","""O(CC12CN(CC1)CCC2)CCCC3(CCOCC3)C#N""",21,"""E32042D8467CE435"""
-"""064E4AD26CC552BB_068DEE379519C819_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(OC)N=C(C=C3C)C""",21,"""E32042D8467CE435"""
-"""D3D4E8AC6833DE55_149E8B3C9011F422_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=CC=C3)[S](=O)(=O)Cl""",21,"""E32042D8467CE435"""
-"""2DEB32401F5DC81C_9B0D570BDDA5C8AD_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(F)(F)F)C=CC=C3""",21,"""E32042D8467CE435"""
-"""850C28BD955FBB6A_53C85323B90DA23B_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)COC3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""EE3F47349F248D4F_47DE415531EF55E3_6039_UN""","""O(CC12CN(CC1)CCC2)CCC(CC(OCC)=O)(C)C""",21,"""E32042D8467CE435"""
-"""C73EF68DDC39B75D_77D5E8B90035DE34_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(NC(C)=O)C=C3""",21,"""E32042D8467CE435"""
-"""16B476FFD4EA21AD_0F340A6F9DEE48C4_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC(=NC=C3)OC)=O""",21,"""E32042D8467CE435"""
-"""D3D4E8AC6833DE55_3D6116999587904B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)[S](Cl)(=O)=O""",21,"""E32042D8467CE435"""
-"""5596551E14DE470B_47E58168B530453B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C([S](F)(=O)=O)C=C3""",21,"""E32042D8467CE435"""
-"""DB9251A549404BDC_C6BA577D9AF8FEF5_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC=CC(=N3)OC)=O""",21,"""E32042D8467CE435"""
-"""9BD5400AB660BB4C_C2381BD5A2E9F030_6039_UN""","""O(CC12CN(CC1)CCC2)CCN3C4=C(CC3)C=CC=C4""",21,"""E32042D8467CE435"""
-"""0E66DA3624BC647D_11E4E9EEBABD648B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(N=C(C(C)C)C=C3)C""",21,"""E32042D8467CE435"""
-"""29DCFCE1A7623E22_147B49706CF3B463_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=CS3)C(OCC)=O""",21,"""E32042D8467CE435"""
-"""C30EE06D7B573E6B_8A9271051FE54680_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=N[N](CC(F)(F)F)C=C3""",21,"""E32042D8467CE435"""
-"""CC31C6C0576538FB_B0809819E97A8FD6_6039_UN""","""O(CC12CN(CC1)CCC2)CCN(C)CC3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""1226EB651BB69A8C_0DB261956BFDFA98_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)[S](C)(=O)=O""",21,"""E32042D8467CE435"""
-"""11D55699A7125FA7_49E38E0C0692078A_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C[N](CC(OC)=O)N=N3""",21,"""E32042D8467CE435"""
-"""4E2B8DA1B7B2FE65_45A29E21E4F027A1_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N3CC(CC(C)C3)C)=O""",21,"""E32042D8467CE435"""
-"""E576CD6DA65F5B63_614E7C3041ECFF43_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N3CCCCC3CC)=O""",21,"""E32042D8467CE435"""
-"""C318741723A88C9A_5AB0C9C99BF010D3_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=N[N]3C4CCCC4""",21,"""E32042D8467CE435"""
-"""CECDA09BBB5FE5F3_1F4C541652DA1BDF_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=N[N]3CC(F)(F)F""",21,"""E32042D8467CE435"""
-"""30C7E822554CA925_E88ACF8ABF44ED7C_6039_UN""","""O(CC12CN(CC1)CCC2)CC4COC3=C(C=CC=C3)O4""",21,"""E32042D8467CE435"""
-"""54B9117694CCAFF4_80FFFDFA060F87BE_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N(C)CC3=CC=CO3)=O""",21,"""E32042D8467CE435"""
-"""F432434235835992_B601490AA70A6B90_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)CCC3CCCCO3""",21,"""E32042D8467CE435"""
-"""1758CB67B07060CA_78A1BE51074FD247_6039_UN""","""O(CC12CN(CC1)CCC2)CCC(NC3=NOC(=C3)C)=O""",21,"""E32042D8467CE435"""
-"""6CB5EC5248BA09F5_6B5C1B79F2D06CAD_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NC3=C(C=CS3)C#N""",21,"""E32042D8467CE435"""
-"""B2B275E71CEAC028_F4456BFD8DC69F0F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC(=C3)C4=CC=CS4""",21,"""E32042D8467CE435"""
-"""E6EF18F7F85B7C57_015D9EA83255627B_6039_UN""","""O(CC12CN(CC1)CCC2)CC(OC)CC3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""AA3C716E8FD425BD_75C4DCF76CC113B2_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=C(C=CC=C3)C#N""",21,"""E32042D8467CE435"""
-"""B2B78513F6932191_8DE431E22807FB56_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(NCCCC)=O)=O""",21,"""E32042D8467CE435"""
-"""CD5842E0A73B5BA5_A0F127434AC3004C_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=NC3=C(C=C(F)C=C3)O4""",21,"""E32042D8467CE435"""
-"""F34DBAAF62D4019D_D3C099FDB209F08C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(ON=C3)C4=CC=CS4""",21,"""E32042D8467CE435"""
-"""783F19BCBF2AD693_E31DF99EC038B1F9_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CSC(=N3)C[S](C)(=O)=O""",21,"""E32042D8467CE435"""
-"""37119E4C2598C907_FCE0F601764F5681_6039_UN""","""O(CC12CN(CC1)CCC2)CCC(CC)(CC)C(=O)OC""",21,"""E32042D8467CE435"""
-"""DB2B1AF057A3F873_6C97B53097B67A6C_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=C(OC)N=CC=C3)=O""",21,"""E32042D8467CE435"""
-"""09880E1E2CB0C0B2_5C8FA295E12DD318_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=C(C=C(C)C=C3)C)=O""",21,"""E32042D8467CE435"""
-"""782F8D616DCF2973_83A20DC1DFCB607B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=C(N(C)C)C=C3)C""",21,"""E32042D8467CE435"""
-"""E2B3C9F2BE69B816_3BD88C9F1D5DF9D5_6039_DP""","""O(CC12CN(CC1)CCC2)CC(NCC3CCCNC3)=O""",21,"""E32042D8467CE435"""
-"""AF9A4D11C748620C_B5D8BF10162FE170_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=N[N]3C)C(OC)=O""",21,"""E32042D8467CE435"""
-"""FAB50A71C5E5C21F_88D260F3CB654944_6039_UN""","""O(CC12CN(CC1)CCC2)CCOCC(C(F)(F)F)(F)F""",21,"""E32042D8467CE435"""
-"""998B9D7A821BADAD_9E9918083C24D1BB_6039_UN""","""O(CC12CN(CC1)CCC2)CCCC3=C(OC)C=CC=C3""",21,"""E32042D8467CE435"""
-"""3AB85BDAD59F32AA_EA0F1D1AB53CAFEE_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(OC)=O)C=CC=N3""",21,"""E32042D8467CE435"""
-"""844C77892FD723EF_770BCD086599100C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=CC(=N3)N(C)C)C""",21,"""E32042D8467CE435"""
-"""26CC92840E33D5F4_A97C396CE813DC95_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N(C)CC3=CC=CS3)=O""",21,"""E32042D8467CE435"""
-"""8557B3289CC7FB61_920542D8F6CA985F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)C(OCC)C""",21,"""E32042D8467CE435"""
-"""FD0A5CC4D2AD6EE0_0C6D57EE4CFDA4EC_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)CC(F)(F)F""",21,"""E32042D8467CE435"""
-"""AD5D46574CC0518C_ADE4C4FC9C2884F1_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)C3=CC(=CC=C3)C#N""",21,"""E32042D8467CE435"""
-"""6063BE09B539106B_9BB4017B11D0A6F4_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=N[N](C=C3)C4CCCC4""",21,"""E32042D8467CE435"""
-"""A750822A27864C38_C7F489B23E771806_6039_UN""","""O(CC12CN(CC1)CCC2)CCCSCC3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""C9F1A4F26B428889_3672D6538C353412_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(OC(F)F)C=CC=C3""",21,"""E32042D8467CE435"""
-"""A4F765E2BAA98CDB_034DC6885163191E_6039_UN""","""O(CC12CN(CC1)CCC2)CCCCOC3CCCCC3""",21,"""E32042D8467CE435"""
-"""D042CD5BC8CDD772_8F51A6CFAD3EE259_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=C(OC)C=C3)C#N""",21,"""E32042D8467CE435"""
-"""C8AE200B4D5BD6EA_B26F368A46E6FA16_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)NC(C)=O""",21,"""E32042D8467CE435"""
-"""A86D58139EDDD430_9A033FEAAFBFF5E3_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(OC(F)F)C=C3""",21,"""E32042D8467CE435"""
-"""464A1C258FF8AE04_AFF0BCE4711BEEE4_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=NC=C[N]3C(C)C)=O""",21,"""E32042D8467CE435"""
-"""D63C47B0F93BD5C2_1A364E0DAC2361E3_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=N[N](C)C(=C3)C(F)(F)F""",21,"""E32042D8467CE435"""
-"""DA1C290718361F54_6EEE1F989C4A60D6_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=N[N]3C)C(F)(F)F""",21,"""E32042D8467CE435"""
-"""2D5BFF1676B7FADF_E397E38F019E36F4_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(CCCCC)C)=O""",21,"""E32042D8467CE435"""
-"""8C1433A88BAD280E_D2031EE567B62560_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C=CC=C3)OC4CC4""",21,"""E32042D8467CE435"""
-"""D12D5E0214485848_F9EC0394ABCDDB78_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3=CC(=N[N]3C)C)=O""",21,"""E32042D8467CE435"""
-"""A426D2530BEA6E79_964AA6F715903E18_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)CCC3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""2040F54049F037E1_65DF499710165E08_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=N[N](CC)N=C3C)=O""",21,"""E32042D8467CE435"""
-"""92CF7D6C357A625F_318B946843905F9C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)CC(NC)=O""",21,"""E32042D8467CE435"""
-"""1B40D5D61D29A291_494F1FF737DF6D9F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3CN3CC4=CC=CC=C4""",21,"""E32042D8467CE435"""
-"""B325314503A8070A_8380F906887ED129_6039_UN""","""O(CC12CN(CC1)CCC2)CCO[S](C[S](C)(=O)=O)(=O)=O""",21,"""E32042D8467CE435"""
-"""16D59535BD3C09CC_5FF611BCD5530591_6039_DP""","""O(CC12CN(CC1)CCC2)CC4=CC3=C(CCNC3)C=C4""",21,"""E32042D8467CE435"""
-"""EB938DB90D7681A4_BD6C6CCAC4AD22A5_6039_DP""","""O(CC12CN(CC1)CCC2)CC(N[C@@H](C(C)C)C(=O)O)=O""",21,"""E32042D8467CE435"""
-"""D72EE71E8124E1BB_33B05B4EA027C894_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)C(OCC)=O""",21,"""E32042D8467CE435"""
-"""CEC589F0E465AEDE_910D823D9DDAB33C_6039_DP""","""O(CC12CN(CC1)CCC2)CC(N[C@H](C(C)C)C(=O)O)=O""",21,"""E32042D8467CE435"""
-"""B246869C1781A93E_BE58B878B2737078_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CN=C(C(F)(F)F)N=C3""",21,"""E32042D8467CE435"""
-"""9A5BFA1BEF6D611C_B9094BE2CEC8D764_6039_UN""","""O(CC12CN(CC1)CCC2)CCC4=NC3=C(C=CC=C3)[NH]4""",21,"""E32042D8467CE435"""
-"""4727DAF540350D47_7C5100A2105308C5_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)C(C)(C)C""",21,"""E32042D8467CE435"""
-"""C616A19F13A83751_9F9C27E6060A795B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC=CC(=C3)OC(C)C""",21,"""E32042D8467CE435"""
-"""211F1F2034434D70_3AD9242D4414D443_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C=C(C(O)=O)C=C3)F""",21,"""E32042D8467CE435"""
-"""CC998601F911D0E6_215AFDF39C025933_6039_UN""","""O(CC12CN(CC1)CCC2)CCCN(C)C3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""73A5627DA700C49F_BB15F90D2F2A39D9_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(F)C=C(C(=C3)F)C#N""",21,"""E32042D8467CE435"""
-"""5524978C2659E53C_F73B106EDE9D87E5_6039_UN""","""O(CC12CN(CC1)CCC2)CCSC3=CC=CC(=C3)OC""",21,"""E32042D8467CE435"""
-"""96E34A5406E3BD9A_240738F6711DA0DF_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3=NSC4=C3C=CC=C4""",21,"""E32042D8467CE435"""
-"""C7C94B08227FD214_19BE10A4ABBC5122_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3=NOC4=C3C=CC=C4""",21,"""E32042D8467CE435"""
-"""4BB2319AC0831FD7_AA500ED8F24795C4_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC4=C(N=C3)C=CC=C4""",21,"""E32042D8467CE435"""
-"""0B3B995B7F4124F2_EA0BD9974921E459_6039_UN""","""O(CC12CN(CC1)CCC2)CCO[P](OCC)(=O)OCC""",21,"""E32042D8467CE435"""
-"""F1BB2A4CA8DCF0BE_99F1588C87134D43_6039_UN""","""O(CC12CN(CC1)CCC2)CCSC3=C(C=C(F)C=C3)F""",21,"""E32042D8467CE435"""
-"""662D4B5E9AB8C13B_461D55D0514E48B5_6039_UN""","""O(CC12CN(CC1)CCC2)CCCOCCOCCOC""",21,"""E32042D8467CE435"""
-"""FC37F63D56334830_C355520E399669D7_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C([N](=O)=O)C=C(C=C3)F""",21,"""E32042D8467CE435"""
-"""FDC38762BFC78D86_1DE129E59DA021B2_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3=N[N](C(C)(C)C)N=N3""",21,"""E32042D8467CE435"""
-"""34C57422D1E2A14C_16A8EE2A17E73895_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3CCC4=C3C=CC=C4""",21,"""E32042D8467CE435"""
-"""6F31303EB70B67E1_5AA21AACF7326A1C_6039_UN""","""O(CC12CN(CC1)CCC2)CCCC(CC(OCC)=O)=O""",21,"""E32042D8467CE435"""
-"""2E4BC0C3921EF681_2EED99453C96999C_6039_DP""","""O(CC12CN(CC1)CCC2)CC3=CC=CC4=C3CCNC4""",21,"""E32042D8467CE435"""
-"""1AE2CD65526DACF8_8E4C0F67BB829F9B_6039_UN""","""O(CC12CN(CC1)CCC2)CC(OC)C3=CC=C(C=C3)F""",21,"""E32042D8467CE435"""
-"""B6A32A87690722C6_9EFF94A585830B02_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=NC3=C(C=CC(=C3)C)S4""",21,"""E32042D8467CE435"""
-"""53F7114552EAEEA9_C00F2ED6D346084E_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(F)(F)F)N=CC=C3""",21,"""E32042D8467CE435"""
-"""46B90E7E20726B90_8C8100B595ABF4F5_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N(CC)CC(F)(F)F)=O""",21,"""E32042D8467CE435"""
-"""6B4675FC30131E87_9947B9E560F745DA_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3=C(C)C=CC=N3)=O""",21,"""E32042D8467CE435"""
-"""896AAABFB1F731E0_3A19D74DCD03B377_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3F)[N](=O)=O""",21,"""E32042D8467CE435"""
-"""8D048FC63DB61CA4_F78E0C3D9C2C0C4C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=NO3)C(OCC)=O""",21,"""E32042D8467CE435"""
-"""5E175A09A3125E3C_31A87CC989CD4406_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC4=C(C=C3)C=CN=C4""",21,"""E32042D8467CE435"""
-"""4227C30CCEE0E07E_EB1D4B71CDC3A604_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=C3CCOCC3=CC=C4""",21,"""E32042D8467CE435"""
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-"""2312E223FCD1A78F_05C4389AB753E265_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=C(C)C=C3)[N](=O)=O""",21,"""E32042D8467CE435"""
-"""482D431E696B82EC_8979C98112D8F6BB_6039_UN""","""O(CC12CN(CC1)CCC2)CC3CC4(CO3)CCCCC4""",21,"""E32042D8467CE435"""
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-"""3C1DC4DD39CB1A05_3601D5BC9B74B21D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CN=C(C(OCC)=O)S3""",21,"""E32042D8467CE435"""
-"""550AB6DF12BF263D_A2078B29172AE1A6_6039_UN""","""O(CC12CN(CC1)CCC2)CC4CCC3(CCOCC3)O4""",21,"""E32042D8467CE435"""
-"""1BA419F80598722F_EF007AC5582FD45A_6039_DP""","""O(CC12CN(CC1)CCC2)CC4OCC3(CCNCC3)C4""",21,"""E32042D8467CE435"""
-"""3472BFF9973760FD_0C29450B7F369A97_6039_UN""","""O(CC12CN(CC1)CCC2)CC4COC3(CCCCC3)O4""",21,"""E32042D8467CE435"""
-"""2AF95CD9065E8ACD_42880F3856210AC6_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N3CC(C)(C)OCC3)=O""",21,"""E32042D8467CE435"""
-"""43DAF4CD5D1B4435_F83B8CC66BBC4DF0_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC=C(OC)C=C3)=O""",21,"""E32042D8467CE435"""
-"""6204E6D554AF8010_C908F6F6C404AC97_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)N3CC4CCC(C3)O4""",21,"""E32042D8467CE435"""
-"""B6B16C75E54F6815_D29BC85DBF912083_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC=C(F)C=C3)(F)F""",21,"""E32042D8467CE435"""
-"""BC2D426A174E4229_FCADD70AB602D616_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NC3CCCCCC3""",21,"""E32042D8467CE435"""
-"""2296EE7BF7EBD33A_A704D83F6C57FD18_6039_UN""","""O(CC12CN(CC1)CCC2)CCCOC3=CC=C(F)C=C3""",21,"""E32042D8467CE435"""
-"""34A018B40FF78DCC_565B045A5DF31EBB_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC(=O)C3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""557C0D544E4E9B89_1BFA056751F569C7_6039_UN""","""O(CC12CN(CC1)CCC2)CCC[S](NC(C)(C)C)(=O)=O""",21,"""E32042D8467CE435"""
-"""CB63CA1879FCCD9F_BDB0ED5580128909_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=C(OC)C=CC=C3)=O""",21,"""E32042D8467CE435"""
-"""9398961E8DECEDFD_D1D5C3B568668586_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)C(F)(F)F""",21,"""E32042D8467CE435"""
-"""EE6FD1EA04C02676_71B31103CEA86137_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(F)C=C(C(=C3)C#N)F""",21,"""E32042D8467CE435"""
-"""EEE8DE4A9FC36D6B_3791991FF4AA9FC4_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(CC(C)C)C=CC=C3""",21,"""E32042D8467CE435"""
-"""73E2C803EE227F4A_CBC0B0F278F908A1_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NCC3CCCCC3""",21,"""E32042D8467CE435"""
-"""FDC6F96ECC342C4E_9BD94E37649A64AE_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N(C)C3CCCCC3)=O""",21,"""E32042D8467CE435"""
-"""1EFF8AA74FD28806_FE0478833D660D0D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)COC(C)C""",21,"""E32042D8467CE435"""
-"""F982170EC1F78972_A24E56D219A43A68_6039_UN""","""O(CC12CN(CC1)CCC2)CC4COC3(CCOCC3)O4""",21,"""E32042D8467CE435"""
-"""E93D43AA560FFBA0_C6E9AEFB951E9FE9_6039_UN""","""O(CC12CN(CC1)CCC2)CC3CCCC(C(F)(F)F)O3""",21,"""E32042D8467CE435"""
-"""AE456B1D15278BC6_32FEB6877EAB3B12_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NSC(=N3)C(OCC)=O""",21,"""E32042D8467CE435"""
-"""DBA858FD889F209D_569688F671D8CF61_6039_UN""","""O(CC12CN(CC1)CCC2)CCCCCCCCCCC""",21,"""E32042D8467CE435"""
-"""F8F7C80FE278D6D9_6CC32BC65B9A6D80_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NN=C4C(=O)NC=C[N]34""",21,"""E32042D8467CE435"""
-"""F84BBFB201DC3C2E_E1473F69D6DBB8F1_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=C(S3)C(C)(C)C)C""",21,"""E32042D8467CE435"""
-"""625740B35B698F17_137EE56A24060F00_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC4=C(C=C3)C=NC=C4""",21,"""E32042D8467CE435"""
-"""D89D3651FAF8A1D6_AE75BB7A2BDCEE63_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C)C=C(C=C3C)C#N""",21,"""E32042D8467CE435"""
-"""3FD5DE2EFBDE1157_0E282B1DADE0C3C7_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CN=CC(=C3)C(OC)=O""",21,"""E32042D8467CE435"""
-"""BFA86D078FB669F2_77291E46EE6CF493_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)[S](F)(=O)=O""",21,"""E32042D8467CE435"""
-"""77A3DA98A1B105A6_8A733D81C9CB2EA3_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(CC(C)=O)C=CC=C3""",21,"""E32042D8467CE435"""
-"""D7B782B99B3EC630_EC47F9ECAB2F1D1E_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=NN=C3C4CC4)C""",21,"""E32042D8467CE435"""
-"""531B1EB5AFB3D56D_F3D8147176736DDC_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=N3)C(F)(F)F""",21,"""E32042D8467CE435"""
-"""3074A6429882BCD6_C531AD51936322DB_6039_UN""","""O(CC12CN(CC1)CCC2)CCCN3CCC(F)(CC3)F""",21,"""E32042D8467CE435"""
-"""BB62193D86F8E150_CDC069414507BC9D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C)C=CC(=C3)[N](=O)=O""",21,"""E32042D8467CE435"""
-"""B51C877162CD87D3_327E2250A15E47C8_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C=CC(=C3)C(O)=O)F""",21,"""E32042D8467CE435"""
-"""119EC3AF7361F63E_9B89D1B4FE6B2229_6039_UN""","""O(CC12CN(CC1)CCC2)CCNC(=O)C3CCOCC3""",21,"""E32042D8467CE435"""
-"""DCD210E951188AE1_34AA7ECD592C1C8F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC=CC(=C3)C(OC)=O""",21,"""E32042D8467CE435"""
-"""74FACAF63039E6B3_F288B593270BF564_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC4=C(C=C3)COCC4""",21,"""E32042D8467CE435"""
-"""74A91C422683DF4C_697DDAB5318DE0B6_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3CC[S](=O)(=O)CC3""",21,"""E32042D8467CE435"""
-"""67EEE028ED9E6759_3392E81A5EA8EA9D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NSC4=C3C=CC(=C4)F""",21,"""E32042D8467CE435"""
-"""23ACFD4A0D12B03E_9F524CDA81B47462_6039_UN""","""O(CC12CN(CC1)CCC2)CCCNC(C(CC)CC)=O""",21,"""E32042D8467CE435"""
-"""F6CB87460A2DF6B7_AEEECE11E9C0BD61_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(F)C=C(C=C3F)C#N""",21,"""E32042D8467CE435"""
-"""7243D156E2C005E9_4F937310310A1F5C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3(F)OC(=O)CC34CCC4""",21,"""E32042D8467CE435"""
-"""42358688036A88AC_66043C57E18CA29A_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C([N](C)N=N3)C(F)(F)F""",21,"""E32042D8467CE435"""
-"""B784A6DCFD94369D_D802C5263AD6DF55_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C[N](C)N=C3C(F)(F)F""",21,"""E32042D8467CE435"""
-"""4FAFD34AB1948E7A_8E5039A1F3B7DFF6_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=C(OCC)C=C3)F""",21,"""E32042D8467CE435"""
-"""40E58B51D7D90198_680FC7CEAEB6EE27_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=NC3=C(F)C=CC=C3O4""",21,"""E32042D8467CE435"""
-"""260DFC133A90BA9F_99869BCE209F439B_6039_DP""","""O(CC12CN(CC1)CCC2)CC3OCCC34CCNCC4""",21,"""E32042D8467CE435"""
-"""6B96F82EBBC7E99C_7196AD0BCC5B0A3B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C([S](N)(=O)=O)C=C3""",21,"""E32042D8467CE435"""
-"""DE7967B779BCE2BB_090BE0A95D149C90_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC=C([N](=O)=O)O3)=O""",21,"""E32042D8467CE435"""
-"""6D4BEFF441F7A9B8_92FA71856ADA12B9_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C([S](C)(=O)=O)C=CC=C3""",21,"""E32042D8467CE435"""
-"""F8342E35446CD8C7_8BD68C741A5E8782_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)C(OC)(C)C""",21,"""E32042D8467CE435"""
-"""F5CFF59BFC63FBA7_2DE2B04D033A7046_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NCCCOC(C)C)=O""",21,"""E32042D8467CE435"""
-"""F5BEC28C743BCEB1_97FB0684B333E337_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NCCC4=C3C=CC=C4""",21,"""E32042D8467CE435"""
-"""8879C5A9CD592741_63A5A7995618CD0A_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(SC(F)F)C=C3""",21,"""E32042D8467CE435"""
-"""9ECCFAFBC98FA5A8_DB7C95FDB4F58805_6039_UN""","""O(CC12CN(CC1)CCC2)CCC(=O)NC3=NC=CC=C3""",21,"""E32042D8467CE435"""
-"""DAA4F5DC2BFEE8AC_D17A4300AB41D3D8_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C)OC(=C3)C(OC)=O""",21,"""E32042D8467CE435"""
-"""18212EAAFF475B33_6BC629142DA52F92_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(C=C3)[S](=O)(=O)Cl""",21,"""E32042D8467CE435"""
-"""233BADB2F06E8B12_90B2903930E8849E_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3[N](=O)=O)C""",21,"""E32042D8467CE435"""
-"""51239516D07D8FAC_644A9FC3BBA818C0_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC4=C(C=C3)C=CC=N4""",21,"""E32042D8467CE435"""
-"""C5996BB7F4CE5CB1_4434374E19511D76_6039_UN""","""O(CC12CN(CC1)CCC2)CCCOC3=C(F)C=CC=C3""",21,"""E32042D8467CE435"""
-"""3C23CFA1A04AD5D1_1A6B00173732F525_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C=CC(=C3)[N](=O)=O)F""",21,"""E32042D8467CE435"""
-"""FA36BC6762F67FFA_7F15232D651BC0DF_6039_UN""","""O(CC12CN(CC1)CCC2)CCCNC(CC(C)(C)C)=O""",21,"""E32042D8467CE435"""
-"""C42F250707019904_886E2D55A4AA800B_6039_UN""","""O(CC12CN(CC1)CCC2)CCC(=O)N3CCCCCC3""",21,"""E32042D8467CE435"""
-"""4DC460135115972C_6EB57500C83DF183_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=NC3=C(CCCCC3)S4""",21,"""E32042D8467CE435"""
-"""CCD85A0D3D0085B3_3A9FC8CEFA9D020F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CN=CC(=C3)C(C)(C)C""",21,"""E32042D8467CE435"""
-"""6B506F8C2ECAD566_F86E3BB69C0FF31D_6039_UN""","""O(CC12CN(CC1)CCC2)CC4CCCC3(CCOC3)O4""",21,"""E32042D8467CE435"""
-"""9D5AD09AFE9A393A_6B897878DE29485B_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N(C)CC3=CSC=C3)=O""",21,"""E32042D8467CE435"""
-"""9C1A329B21D2226A_950FF54050051935_6039_UN""","""O(CC12CN(CC1)CCC2)CC3CCCC(F)(F)C(N3)=O""",21,"""E32042D8467CE435"""
-"""5B2F4490F52DE44B_3EC1F757CF03B49D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC(=N3)N4CCCC4""",21,"""E32042D8467CE435"""
-"""D9031CBF9CACFBD3_852CA642959EACDB_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C)OC=C3C(F)(F)F""",21,"""E32042D8467CE435"""
-"""68B8F75A967283D5_08618854944894A9_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=CC3=C(CN(C)C3)C=C4""",21,"""E32042D8467CE435"""
-"""65EDCB11C2CA093E_CA3B8CB3413E00FA_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(OCC)=O)[NH]N=C3""",21,"""E32042D8467CE435"""
-"""CBC540B2831B7F89_55FB195319A4348B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=C(C)O3)[S](=O)(=O)C""",21,"""E32042D8467CE435"""
-"""6F93CB982B967DF4_B1707E4D9704BE7E_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC4=C3N=C(C)O4""",21,"""E32042D8467CE435"""
-"""DEA302A2D6BFCF9C_2CD189AD5ABDEC9A_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC=CC(=C3)OC)F""",21,"""E32042D8467CE435"""
-"""96FBAB0D3E3FA328_B85529DC8B341D63_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NN=C4[N]3CCOCC4""",21,"""E32042D8467CE435"""
-"""23D111D9D6423212_375EC7B46ED57591_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC4=C(C=C3)CCOC4""",21,"""E32042D8467CE435"""
-"""424A992239634217_63CA0F57C71B0B18_6039_DP""","""O(CC12CN(CC1)CCC2)CC3(OC(CC34CNC4)=O)F""",21,"""E32042D8467CE435"""
-"""E4F1FD489134D0AE_9B3EC4F08E61C0E5_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=NC3=C(CC(C)CC3)S4""",21,"""E32042D8467CE435"""
-"""59E9F3D9B6C4B118_6616AB74C48947DB_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC=C(SC)C=C3)=O""",21,"""E32042D8467CE435"""
-"""05F9F5C6435018AA_B3992628F32F06C9_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CN=C(C(OC)=O)C=N3""",21,"""E32042D8467CE435"""
-"""5565D7641C44F2C5_0AE8FF6A283664A5_6039_UN""","""O(CC12CN(CC1)CCC2)CCC(N3CCN(C)CC3)=O""",21,"""E32042D8467CE435"""
-"""4A249019C084841B_D40892EDC73D78B8_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(F)(F)F)C=CC=N3""",21,"""E32042D8467CE435"""
-"""A17584F40A009DFA_8E77BFB591FC38C5_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(OCC)=O)SN=N3""",21,"""E32042D8467CE435"""
-"""2C18A48740E101F3_90A289889F5D22AA_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CN=C4[N]3C=C(F)C=C4""",21,"""E32042D8467CE435"""
-"""E846EA62CFFC192A_F75DD6D66D53F5BE_6039_UN""","""O(CC12CN(CC1)CCC2)CCCC(=O)N3CCCCC3""",21,"""E32042D8467CE435"""
-"""F3445EF96B9655EC_B9742FF9C08A7CAB_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(C)(C)C)C=CC=C3""",21,"""E32042D8467CE435"""
-"""5DFC62A177ABD81F_3B8E2E4E45655DE0_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3=CC(=C(C(=C3)F)F)F""",21,"""E32042D8467CE435"""
-"""690E68988DD20E59_8AF2AF2C181892D8_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC=CC(=C3)[S](F)(=O)=O""",21,"""E32042D8467CE435"""
-"""BCB49D6727A64C73_DDF82356132BBF5F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CN=C(C(F)(F)F)C=C3""",21,"""E32042D8467CE435"""
-"""FD97CC774D0ED1DF_2FEBF6B6BCF875F0_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=NC=C3)C(F)(F)F""",21,"""E32042D8467CE435"""
-"""48885051364B02A6_91FD7B7D3A6DCB6D_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)C3=CC=C(C=C3)C#C""",21,"""E32042D8467CE435"""
-"""3D5A3161C8D9ADFD_A1985112F3C07759_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(OC(C)C)C=C3""",21,"""E32042D8467CE435"""
-"""7BAEC73CFC7A78F1_1E2E7137BF313344_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=C(C(O)=O)C=C3)F""",21,"""E32042D8467CE435"""
-"""0175786BA33B55E0_AD1C3BD2077B347B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(NC(C)=O)C=CC=C3""",21,"""E32042D8467CE435"""
-"""8A5022FDDBFBAAEE_457C9208A213AE53_6039_UN""","""O(CC12CN(CC1)CCC2)CC4CN3CC(CCC3=O)O4""",21,"""E32042D8467CE435"""
-"""2EBD0D129556CB6A_0C8B88A75872949B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NN=C(O3)N4CCCC4""",21,"""E32042D8467CE435"""
-"""F75554B7221BA834_40C90EFB1601B71B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC4=C3CCCCC4""",21,"""E32042D8467CE435"""
-"""C670BA91E9C44D20_1E99ECBD7B2DDB58_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC=C3C(OCC)=O""",21,"""E32042D8467CE435"""
-"""571A1B56A8B81824_BD4CB3795395522E_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC(=C3)C(OCC)=O""",21,"""E32042D8467CE435"""
-"""81F30E2D85D61FE8_7186118CDDAB3163_6039_UN""","""O(CC12CN(CC1)CCC2)C[C@@H](C(C)(C)C)N[S](=O)(=O)C""",21,"""E32042D8467CE435"""
-"""5D10A0ACB03C0DE9_CE55A1CAA08D7AF0_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)C3=CN=C4[N]3C=CS4""",21,"""E32042D8467CE435"""
-"""0BC93420C1D72363_8F04990B02228706_6039_UN""","""O(CC12CN(CC1)CCC2)CCCOC3=CC(=O)CCC3""",21,"""E32042D8467CE435"""
-"""EA86B65A01E0EC8B_3E7D7D3FE73C5126_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)SCCC""",21,"""E32042D8467CE435"""
-"""33C36745E8E74EC3_A408C0D32DAFF5ED_6039_UN""","""O(CC12CN(CC1)CCC2)CCCC3=C(F)C=CC=C3F""",21,"""E32042D8467CE435"""
-"""69FB487361755A3A_68CA1F68A4A954CD_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC(=C3)C4CCCC4""",21,"""E32042D8467CE435"""
-"""D2CE69EB98FC225A_F919CE952E586BD4_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=N3)C(C)(F)F""",21,"""E32042D8467CE435"""
-"""52B20F4D600FABEE_724A3686439FE426_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC(=CC(=C3)F)F)=O""",21,"""E32042D8467CE435"""
-"""5474511E627652AE_CF70E23EF1B5C0CB_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(C(CC)C)C=C3""",21,"""E32042D8467CE435"""
-"""FBA932879D82C44C_C3B15F68231A0584_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC4=C3OC(=N4)C""",21,"""E32042D8467CE435"""
-"""C5494D4344F4E458_190FC9A191BAECF2_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(N=[S](C)(=O)C)=O)=O""",21,"""E32042D8467CE435"""
-"""35439923F86EB4F0_27A432BD38C50750_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(F)(F)F)N=CC=N3""",21,"""E32042D8467CE435"""
-"""3CC16488A0ED2EFC_7C5055DD0119B3ED_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)[S](C)(=N)=O""",21,"""E32042D8467CE435"""
-"""A755E34145D8C085_903980222F286B9D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC(=N3)C(OCC)=O""",21,"""E32042D8467CE435"""
-"""8CD5B61674024165_810786EEF1283169_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=N[N](C)C=C3[S](=O)(=O)Cl""",21,"""E32042D8467CE435"""
-"""CED974D694A41DE9_BE678A049CF6F137_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=N[NH]3)C(OCC)=O""",21,"""E32042D8467CE435"""
-"""4B6973FD15CE761E_BF88104D61A7685C_6039_UN""","""O(CC12CN(CC1)CCC2)CC4CC3(CCCC3)C(=O)O4""",21,"""E32042D8467CE435"""
-"""69A0986EC4A9615E_DB6FE886F83D4346_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=N[N](C)C=C3[S](=O)(=O)N""",21,"""E32042D8467CE435"""
-"""61AE0CBBE77AB933_DE42C9348DC5EE70_6039_DP""","""O(CC12CN(CC1)CCC2)CC4CCC3(CCNCC3)O4""",21,"""E32042D8467CE435"""
-"""3CDB86305C13331C_BF364604C07CDCA3_6039_UN""","""O(CC12CN(CC1)CCC2)CC(OC3CN(C)CCC3)=O""",21,"""E32042D8467CE435"""
-"""1097E1A644E72D19_80B9124FC078036E_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=NC(=C3)OC)OC""",21,"""E32042D8467CE435"""
-"""0BB0390E9B682F03_4D8AF0CB82773148_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3(C(O)=O)CCOCC3""",21,"""E32042D8467CE435"""
-"""5D8CBB2185FBCED7_179146A455C1603A_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(OCC)=O)C=NO3""",21,"""E32042D8467CE435"""
-"""F10F7FCD90362B76_27ECA85331D5180F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=NC(=N3)C4CC4)C""",21,"""E32042D8467CE435"""
-"""0382C5ADA9D4B221_D4E1A1C0B0B367A6_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=NC(=N3)OC)OC""",21,"""E32042D8467CE435"""
-"""4AAB3C113D7ED22E_BA75DAB000784957_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(C)(C)F)C=CC=C3""",21,"""E32042D8467CE435"""
-"""9FA88DD67708D463_B69105844A8C7C94_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C(OCC)=O)C=N[NH]3""",21,"""E32042D8467CE435"""
-"""BCC407289EA22785_02F9E5A808CC485B_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3(CCOCC3)C#N""",21,"""E32042D8467CE435"""
-"""6240CB56068FE477_90CC290863EBA476_6039_UN""","""O(CC12CN(CC1)CCC2)CC#CC3=CC=CC(=C3)OC""",21,"""E32042D8467CE435"""
-"""DAEC07C7A2609544_FA49783369575DC1_6039_UN""","""O(CC12CN(CC1)CCC2)CCCO[S](C(F)(F)F)(=O)=O""",21,"""E32042D8467CE435"""
-"""A6AEB6449D34056F_6B778FFB99BF6964_6039_UN""","""O(CC12CN(CC1)CCC2)CC[S](=O)(=O)C3=CC=CC=C3""",21,"""E32042D8467CE435"""
-"""633C4D9D9F2A733E_609B944FAF2FA252_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CN=C(OC)C=C3OC""",21,"""E32042D8467CE435"""
-"""6DC6C0AC5A6D3D4A_EB0279621789F472_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CN=C(C(OC)=O)C=C3""",21,"""E32042D8467CE435"""
-"""6F1F99817C2D4ED4_4D8D3AC6C776814C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C([S](F)(=O)=O)C=CC=C3""",21,"""E32042D8467CE435"""
-"""B38A1B011163E5E7_957DE616DAD363C5_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC=C(C(C)(F)F)C=C3""",21,"""E32042D8467CE435"""
-"""869F22FFF5E5A959_30287C82551A8186_6039_UN""","""O(CC12CN(CC1)CCC2)CC3CN3CC4=C[N](C)N=C4""",21,"""E32042D8467CE435"""
-"""5787EEBF7A1BC0F5_A46A71A6D141E78D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=C(C=C3)[N](=O)=O)C""",21,"""E32042D8467CE435"""
-"""E94A162A3405D285_DAD62E208535DF30_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=N3)OC(F)F""",21,"""E32042D8467CE435"""
-"""D0EF878805AF0A98_9DC3E5277D55E20F_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=C[N]3C=CC=C(F)C3=N4""",21,"""E32042D8467CE435"""
-"""BB896E75176D3021_C8D3A9E93B2BF1EE_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NN=C(O3)C4=CC=CO4""",21,"""E32042D8467CE435"""
-"""06FA01BA13C37756_A075A7AE44E54869_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)C3CC4=C3C=CC=C4""",21,"""E32042D8467CE435"""
-"""40B788E88EE0186B_88A772D75FD621A4_6039_UN""","""O(CC12CN(CC1)CCC2)CCN3CCN(CC3)C4CC4""",21,"""E32042D8467CE435"""
-"""DB0CABBAA3DF676F_AE683100B2A309A6_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)N3CCCCCCC3""",21,"""E32042D8467CE435"""
-"""9FFBCEB4743AC3CE_E544A4C2FABF12BC_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NNC(C(C)(C)C)=O)=O""",21,"""E32042D8467CE435"""
-"""CDC4D789A81E5501_433BC790F88766C7_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=C(C)[N](C(=C3)C)C)=O""",21,"""E32042D8467CE435"""
-"""368C65485EAAEE1F_8E8EB56E2AFC9FAB_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(SC(F)F)C=CC=C3""",21,"""E32042D8467CE435"""
-"""DEB10B7F0CC1B10A_E65C4A9F2B2331EF_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=C(O3)C)C(OC)=O""",21,"""E32042D8467CE435"""
-"""950232968940CD03_4D4BB3F8EB2F21B5_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3=CC=C([N](=O)=O)C=C3""",21,"""E32042D8467CE435"""
-"""15A784942208CE00_2FE550AD0B4DE8FD_6039_UN""","""O(CC12CN(CC1)CCC2)CCCCC(N[S](C)(=O)=O)=O""",21,"""E32042D8467CE435"""
-"""057FFE600FB9C5B9_DA3DF11D2A713650_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NC(=O)C3=CC=C[NH]3""",21,"""E32042D8467CE435"""
-"""7D0D2D308AB4F7A4_C7FE4FA74BE89908_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=C(C=CC(=C3)C)C""",21,"""E32042D8467CE435"""
-"""6CC95A876C0D0D6D_A9242DE4EEB407CB_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)OCCC""",21,"""E32042D8467CE435"""
-"""3322F6B02F86AFCC_9A390F6CC8BA8518_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C([N](=O)=O)C=CC=C3F""",21,"""E32042D8467CE435"""
-"""FE66E07766665EC0_D829FC857BDD13F3_6039_UN""","""O(CC12CN(CC1)CCC2)CCCN(CC)CC(F)(F)F""",21,"""E32042D8467CE435"""
-"""B9EE8AEFF6B50934_A86799B0B5D58F66_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CN=C(C(C)(C)C)N=C3""",21,"""E32042D8467CE435"""
-"""6DCEDA8F48E9ADCE_A03900F5D26A3024_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC=C(C(OC)=O)C=C3""",21,"""E32042D8467CE435"""
-"""9BB6DF5C2556F7A2_C2F361BD7EBDB285_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N(C(CC(C)C)C)C)=O""",21,"""E32042D8467CE435"""
-"""88BF57F5B6F2F280_31DF8D39EE8F88AE_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N3CC(CC)OCC3)=O""",21,"""E32042D8467CE435"""
-"""CD11D9B491E11279_DFB7DF38EC6EF66E_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3=CC=C(C(N)=O)C=C3""",21,"""E32042D8467CE435"""
-"""3161C63CCB0D84C7_7CAB6710F96FC5F8_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C34CC(C)(C3)OCC4)=O""",21,"""E32042D8467CE435"""
-"""610CDFA66D342094_B293B0A04F35C985_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C4C(=CC=C3)N=CC=C4""",21,"""E32042D8467CE435"""
-"""E523772AD222EB05_5819619DEBC9A056_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3CCC(C)(C)CC3)=O""",21,"""E32042D8467CE435"""
-"""5222470B2C30C81E_955AA927419F5FF8_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C=C(C(N)=O)C=C3)F""",21,"""E32042D8467CE435"""
-"""C322E1BEB6EB0C9C_B6B0BFDC9FCD6BEF_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C=N[N]3C)[S](=O)(=O)Cl""",21,"""E32042D8467CE435"""
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-"""E0A009CFA146FE19_B87DEFE968956D83_6039_UN""","""COC(=O)[C@@H]3CC=C[C@H](OCC1=NN=C(S1)C2CCC2)C3""",21,"""B46BD75EB1F8BDBB"""
-"""9A43D8D3E46B43D4_734846992D1E67A1_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCC1=CC=CC(=C1)C(F)F)C2""",21,"""B46BD75EB1F8BDBB"""
-"""D006A97C8FF5A955_CA020C63C39B45F4_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCC1=CC(=C(C=C1)C)OC)C2""",21,"""B46BD75EB1F8BDBB"""
-"""6D5338AB323DE1DE_D2353C032BA2B1AB_6039_UN""","""COC(=O)[C@@H]3CC=C[C@H](OCC1=C(C=CC=C1)C2CC2)C3""",21,"""B46BD75EB1F8BDBB"""
-"""326A768D6975CFFD_C8EE657BECC57CB6_6039_UN""","""COC(=O)[C@@H]3CC=C[C@H](OCC2CC1(CCC1)C(=O)O2)C3""",21,"""B46BD75EB1F8BDBB"""
-"""3B149672AA100D04_F06023B6DE9BDE5D_6039_UN""","""COC(=O)[C@@H]1CC=C[C@H](OCC(NCC(C(C)C)=O)=O)C1""",21,"""B46BD75EB1F8BDBB"""
-"""11E14035676F3052_757B7B35DB50F937_6039_UN""","""COC(=O)[C@@H]3CC=C[C@H](OCC2=NC1=C(C=CC=N1)O2)C3""",21,"""B46BD75EB1F8BDBB"""
-"""5597B8678327D9C4_C85D44E5D4DAD0EC_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCCC1=CC=C(C=C1)C#N)C2""",21,"""B46BD75EB1F8BDBB"""
-"""047CC9337773D6ED_9A506D2A23DAA555_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCC1=CC(=C(C=C1)C#N)C)C2""",21,"""B46BD75EB1F8BDBB"""
-"""F7EB2BC1A06D43AD_F319EB92EF9C8D4A_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCCCN1C(=O)CNC1=O)C2""",21,"""B46BD75EB1F8BDBB"""
-"""6750FE394838A8F6_83C69F014CC8C4B3_6039_UN""","""COC(=O)[C@@H]3CC=C[C@H](OCC1=CC=C(C=C1)C2CC2)C3""",21,"""B46BD75EB1F8BDBB"""
-"""527DAB2FE037464C_A9916535985DEAB1_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCC1=NC=N[N]1CC(F)F)C2""",21,"""B46BD75EB1F8BDBB"""
-"""9DD182E0E02E0B98_E1FD84BC43AF3545_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCC1=CC(=C(OC)N=C1)C)C2""",21,"""B46BD75EB1F8BDBB"""
-"""DB88304438E33D9F_4F033A3B7F47AE23_6039_DP""","""COC(=O)[C@@H]3CC=C[C@H](OCC2=NN=C(C1CNC1)S2)C3""",21,"""B46BD75EB1F8BDBB"""
-"""F0202EA296B6731C_90DB5CDB996862F5_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCC(C1=C(C)[N](N=C1)C)=O)C2""",21,"""B46BD75EB1F8BDBB"""
-"""68D8146BE0D77ACF_8CDA8DDE56B2CCB5_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCC1=CC=C(C(F)(F)F)S1)C2""",21,"""B46BD75EB1F8BDBB"""
-"""B034EC25F05FE798_AC877E84F7D5F954_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OC[C@H]1CC[C@@H](C(OC)=O)O1)C2""",21,"""B46BD75EB1F8BDBB"""
-"""4768FA7515B1AB3A_D3BE90B32780A97C_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCC1=CON=C1C(F)(F)F)C2""",21,"""B46BD75EB1F8BDBB"""
-"""14F880C38A7F118D_D5B59E408CCACE42_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC(=N3)C4=CSC=C4""",21,"""6FF6AA6D1BE24644"""
-"""9C7DFA61566B01EC_149AB6BCCFE1ECC0_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)C4=CC=CO4""",21,"""6FF6AA6D1BE24644"""
-"""E771A7C2BBE2F07B_E10FE4C69E0160AE_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
-"""DEEA8B84711A6FB4_AE1C98696275CD78_6039_UN""","""O(C1CCCC12CCCC2)CCOC3=CC=CC(=C3)CC""",21,"""6FF6AA6D1BE24644"""
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-"""9B5919FE2000CE38_6433E99723B891E3_6039_UN""","""O(C1CCCC12CCCC2)CCCOC3=C(C)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
-"""04CFC3ACB001B635_2ABD6517F1763958_6039_UN""","""O(C1CCCC12CCCC2)CCOC3=CC(=CC=C3)C#N""",21,"""6FF6AA6D1BE24644"""
-"""9439554F0AFCC38F_002586162A6666F9_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=C(C)C=C3)C)=O""",21,"""6FF6AA6D1BE24644"""
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-"""7CB586F50E7A89DB_51496CC67387A7BE_6039_UN""","""O(C1CCCC12CCCC2)CC(CC3=CC=C(F)C=C3)=O""",21,"""6FF6AA6D1BE24644"""
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-"""C79BEA954B619832_990A815DD643F694_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NNC3=NC=CC=C3""",21,"""6FF6AA6D1BE24644"""
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-"""643DF47C97535108_567B31B7D1598126_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=C(C(=C3C)OC)C""",21,"""6FF6AA6D1BE24644"""
-"""A7812E667BBA573D_628A898F41472BF3_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C(C(OC)=O)O3)C""",21,"""6FF6AA6D1BE24644"""
-"""2B5BCF7058159E0F_185847EEE98C9416_6039_UN""","""O(C1CCCC12CCCC2)CCSC3=CC(=C(C)C=C3)C""",21,"""6FF6AA6D1BE24644"""
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-"""F147922CBA2B2EA0_B36E1E6573815754_6039_UN""","""O(C1CCCC12CCCC2)CC(NCC3=CC=C(C)S3)=O""",21,"""6FF6AA6D1BE24644"""
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-"""D0ACD181CFC7B45A_478C6C40A314FD0F_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NCCC3=CSC=C3""",21,"""6FF6AA6D1BE24644"""
-"""042D2709F1639317_3282E5A6A9FE427F_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(C)C(=O)N(C)C)=O""",21,"""6FF6AA6D1BE24644"""
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-"""D3BD6B35034E3DCF_BA23928EF329DEE6_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(OC)=O)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
-"""B0BA6A5CD2BCE7D5_EEEB0150491C6F73_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)CCC(C)C""",21,"""6FF6AA6D1BE24644"""
-"""223FD08264294CEF_7165C25EF2D9BE1E_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)N(C)C(=O)C""",21,"""6FF6AA6D1BE24644"""
-"""8556A275E083A15E_BD46776FB9DA09BE_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)OCCO4""",21,"""6FF6AA6D1BE24644"""
-"""A5335497CCDEBED2_5347476432A7D096_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(OC(C)C)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
-"""5BBBA46AD6682697_28C371E50B03C96E_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC4=C([N]3C)C=CC=C4""",21,"""6FF6AA6D1BE24644"""
-"""646551F5398DEF90_CF79069CAAB1D7AF_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(CC(C)C)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""2C58C6C184FB0745_CF00849015CFE0EF_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)C4=CSC=C4""",21,"""6FF6AA6D1BE24644"""
-"""FAAB3D3AA184A471_B78B2B7C10E84BD6_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(F)C=CC=C3[NH]4""",21,"""6FF6AA6D1BE24644"""
-"""FB86A5F3A4E38C6A_FEE5A9705F70C56B_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=CO3)C(O)=O)=O""",21,"""6FF6AA6D1BE24644"""
-"""193DB8895B89F061_FE5A6BCD4A6515A4_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=CO3)C(N)=O)=O""",21,"""6FF6AA6D1BE24644"""
-"""C7FA324663181023_A42B681C1536CC41_6039_UN""","""O(C1CCCC12CCCC2)CCCCC[N]3C=C(C)C=N3""",21,"""6FF6AA6D1BE24644"""
-"""55F2A8F4A48AD6FF_33888A0628BAB0C6_6039_UN""","""O(C1CCCC12CCCC2)CCC(N(CC(OC)=O)C)=O""",21,"""6FF6AA6D1BE24644"""
-"""C0AFD3DEBD45019B_D2F320B4A59E0B3F_6039_UN""","""O(C1CCCC12CCCC2)CCC[N]3N=C([N](=O)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
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-"""E5FF49D5B4E05AF7_7A3E747A8BDEE7FD_6039_UN""","""O(C1CCCC12CCCC2)CC3OCCC4=C3C=CC=C4""",21,"""6FF6AA6D1BE24644"""
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-"""818C897E21370594_53F88252D375EDBB_6039_UN""","""O(C1CCCC12CCCC2)CCC3=CC4=C(C=C3)OCC4""",21,"""6FF6AA6D1BE24644"""
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-"""A26450AAC1B6A8DF_20BBD3FD25519050_6039_UN""","""O(C1CCCC12CCCC2)CC4=C3C=CC=CC3=CC=C4""",21,"""6FF6AA6D1BE24644"""
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-"""DE6EEB8A8CA89725_0681343FDF2760C6_6039_UN""","""O(C1CCCC12CCCC2)CCOC3=CC=C(SC)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""AEF7288F30BA927C_BFF4B8AC8466C41D_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(C=C3)OCC#N""",21,"""6FF6AA6D1BE24644"""
-"""BA65A5DAAC7EF915_756C93C8D0B23272_6039_UN""","""O(C1CCCC12CCCC2)CCN(CCCC)CCCC""",21,"""6FF6AA6D1BE24644"""
-"""38C193F9E8CA71CD_6A76949A0D9287EE_6039_UN""","""O(C1CCCC12CCCC2)CCC3=CC=C(C(O)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""A63065B7381749DA_B87D3F13EA13633C_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C[S](C)(=O)=O""",21,"""6FF6AA6D1BE24644"""
-"""201A18BAB6C1551C_01748B92E96BCB09_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C4=N[NH]C=N4""",21,"""6FF6AA6D1BE24644"""
-"""4D152EFF97DAC237_1827A5F68EA5AFB7_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=C(C=C3)F)C)=O""",21,"""6FF6AA6D1BE24644"""
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-"""EA8FDAD6938A5260_00830441C48086CF_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=CS3)C(O)=O)=O""",21,"""6FF6AA6D1BE24644"""
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-"""F1C7D777489BE0EC_61E5E128312A8486_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=CS3)C(N)=O)=O""",21,"""6FF6AA6D1BE24644"""
-"""210F6A21CD6FD4E7_F30094EA5743CA14_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=C(O3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
-"""508E0E09A73F6443_B63D5384F6ABC349_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NCC3=CN=CC=C3""",21,"""6FF6AA6D1BE24644"""
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-"""C744DFFDA61FE681_7EDD78C4AA9A1954_6039_UN""","""O(C1CCCC12CCCC2)CC(NCCOCCCC)=O""",21,"""6FF6AA6D1BE24644"""
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-"""277A7F5CAD748030_A5D8B008C8C70419_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NCCC3=CC=CS3""",21,"""6FF6AA6D1BE24644"""
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-"""D34870CD3B313E12_F2498DF929758098_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=N[NH]3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
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-"""BACC4F1A96B8A429_D9EA6E589A4A073E_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C=C([N](=O)=O)C=C3)F""",21,"""6FF6AA6D1BE24644"""
-"""729C24655DA10DD6_CEC66921B088F67C_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(OC)C=C(C=C3)C#N""",21,"""6FF6AA6D1BE24644"""
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-"""D92BAD198C9ACBDF_C33B4FA886BD287C_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=C(F)C=CC=C3)=O""",21,"""6FF6AA6D1BE24644"""
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-"""0FCB6301006FD681_5E43DC13E7CB344D_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=CC=CC(=C3)C)=O""",21,"""6FF6AA6D1BE24644"""
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-"""0BAE0AB7C8910084_06B650208EBF84A0_6039_UN""","""O(C1CCCC12CCCC2)CC3=NN=C([N]3C)C4CCC4""",21,"""6FF6AA6D1BE24644"""
-"""40DCE4A6EB7F4B9D_B99374A4C45E7DC2_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=C(C)C=CC=C3)=O""",21,"""6FF6AA6D1BE24644"""
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-"""793D8B7386BD73FB_AB8C3CF7F540931C_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(C)C=CN=C3[NH]4""",21,"""6FF6AA6D1BE24644"""
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-"""A204828C8A15032F_8ED14967F4AA14F1_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)[NH]C(=N4)C""",21,"""6FF6AA6D1BE24644"""
-"""6E8CB735DC1A4735_5940B12A59B4D886_6039_UN""","""O(C1CCCC12CCCC2)CC[N]3C=C(C(OC)=O)N=N3""",21,"""6FF6AA6D1BE24644"""
-"""C8D7346595BEA250_E1FF5D2FA903F236_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=CC=CC(=C3)F)=O""",21,"""6FF6AA6D1BE24644"""
-"""3126F68989DAC114_836F8AC6E28821C7_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC=CC(=C3)OC)=O""",21,"""6FF6AA6D1BE24644"""
-"""F2A6C972492D827A_5DAE47AAE49F861A_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3CCCCC3C)=O""",21,"""6FF6AA6D1BE24644"""
-"""CF12C8467F35DB28_33B2DA33A12EA1B8_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)N=CC=C4""",21,"""6FF6AA6D1BE24644"""
-"""8A9E7A7489F99663_2B0C83906C5FAD87_6039_UN""","""O(C1CCCC12CCCC2)CC(N3C(CCCC3C)C)=O""",21,"""6FF6AA6D1BE24644"""
-"""06BA748A93C561BA_F06C89CD74DDEA30_6039_UN""","""O(C1CCCC12CCCC2)CCC4COC3(CCCC3)O4""",21,"""6FF6AA6D1BE24644"""
-"""5F27E1461920C4D2_CA53660CCB274439_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C([N](=O)=O)C=C3)F""",21,"""6FF6AA6D1BE24644"""
-"""3767A7F10074D799_006EC84CAC2E2A5C_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(C(NC)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""5D670FBE5DCB0E24_72AAD3B80852C00A_6039_UN""","""O(C1CCCC12CCCC2)CC[N]3C(=CN=C3C)[N](=O)=O""",21,"""6FF6AA6D1BE24644"""
-"""0A3F1E4542A5F554_FE21E1F29371FE1D_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=CC(=C3OC)OC""",21,"""6FF6AA6D1BE24644"""
-"""3CBF37FA4D842DBC_D74AB3A7D7F92B01_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C(OC)C(=C3)F)F""",21,"""6FF6AA6D1BE24644"""
-"""CFE34806A91D8860_4E947C917A66C1F1_6039_UN""","""O(C1CCCC12CCCC2)CC4CCC3(CCCCC3)O4""",21,"""6FF6AA6D1BE24644"""
-"""2FB99C946332B60D_5CF82315723C9ABC_6039_UN""","""O(C1CCCC12CCCC2)CC(C3CCC(F)(F)CC3)=O""",21,"""6FF6AA6D1BE24644"""
-"""D7026F9684F28F33_EFF1B8181611F9CC_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=C(C(F)(F)F)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""8D8A9844FE053323_36A8CE31C0D5516D_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C([Si](C)(C)C)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""2F0AE9CD56B2266C_313966CDFE3AF9CE_6039_UN""","""O(C1CCCC12CCCC2)CC3=NN=N[N]3CC(F)(F)F""",21,"""6FF6AA6D1BE24644"""
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-"""82D5B73713F8F289_C82D1BF903ECAC22_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(C=C3)C4CCC4""",21,"""6FF6AA6D1BE24644"""
-"""68B790224ADED7E0_4054ECA80D07FAAD_6039_UN""","""O(C1CCCC12CCCC2)CC3=NN=C4[N]3CCCCC4""",21,"""6FF6AA6D1BE24644"""
-"""5DC6FB07340BCB49_6D24B89621E7A801_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=N3)C(OC)=O""",21,"""6FF6AA6D1BE24644"""
-"""F5558EAC58FFBDE6_9E534A7747ECE81A_6039_UN""","""O(C1CCCC12CCCC2)CC3=C([S](N)(=O)=O)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
-"""37E81CD8E2BDEF59_545CFF8CBF728B49_6039_UN""","""O(C1CCCC12CCCC2)CC(C(C(OCC)=O)(C)C)=O""",21,"""6FF6AA6D1BE24644"""
-"""EB31CE432D111A8C_2397E8C054AB7E73_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C([S](Cl)(=O)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""11F0000D8F01AA8D_DFDC938E8F1D9F1D_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(N=C3)C=CC=C4""",21,"""6FF6AA6D1BE24644"""
-"""A39A002F2F140701_4BFBC787021BC2D1_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C([S](C)(=O)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""AE47455C9DC4A565_F335E57207606126_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C=CC=C3)[S](=O)(=O)Cl""",21,"""6FF6AA6D1BE24644"""
-"""41D455CD250DC6C4_C33EC220C18D1D4C_6039_UN""","""O(C1CCCC12CCCC2)CCCC3(CCOCC3)C#N""",21,"""6FF6AA6D1BE24644"""
-"""CD92B359B6EAFC08_8A5B0682C8876A68_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(OC)N=C(C=C3C)C""",21,"""6FF6AA6D1BE24644"""
-"""6FBBC111AEDA23E5_98486389CD8F5653_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=CC=C3)[S](=O)(=O)Cl""",21,"""6FF6AA6D1BE24644"""
-"""055767DA65DC46A3_17DBBFBE803B6ADC_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(F)(F)F)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
-"""13A7F70F2ED9DAB0_DF1EBB96E493004A_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)COC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
-"""3F09C17E7D4C2619_CB08A9E06C71F792_6039_UN""","""O(C1CCCC12CCCC2)CCC(CC(OCC)=O)(C)C""",21,"""6FF6AA6D1BE24644"""
-"""EBC61F8478661BCC_FB03000C5DAB7C45_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(NC(C)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""D309BBCB93DFE61A_83E2E2DAC070EAB5_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=NC=C3)OC)=O""",21,"""6FF6AA6D1BE24644"""
-"""6FBBC111AEDA23E5_B1B7FE2CC819323A_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)[S](Cl)(=O)=O""",21,"""6FF6AA6D1BE24644"""
-"""4C734CF58990087E_CB3369DDE8AEE74A_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C([S](F)(=O)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""AE833519EC45AE77_4A6CBFC8C7665C84_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC=CC(=N3)OC)=O""",21,"""6FF6AA6D1BE24644"""
-"""91C1FC5038C90CE6_4EEEF360FF775241_6039_UN""","""O(C1CCCC12CCCC2)CCN3C4=C(CC3)C=CC=C4""",21,"""6FF6AA6D1BE24644"""
-"""C8E003F5CF1E4D38_9D32015BE723C6FA_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(N=C(C(C)C)C=C3)C""",21,"""6FF6AA6D1BE24644"""
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-"""3AB4F7CF312589FC_3C5670ACB4E42DA7_6039_UN""","""O(C1CCCC12CCCC2)CCN(C)CC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
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-"""046231877775689D_8F9B2E3D0CFDBB6F_6039_UN""","""O(C1CCCC12CCCC2)CCCCOC3CCCCC3""",21,"""6FF6AA6D1BE24644"""
-"""89B40AA29520AE64_03874E7AF0A04028_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C(OC)C=C3)C#N""",21,"""6FF6AA6D1BE24644"""
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-"""C542F5F9087F93CA_232654512C854C95_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=NC=C[N]3C(C)C)=O""",21,"""6FF6AA6D1BE24644"""
-"""5D5BC3CDDB622743_96E0A6B8F1BDC392_6039_UN""","""O(C1CCCC12CCCC2)CC3=N[N](C)C(=C3)C(F)(F)F""",21,"""6FF6AA6D1BE24644"""
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-"""4930BB3A32CC48D3_BD5D7CDD1E0EFDED_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)CC(NC)=O""",21,"""6FF6AA6D1BE24644"""
-"""3995C228B8054964_C599F7426A41CFEE_6039_UN""","""O(C1CCCC12CCCC2)CC3CN3CC4=CC=CC=C4""",21,"""6FF6AA6D1BE24644"""
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-"""4332AB362A136A5E_BF66B3FBFDB96AE5_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C(OCC)=O""",21,"""6FF6AA6D1BE24644"""
-"""A7EEB117D06FE274_1DDB6A88C044114D_6039_DP""","""O(C1CCCC12CCCC2)CC(N[C@H](C(C)C)C(=O)O)=O""",21,"""6FF6AA6D1BE24644"""
-"""FAB4DBE02FFB047D_328E50CDEFEDD209_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=C(C(F)(F)F)N=C3""",21,"""6FF6AA6D1BE24644"""
-"""2132A421D556D6F6_35DFA35793567515_6039_UN""","""O(C1CCCC12CCCC2)CCC4=NC3=C(C=CC=C3)[NH]4""",21,"""6FF6AA6D1BE24644"""
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-"""423138B46228A7BB_134ACF535B94DB2A_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=CC(=C3)OC(C)C""",21,"""6FF6AA6D1BE24644"""
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-"""5C3F5323435B1EE6_AD8C1546C19CFB42_6039_UN""","""O(C1CCCC12CCCC2)CCCN(C)C3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
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-"""F491B8A028A11649_9568F811F622F353_6039_UN""","""O(C1CCCC12CCCC2)CCC3=NOC4=C3C=CC=C4""",21,"""6FF6AA6D1BE24644"""
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-"""5D41A2EC01753E3C_1527B039DA8DEF32_6039_UN""","""O(C1CCCC12CCCC2)CCSC3=C(C=C(F)C=C3)F""",21,"""6FF6AA6D1BE24644"""
-"""11702CE10408B9D2_CACBBD650CD0EAC4_6039_UN""","""O(C1CCCC12CCCC2)CCCOCCOCCOC""",21,"""6FF6AA6D1BE24644"""
-"""40B1B906C782D81B_4F83BABB6408CBA6_6039_UN""","""O(C1CCCC12CCCC2)CC3=C([N](=O)=O)C=C(C=C3)F""",21,"""6FF6AA6D1BE24644"""
-"""16EFBB776BB97247_9137C150C03E83C3_6039_UN""","""O(C1CCCC12CCCC2)CCC3=N[N](C(C)(C)C)N=N3""",21,"""6FF6AA6D1BE24644"""
-"""B42F475D149C4BA6_9A7E069F4A799AE4_6039_UN""","""O(C1CCCC12CCCC2)CCC3CCC4=C3C=CC=C4""",21,"""6FF6AA6D1BE24644"""
-"""2F06D21C055FC625_D674F219AAACC86D_6039_UN""","""O(C1CCCC12CCCC2)CCCC(CC(OCC)=O)=O""",21,"""6FF6AA6D1BE24644"""
-"""6D6ADAA591BCD7D2_A23B71F061083BED_6039_DP""","""O(C1CCCC12CCCC2)CC3=CC=CC4=C3CCNC4""",21,"""6FF6AA6D1BE24644"""
-"""D3D3A22735C3C4D0_029AE7D2E61C3DEA_6039_UN""","""O(C1CCCC12CCCC2)CC(OC)C3=CC=C(C=C3)F""",21,"""6FF6AA6D1BE24644"""
-"""B0716C9FE486542E_12297C10D81DA973_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(C=CC(=C3)C)S4""",21,"""6FF6AA6D1BE24644"""
-"""18FC8CAC1995B6D6_4CD9C6638ED8AA3F_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(F)(F)F)N=CC=C3""",21,"""6FF6AA6D1BE24644"""
-"""6B686072A944BE9C_0057E800C8355684_6039_UN""","""O(C1CCCC12CCCC2)CC(N(CC)CC(F)(F)F)=O""",21,"""6FF6AA6D1BE24644"""
-"""1FDF8CCA7C59843A_159151503D69E7AB_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=C(C)C=CC=N3)=O""",21,"""6FF6AA6D1BE24644"""
-"""C04069AF37590A17_B6CF3FF8909D1106_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3F)[N](=O)=O""",21,"""6FF6AA6D1BE24644"""
-"""B192C842D2FC113D_7B58E488C1B2AE3D_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=NO3)C(OCC)=O""",21,"""6FF6AA6D1BE24644"""
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-"""BF797509CC91BD79_05AF21344F4654CA_6039_UN""","""O(C1CCCC12CCCC2)CC3CC4(CO3)CCCCC4""",21,"""6FF6AA6D1BE24644"""
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-"""4BBBA5E02DE4DFF6_0E894F64D8C4CE3B_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)N=CC=N4""",21,"""6FF6AA6D1BE24644"""
-"""6E5FA620DFFAAE1E_BAD73D09C6EA106C_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=C(C(OCC)=O)S3""",21,"""6FF6AA6D1BE24644"""
-"""DB5446E0F64488D7_2ED1639C4AB443D7_6039_UN""","""O(C1CCCC12CCCC2)CC4CCC3(CCOCC3)O4""",21,"""6FF6AA6D1BE24644"""
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-"""0CE74939C5089099_74ED64733622EF81_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC=C(OC)C=C3)=O""",21,"""6FF6AA6D1BE24644"""
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-"""D5B60E6AE43E9986_707B3FBFEB9C7467_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NC3CCCCCC3""",21,"""6FF6AA6D1BE24644"""
-"""39434D86ECF8B979_2BD2308A31C95F69_6039_UN""","""O(C1CCCC12CCCC2)CCCOC3=CC=C(F)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""0EE6377956D9C3C2_DA8DECEF006DBCCA_6039_UN""","""O(C1CCCC12CCCC2)CCOC(=O)C3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
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-"""69CC81EB7BBAAB7E_5D032B0035F827F7_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)C(F)(F)F""",21,"""6FF6AA6D1BE24644"""
-"""661CA977BD71837C_FD65F9B69336C346_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(F)C=C(C(=C3)C#N)F""",21,"""6FF6AA6D1BE24644"""
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-"""C4FCA4860EF95C28_863E17DF75A8C6D4_6039_UN""","""O(C1CCCC12CCCC2)CCC(N3CCN(C)CC3)=O""",21,"""6FF6AA6D1BE24644"""
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-"""2FA38FB1C7861D47_02A15700CC629AB4_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(OCC)=O)SN=N3""",21,"""6FF6AA6D1BE24644"""
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-"""C803E5A23C4C3175_C9AA7ABDFF8D0C22_6039_UN""","""O(C1CCCC12CCCC2)CC4CN3CC(CCC3=O)O4""",21,"""6FF6AA6D1BE24644"""
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-"""AEC78FC1E08A6FE3_CC1FE64E4B9F156A_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC4=C3CCCCC4""",21,"""6FF6AA6D1BE24644"""
-"""AA2B919A4EA5957C_924F040826B37929_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC=C3C(OCC)=O""",21,"""6FF6AA6D1BE24644"""
-"""436E5B8D036F56AF_319A5BCC0E0BF05F_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC(=C3)C(OCC)=O""",21,"""6FF6AA6D1BE24644"""
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-"""B31DE0185099D438_B2AB958ABAA2F357_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)SCCC""",21,"""6FF6AA6D1BE24644"""
-"""23BB705D96E6466E_28DE28667031579C_6039_UN""","""O(C1CCCC12CCCC2)CCCC3=C(F)C=CC=C3F""",21,"""6FF6AA6D1BE24644"""
-"""44A2DEEBC434F9E2_E41CF7DDF937F6BC_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC(=C3)C4CCCC4""",21,"""6FF6AA6D1BE24644"""
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-"""327AB3AE191BDFEA_FE9CDE331E014657_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=CC(=C3)F)F)=O""",21,"""6FF6AA6D1BE24644"""
-"""711C07D8E72C46DC_43A60A8BAC2B62BA_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(C(CC)C)C=C3""",21,"""6FF6AA6D1BE24644"""
-"""BE88ECCA5AE872EC_4F67B7DD7E84A7F5_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC4=C3OC(=N4)C""",21,"""6FF6AA6D1BE24644"""
-"""C663CB97C5245F90_95D92114CC244E83_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(N=[S](C)(=O)C)=O)=O""",21,"""6FF6AA6D1BE24644"""
-"""B2D3A4658C85C62D_AB72DA08655BA521_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(F)(F)F)N=CC=N3""",21,"""6FF6AA6D1BE24644"""
-"""258477B57BB39C98_F086BD685C87119C_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)[S](C)(=N)=O""",21,"""6FF6AA6D1BE24644"""
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-"""2EC859A4EB62A177_0DD16E5BACB69318_6039_UN""","""O(C1CCCC12CCCC2)CC3=N[N](C)C=C3[S](=O)(=O)Cl""",21,"""6FF6AA6D1BE24644"""
-"""04C2AD9335C88114_32B162B1C1685346_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=N[NH]3)C(OCC)=O""",21,"""6FF6AA6D1BE24644"""
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-"""FA7AC24584AD2513_57B90033A5A3E137_6039_UN""","""O(C1CCCC12CCCC2)CC3=N[N](C)C=C3[S](=O)(=O)N""",21,"""6FF6AA6D1BE24644"""
-"""51D31C9A689B4B4B_52942181D05B4C01_6039_DP""","""O(C1CCCC12CCCC2)CC4CCC3(CCNCC3)O4""",21,"""6FF6AA6D1BE24644"""
-"""E193E79075F6E9D1_33E0AEB19DE27ED2_6039_UN""","""O(C1CCCC12CCCC2)CC(OC3CN(C)CCC3)=O""",21,"""6FF6AA6D1BE24644"""
-"""B1B5E64A7B42D2C6_0C6FFAFA9DE6A11F_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=NC(=C3)OC)OC""",21,"""6FF6AA6D1BE24644"""
-"""BA2C504818CEED19_C15C187EDFE99339_6039_UN""","""O(C1CCCC12CCCC2)CCC3(C(O)=O)CCOCC3""",21,"""6FF6AA6D1BE24644"""
-"""784EA4A0A2DAE46A_9B47AE11085FC24B_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(OCC)=O)C=NO3""",21,"""6FF6AA6D1BE24644"""
-"""37FD8721A5E6DC5E_AB3A40E66C4BBA7E_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=NC(=N3)C4CC4)C""",21,"""6FF6AA6D1BE24644"""
-"""EB9A7E09614FFADE_58374975ED2DC5D7_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=NC(=N3)OC)OC""",21,"""6FF6AA6D1BE24644"""
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-"""CC9CFD20077AE781_3A47ED311712DEE5_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(OCC)=O)C=N[NH]3""",21,"""6FF6AA6D1BE24644"""
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-"""8DC1A0125B165B4E_EC4D7CFAF2B10023_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=C(OC)C=C3OC""",21,"""6FF6AA6D1BE24644"""
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-"""DDBCA2E2F6518019_02585DDB77623DDA_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(SC(F)F)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
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-"""2AC28638EEC9A5D3_C19D5B4DB6B183C4_6039_UN""","""O(C1CCCC12CCCC2)CCC3=CC=C([N](=O)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
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-"""B01AEC8BC1C245A5_56EB19A877EF9421_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NC(=O)C3=CC=C[NH]3""",21,"""6FF6AA6D1BE24644"""
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-"""CBA3259999D0BF6A_BD09658CB3112ADF_6039_UN""","""O(C1CCCC12CCCC2)CC(N3CC(CC)OCC3)=O""",21,"""6FF6AA6D1BE24644"""
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-"""A4CD54327FC19469_198C41921C01FD89_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C=C(C(N)=O)C=C3)F""",21,"""6FF6AA6D1BE24644"""
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-"""6F4B810BA5CF2F3A_D4899A3A4724B441_6039_UN""","""C[C@H](OCC(NC(C1=CC=C[N]1C)=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1368A35B14EB943B_E4A4EF4AD967B0D3_6039_UN""","""C[C@H](OCC(C1=CC(=C(OC)C=C1)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""81803887B9BE9179_6452135D8C6B8502_6039_UN""","""C[C@H](OCC(N1CCCC(C(N)=O)C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""46C89D55A0FB3AB5_4753A3D00C6FA30C_6039_UN""","""C[C@H](OCC1CN=C(O1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""D85BEC090303DDD4_44579F72109DB804_6039_UN""","""C[C@H](OCCCCCCCCCCCC)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
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-"""06E579442F3EA6FB_2AE8073FFE760679_6039_UN""","""C[C@H](OCCCC2=NC1=C(C=CC=C1)O2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F3FF50F84602E4D5_29D46F3CB78AA2C2_6039_UN""","""C[C@H](OCC(C1=CC(=C(C)C=C1C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""18255669D08456E2_07AE0647AA5692C9_6039_UN""","""C[C@H](OCC(NC1=C(C=C(C)C=C1)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""69ADE25CD45CD396_D84CE8995FCD8D6D_6039_UN""","""C[C@H](OCC(C1=CC=C(OCC)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""382BA6F26E547F50_1DE2B62AE28EDA63_6039_UN""","""C[C@H](OCCOC1=CC=C(OCC)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1B9EB0DB1A4B23F6_2685DDC8B5A254BB_6039_UN""","""C[C@H](OCC(=O)NC(=O)NC1CCCC1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""D95E20A09E8F972A_452C3D17CF5D338B_6039_UN""","""C[C@H](OCC(NC(CCCC(C)C)C)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""02F19D731BDD00B5_22B909E7666FD70D_6039_UN""","""C[C@H](OCCN[S](=O)(=O)C1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1FC88C03AF2E5201_42F3ACB1776E0445_6039_UN""","""C[C@H](OCC(C1=C(C=C(C)C=C1C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""232D9E23FA71B9BC_47368829B7F804A0_6039_UN""","""C[C@H](OCC1=COC(=N1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""326A5222120445F4_96E79661F831B9DE_6039_UN""","""C[C@H](OCC(NC1=CC(=NO1)C(C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""9D088339ED9D659E_0710BA5FF26D3071_6039_UN""","""C[C@H](OCC1=CSC(=N1)N(CC)C(=O)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3BBA0BA470470F01_0A1459712B287F1E_6039_UN""","""C[C@H](OCCC23CC1CC(CC(C1)C2)C3)CN4CCCC4""",21,"""84B363E7BB3ACD30"""
-"""89E2427FC89CB7D2_960E29EBDB4FD9F7_6039_UN""","""C[C@H](OCC1=NC=C(O1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""51547D7FA5A5B2A1_20F987705B97C351_6039_UN""","""C[C@H](OCC1=C(OC)C=CC(=C1)[N](=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3A58E3A8177FCD66_F0D2D13997426EB8_6039_UN""","""C[C@H](OCC1=CC(=NO1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""CF7EFA2826527C66_146C5EB591DE9B17_6039_UN""","""C[C@H](OCC(C1=C(OC)C=C(C=C1)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B09EEF670399C6F9_48160E4E4F79CFE7_6039_UN""","""C[C@H](OCC1=NOC(=N1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""76E1933F2BA683A8_D08AD65F2B85AF48_6039_UN""","""C[C@H](OCC(N[C@@H](CC(C)C)C(=O)O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""BCF34F5B6D2B3FF4_10DD105E15CC2F15_6039_UN""","""C[C@H](OCCC(NC1=CC=C(F)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C7FB023E82F55180_92B55FF92FDC53E2_6039_UN""","""C[C@H](OCC2=NC(=C1C=CC=CC1=N2)C)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""3B729D3331317EF3_66E1620952612C26_6039_UN""","""C[C@H](OCC1=CSC(=N1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""35DFA60E22303210_B50FB187A0E0E978_6039_UN""","""C[C@H](OCC(C1=CC=C(CC(N)=O)S1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""CE2B16053586285B_7B195C516F33E805_6039_UN""","""C[C@H](OCC(=O)NNC(=O)C1=CC=CS1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""49FC5290D7C3F751_C4C342945DDB7168_6039_UN""","""C[C@H](OCCC(NC1=CC=CC(=C1)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1B6F429B98D91D57_F6BB6CC768666A43_6039_UN""","""C[C@H](OCC(=O)NCC(=O)N1CCCC1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""AE533EF387A1D4C2_870AB9F4FC9063AB_6039_UN""","""C[C@H](OCC2=NC1=CC(=C(C=C1[NH]2)F)F)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""367127D04D99FFD4_2F57960F9B34A461_6039_UN""","""C[C@H](OCC(C1=C(OC)C=CC(=C1)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C2AFAC2791250DF9_C9B16817611D021A_6039_UN""","""C[C@H](OCCCOC1=CC=C(OC)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3E9F3EF7E5F7C1E6_E0E764D7ABF37C27_6039_UN""","""C[C@H](OCC(N(CCCC)CCCC)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""6DC296D7EF249911_B069B24AF9F16345_6039_UN""","""C[C@H](OCC(N(C1CCC(C)CC1)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""5A06A926D20187A8_EF00FC4B39F87B95_6039_UN""","""C[C@H](OCC(NC(NC(COC)C)=O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""062C2B2DC54685A4_7BC63B116200BFC0_6039_UN""","""C[C@H](OCC(NC1=CC=N[N]1C(C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""85A842F1F4A86A00_C7520AF92DAF6793_6039_UN""","""C[C@H](OCC1=NOC(=C1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""6B3CB77CF0788929_6E32C7CC277AAAB7_6039_UN""","""C[C@H](OCC(N(C)CC1=CC=C(C)O1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""690C08D846F0EABF_2AB6C3EA2220CAB3_6039_UN""","""C[C@H](OCC1=NC(=NO1)C2=CN=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""2EE8882A203F5AB4_8D0ED05C534182C5_6039_UN""","""C[C@H](OCCCN1C(NC(C)(C)C1=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""D153E1375D30CEF8_455CDB6DC4B01844_6039_UN""","""C[C@H](OCCOC1=CC=CC(=C1)[N](=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""D6B3344BEC57225A_E655FAD05864ED70_6039_UN""","""C[C@H](OCCOC1=C(OCC)C=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1F9A7273B8C892BA_687482369086423E_6039_UN""","""C[C@H](OCCOCCOC1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2E5B872799A4F050_6A0F452946E0FE65_6039_UN""","""C[C@H](OCC1=CC(=CC2=C1N=CC=C2)F)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""0338C75B57EC4E91_DE581CA839752C94_6039_UN""","""C[C@H](OCC(=O)NOCC1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C7208F498BDA1C0B_94BAD0D7E906932A_6039_UN""","""C[C@H](OCC1=C[N](N=C1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""A6930FA02B79B6EA_14CC8007E870A23E_6039_UN""","""C[C@H](OCC(NC(NCC(F)(F)F)=O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""EB03281986DBF2F2_F00F5FFCDA4F263A_6039_UN""","""C[C@H](OCC(C1=C([N](CC)C(=C1)C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""413558E87AD4C660_FDC32A169CD2320C_6039_UN""","""C[C@H](OCC(NCC1=C(F)C=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""45A4C88CDA6307E5_2978089DED653E36_6039_UN""","""C[C@H](OCC2=C(C)N=C1C=CC=CC1=N2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F9E0E1AA494E4957_5A80FB995636BEFA_6039_UN""","""C[C@H](OCC1=CN=C(S1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""88E36209FDB4040F_3A92E002D018CE97_6039_UN""","""C[C@H](OCC(N(C)C1CC[S](=O)(=O)C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""BFF00DC8E73D48F1_BAAC269540C9EB7D_6039_UN""","""C[C@H](OCC(C1=CC=C(C(C)C)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""EF0CA378FD8C3298_0FDF377E36205159_6039_UN""","""C[C@H](OCC(=O)C(C#N)C1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""DC4E8A2C18025777_3F7C66EEE4205586_6039_UN""","""C[C@H](OCCOC1=CC=C([N](=O)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""BE1B94415063BB7A_16092C77C73E0195_6039_UN""","""C[C@H](OCC(NC1=CC(=CC(=C1)F)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""39E4B529A0916AB9_EFC12955291A3326_6039_UN""","""C[C@H](OCC(=O)C1=CC2=C(C=C1)OCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""11C405ABFECB8FF9_65B7EB94C58578E6_6039_UN""","""C[C@H](OCCCOCCC1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B5CA87D064B4CAA1_AD3B61680DDD248E_6039_UN""","""C[C@H](OCC(C1=C[N](C)C(=C1)C(=O)N)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""A7D443C934FF2206_21462358C291C2CB_6039_UN""","""C[C@H](OCC(=O)NC1=NN=C(O1)C2CC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""D3119FC8EC87F0DD_8EB5B8687B36F800_6039_UN""","""C[C@H](OCC1=CSC(=N1)C2CCCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""2A10C5F990365A80_32882DCD8595A66D_6039_UN""","""C[C@H](OCC1=CSC(=N1)C2=CC=C(C)O2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""493D3979F51A5D43_0658DACD4877A976_6039_UN""","""C[C@H](OCC1=CSC(=N1)CC(N(C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C5A718A8FF6F5907_5BEAFB9B78651B85_6039_UN""","""C[C@H](OCC(NCC1=CC=CC(=C1)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""D68FA45E99B2846D_C6A475C5CE214D82_6039_UN""","""C[C@H](OCC(N(C)CC1CCCCC1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C71F136E55450AFC_EDC6A4198DFDF91F_6039_UN""","""C[C@H](OCC(=O)NCCC1CCCCC1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""69F01F0750C9EE44_4A320E62D0CB0A91_6039_UN""","""C[C@H](OCC(NCC1=CC=C(CC)S1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""94123AF2E82FC4B0_15B7415C7A009B01_6039_UN""","""C[C@H](OCC(=O)NC2=NC1=C(CCC1)S2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""5AEA1F6CC231E3AB_6BC50E624B9D86F2_6039_UN""","""C[C@H](OCC(=O)N(C1CC1)C2CCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""91C204EDEE194FDF_2B89B3B399D6E3C8_6039_UN""","""C[C@H](OCC(NC1=CC=N[N]1CCC)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B98FE8929854BEFF_9F79B174F1E25D93_6039_UN""","""C[C@H](OCC(=O)NCC1CC[S](=O)(=O)C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""A97ED3B778524D24_37B209F3B96F6679_6039_UN""","""C[C@H](OCC1=CC=CC(=C1)C(N(C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""34EB5E15C08352F3_81E6451C4A64EC8E_6039_UN""","""C[C@H](OCC2=NC1=C(C=N[N]1C)C(N2)=O)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""C48611AC281251E5_13CF9DFC2927A471_6039_UN""","""C[C@H](OCC(NC1=NC(=C(S1)C)CC)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7FCE6B61B40976E0_338BF0F4E12E1A65_6039_UN""","""C[C@H](OCC1=CC=C([S](N(C)C)(=O)=O)O1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""60A51667C7E0986B_5F5F5FDB46C6E00C_6039_UN""","""C[C@H](OCC1=N[N](C=C1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1A0D97B697178962_5D4596034C271B42_6039_UN""","""C[C@H](OCCC1=CC=C([S](N)(=O)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""EAF5E21F36365D3B_49CEA4908CBA435E_6039_UN""","""C[C@H](OCC(NCCOCCC(C)C)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""2AA5624D085C9C5E_E435494FEC035708_6039_UN""","""C[C@H](OCC(=O)C1=CC2=C(C=C1)CCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""D72847BEB9E8A94E_661685A7BF59F8B4_6039_UN""","""C[C@H](OCCOC(=O)NC1=CN=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""8FB56E36DA42A7CE_9783BB9659506416_6039_UN""","""C[C@H](OCCCN(CCCC)CCCC)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""B9E9095B65224253_AED7D57CCE5619FA_6039_UN""","""C[C@H](OCC(NCC1=C(ON=C1C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2C187DADF2C84BFD_C1A99DAC845F1DC4_6039_UN""","""C[C@H](OCC(C1=CC(=CO1)C(OC)=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""E57CF63E057D000A_27C61EED1D3987F4_6039_UN""","""C[C@H](OCC2=NN=C(C1=C(C)C=CO1)O2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""6E1CFE1FA45AC41A_6502E1355A713BF2_6039_UN""","""C[C@H](OCC1=CN=C(C=C1)[N]2C=NC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""0980244CD7F38283_5C2B807311F8D878_6039_UN""","""C[C@H](OCC1=C[N](N=N1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""BFEA307BD0D08C6F_B8AD7A86F01617F5_6039_UN""","""C[C@H](OCC1=C(C)OC(=N1)C2=CSC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""3F9C8C51ECAD7690_0B8A566914F49D20_6039_UN""","""C[C@H](OCCC1=CC2=C(C=C1)C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F679BE38BFD93E41_2E520F7C02A2B92D_6039_UN""","""C[C@H](OCC1SC(=NC1)N2CCOCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""C334B4D4A6BD2619_3AFC5EF7F484CC4D_6039_UN""","""C[C@H](OCC(C1=C(C)OC(=C1)C(=O)O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""A8AD78D6AB837363_5BFFA0D10CFE6178_6039_UN""","""C[C@H](OCC(=O)NCC(=O)C1=CC=CS1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""D84B412163ED48D2_2C60D6A56FC3F816_6039_UN""","""C[C@H](OCCCOC1=CC=C(C=C1)C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2F9A8B6E5A12564F_1BC9FBB049CF1602_6039_UN""","""C[C@H](OCC(NCC1=CC=CC(=C1)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1C23281B05F55FAB_3CB93BDA6404BDD7_6039_UN""","""C[C@H](OCC1=NOC(=N1)CCC(OC)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C4E09C6FD9185768_368F8CAEB36C0112_6039_UN""","""C[C@H](OCC1=CC(=NC2=C1C=CC=C2)C)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""42F41B0848F7BD82_C056C3CBC96CA549_6039_UN""","""C[C@H](OCC(NC1=C(C(=C(C)S1)C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""8896EAC0B75E5C4D_1B576F5373CD8BB5_6039_UN""","""C[C@H](OCC(C1=CC(=C(C)C=C1F)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""CF8A9AD483F3CF62_7094F7FA7E699B80_6039_UN""","""C[C@H](OCC(=O)N1CCN(CC1)CC#C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""139F031A57DEAAFA_CD9E8CA47B775916_6039_UN""","""C[C@H](OCCN[S](C1=C[N](C)N=C1)(=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""690CD246FDE74937_689ED066A06C459D_6039_UN""","""C[C@H](OCCC=CC1=CC=CC(=C1)OC)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""E8062F62ABB91701_70C51F6D05DCE275_6039_UN""","""C[C@H](OCC1=C(C=CC(=C1)OC)[N](=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""4A26D0855A1D6146_2D56B5DF9D5D6278_6039_UN""","""C[C@H](OCCOCC1=CC=C(OC)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""6B310095548AF2F5_63312E4B3E8FB417_6039_UN""","""C[C@H](OCC1=C(C)OC(=N1)C2=CC=CO2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""574F5AE4868617F6_3F673C2294E8A60F_6039_UN""","""C[C@H](OCCOC1=CC=C(C=C1)CC#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""F017634E4B6BD1C2_BC3FC199DD3E5031_6039_UN""","""C[C@H](OCC(C1=CC(=C(C(=C1)C)F)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""87B0CDAEB76B3A60_219D66950A487D99_6039_UN""","""C[C@H](OCC1=NOC(=N1)C2=C(C)N=CS2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""A25814DCE7A1EBF7_0C13C527BD1FEE95_6039_UN""","""C[C@H](OCC1=CC(=C(C(OC)=O)C=C1)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""8D19E5BC3DA0989B_F19C86C919BB6576_6039_UN""","""C[C@H](OCCN1C2=C(CCC1)C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""59DE2F70F7DB5E1F_9DFD841214F243C8_6039_UN""","""C[C@H](OCCCOC1=CC(=CC=C1)C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""11DFAAA427CB39E3_F20EF67C7F326B3E_6039_UN""","""C[C@H](OCC(NC1=NN=C(C(C)C)S1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1BF596C09F6B7DAA_A052D94ED2BFABA7_6039_UN""","""C[C@H](OCC(=O)C1=CSC2=C1C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""3E5ED8A14A74EA09_62101925E6C1F9C1_6039_UN""","""C[C@H](OCC1=CC(=CC(=C1)[N](=O)=O)OC)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""68A2E2A2323B56BC_FEF85F4830549255_6039_UN""","""C[C@H](OCCC1=C[N](CC(OC)=O)N=N1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""168A239BE358801E_A1BBC9EDF9BFF022_6039_UN""","""C[C@H](OCCCC1=NN=C(C(F)(F)F)O1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3B951F9AFA217F9A_A0C5F716216B05C7_6039_UN""","""C[C@H](OCCC(N(C)C1=CC=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""92A5D919F45D22B5_ECD5C60B574639C0_6039_UN""","""C[C@H](OCC(=O)NC1(CCCCC1)C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""FFA1DE34EA974EF6_AEF7C4B77D0C2854_6039_UN""","""C[C@H](OCC(NC1=CC=C(SC)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""547A57A9B6C72C70_809C43C2366913C4_6039_UN""","""C[C@H](OCC1=NN=C(O1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""40AED43BF425D40C_A7076EF03D76CF1C_6039_UN""","""C[C@H](OCC1=NC(=NO1)C2=NC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""9519B3F02737F567_B5D181000079249E_6039_UN""","""C[C@H](OCC(=O)C1=C[NH]C2=C1C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""ACDAA9C2CB44F5C8_F1723DF342372A0E_6039_UN""","""C[C@H](OCC1=C(CC(OC)=O)C=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""4BABFD4D21B1F04B_E6783CB1FE661D2F_6039_DP""","""C[C@H](OCC1=CC(=CC(=C1)C(F)(F)F)N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""44ED63D569D55DE5_AB96A2423AF111E8_6039_UN""","""C[C@H](OCCC1=NC2=C([N]1C)C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""5F66C6F983FA5900_E9CE017E0D347BA6_6039_UN""","""C[C@H](OCCN1C=C([N](=O)=O)C=CC1=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2C7BDD8F6EC83C3F_583E94AB86753890_6039_UN""","""C[C@H](OCC(N1CCCCC1C(N)=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7553C82146CAD0D5_52F33DEEC5E8A6B5_6039_UN""","""C[C@H](OCC1=CC(=C(OC)C=C1)[N](=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""163A3D03A796DAED_4777E775CC1F636A_6039_UN""","""C[C@H](OCC2=NN1C(C=C(C)N=C1S2)=O)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""726AA8B77A70764F_6DA6F10B2099806B_6039_UN""","""C[C@H](OCC(NC1CCN(CC)CC1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""63F932E912EC300D_561DBB8E6C068075_6039_UN""","""C[C@H](OCC(N(C1CCCCC1C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""A6BBBB28986D542A_1630BE8B3D079DD8_6039_UN""","""C[C@H](OCC(N(C(C)C1CC1)C2CC2)=O)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""57FAAE917E896044_E15F07F755FD2BFA_6039_UN""","""C[C@H](OCC1=CC(=CC2=C1OCOC2)F)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""CE9B3A4A5392264E_696DF5B369B85CE3_6039_UN""","""C[C@H](OCCCOC1=CC(=CC(=C1)C)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""6B636CFE5AC9EC0D_0A35568BC06C4EC2_6039_UN""","""C[C@H](OCC(N(C(CC)C)C(C)CC)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""7C9B469ADDBE3DFF_38226F35B69CCB6F_6039_UN""","""C[C@H](OCCC1=CC=C(C=C1)[S](=O)(=O)Cl)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3A6D960C6E5BDDD1_616AC0B4D2F414FD_6039_UN""","""C[C@H](OCC(=O)N2CCC1=C(C=CS1)C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""7313C9D741135B08_666A6B8AC28D60E6_6039_UN""","""C[C@H](OCC2=C[N]1C=CC=CC1=C2C#N)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""08E9AB9CF1B90043_484E5EB5162D8030_6039_UN""","""C[C@H](OCC2=NC1=C(C=CC=C1)C(=O)O2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""05486CE4E2DD4D31_718D057466CD4DBA_6039_UN""","""C[C@H](OCC1=C(C)OC(=N1)C2=CC=CS2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""A3F3AA2261C1BF53_AFB7F64B0AD25E74_6039_UN""","""C[C@H](OCC(=O)C1=CC2=C(C=C1)COC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""5D4EFD915DE099F4_75E2A08192A7AC70_6039_UN""","""C[C@H](OCC(N(CC(NCCC)=O)C)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""1DBE47E69CEB55E7_4EB0A97F08C246CD_6039_UN""","""C[C@H](OCC1=NOC(=N1)C2CCCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""5008A3596D056538_08BF813B4A0FE54C_6039_UN""","""C[C@H](OCC(=O)NC1=CC(=CC=C1)C#C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""E8D555510D284372_9306FE2A7B6314CC_6039_UN""","""C[C@H](OCC1=C(C=CC=C1)N2CCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""6129BAF3CE1D443C_556A5159823A8E47_6039_UN""","""C[C@H](OCC1=C(C)C=CC2=C1C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""630CD3F5B082745C_289A3CDEB35C05C6_6039_UN""","""C[C@H](OCC1=C(CC)OC(=C1)C(=O)OC)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""13E294E331FA067B_AF65353CF99387FE_6039_UN""","""C[C@H](OCC1=C(C(OC)=O)C=C(C=C1)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""6888E4E1B7F305B0_82089576F710144C_6039_UN""","""C[C@H](OCC1=N[N](C=N1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""5FD02F6C747E9285_0CFB416899AE877E_6039_UN""","""C[C@H](OCC(=O)C1=C[NH]C2=C1C=CC=N2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""165AE5782BD312F2_A7F32537E6091BDF_6039_UN""","""C[C@H](OCC2=NC1=C(N=C(OC)C=C1)[NH]2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""160F3840FA7B6C72_5ACD2E48A531F4C3_6039_UN""","""C[C@H](OCCN1C(=O)OC2=C1N=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""797C77347D685BC9_CB47F9185243C496_6039_UN""","""C[C@H](OCC(NCC1=CC=C(F)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7888CDD1CEF99B18_05EB5BFB080C74FA_6039_UN""","""C[C@H](OCC(NC1=C(C=C(F)C=C1)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""13887B9CEC722188_D945A8EF939B7F2A_6039_UN""","""C[C@H](OCC(=O)NCCC1=CCCCC1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""F5172B39D1B81AED_D5D121FDDC978B58_6039_UN""","""C[C@H](OCC1=COC(=C1)[S](N(C)C)(=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""5C2570BCCD3F3AEE_100BD38745E5D859_6039_UN""","""C[C@H](OCC1=CC(=CC=C1)[N]2N=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1C215EA4DF5D33DB_F23482CFC9D55427_6039_UN""","""C[C@H](OCCC1=CC2=C(C=C1)OCCO2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""05055676E1412EDB_D47AFB705D1B6106_6039_UN""","""C[C@H](OCC(NC1=C(C=C(C)C=C1)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""6A06026836BD1819_362899AD42B97880_6039_UN""","""C[C@H](OCC(NC1=CC=C(OC)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""53FDD6BAE9BE4D96_19CF7DACC34D22E6_6039_UN""","""C[C@H](OCC(=O)NC1CCCCCCC1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""D0167F3CE0428C01_A4790D7623AFA5A7_6039_UN""","""C[C@H](OCC(NCC1=CC=C(C)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1BF2EA4279B745FF_CC6A61F6F451A347_6039_UN""","""C[C@H](OCC(N1CCN(C(C)=O)CC1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""8E2E9ADB4CCFFCFE_E1E5C5FC46E34F8B_6039_UN""","""C[C@H](OCC(NC1=C(C=CC(=C1)F)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""BBDCC4E19C5F0104_110823B4F29F8892_6039_UN""","""C[C@H](OCC(NC1=CC=CC(=C1C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""77D1F8F4E3FBF0CA_2761988F93FEC67A_6039_UN""","""C[C@H](OCC(=O)NC1=CC(=CC=C1)C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""BE788A071ACD8780_9E48B9B36BA144D1_6039_UN""","""C[C@H](OCC(NC1=C(C=CC(=C1)C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""CAABD89158CF93FF_7B9D50091251E522_6039_UN""","""C[C@H](OCC(NC1=CC(=CC(=C1)C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7D1823F1A43FD5D9_222B2CE7BFA956A4_6039_UN""","""C[C@H](OCC(NC1=CC(=C(C)C=C1)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""4A48D32A7AD612F9_75EF1ACC0FF33FBF_6039_UN""","""C[C@H](OCCCC(C1=CC=C(F)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""CA7E44A948CA9907_7E4A38EC1B627EF2_6039_UN""","""C[C@H](OCCOC(=O)NC1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B17CC151717B8DF1_70A48C1D1F40C0A0_6039_UN""","""C[C@H](OCC1=C(C=CC(=C1)C(OC)=O)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""515A35AA2DBDB713_854E434821AD9DA8_6039_UN""","""C[C@H](OCC(NC1=C(CC)C=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""A10B462D65AE4301_530D2FD10559252A_6039_DP""","""C[C@H](OCCOC1=C(C(O)=O)C=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""6F8E45F21033DA8A_E6F6FEF78C43CE09_6039_UN""","""C[C@H](OCC2=NN=C(C1CC1)[N]2C3CC3)CN4CCCC4""",21,"""84B363E7BB3ACD30"""
-"""35DC06712399ECB8_E3915B11F1105BD3_6039_UN""","""C[C@H](OCC1=NN=C(S1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""07C15C07A5FC61F0_5CB6F6F5612D45C3_6039_UN""","""C[C@H](OCC1=CC(=NC=C1)OCCOC)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""E742B0379EF4E14F_25B2F4FDCC011BB4_6039_UN""","""C[C@H](OCCC1=C(C(OC)=O)C=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""714DFCCD0066C25D_5C85848ABAE78DFF_6039_UN""","""C[C@H](OCC(=O)N1CCC2=C1C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""0349C695511E467C_F15A31687C057D4C_6039_UN""","""C[C@H](OCC(NC1CCCC(C)C1C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""75D19189E070CDB1_8A24DDD2D2277F20_6039_UN""","""C[C@H](OCC1=CC=C(C(C)(C)C#N)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""236A68CBABBCD0FE_7205700D31FCD5B4_6039_UN""","""C[C@H](OCC(NC1=CC(=C(F)C=C1)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""850D899724177439_CCD0E3DBF7CB1A67_6039_UN""","""C[C@H](OCC(=O)N(CCC#N)CCC#N)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""D6AC5341AACE6227_27A66771B0E58D6F_6039_UN""","""C[C@H](OCC(CC1=CC=C(OC)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1B574FC4CA6E6733_605FF07F9543996B_6039_UN""","""C[C@H](OCC(C1=CC=C([N](=O)=O)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""EC79B0AEAAE75AF1_0EC1F2F9BA58393E_6039_UN""","""C[C@H](OCCC[S](=O)(=O)C1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C4A05622826F609B_3198830BCEB75D69_6039_UN""","""C[C@H](OCC1=CC(=NO1)C2=C[N](C)N=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""4F16FE5244D7E9DB_01AAB2FDB5CACA32_6039_UN""","""C[C@H](OCCCN1CCN(C(C)C)CC1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7DAFF59396E93803_AD2AF1F83962C9FC_6039_UN""","""C[C@H](OCC1=CC=C(C(C)C(=O)O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""673B83B06947AB5F_6AEC97ACA003B8F6_6039_UN""","""C[C@H](OCC1=C(C(OCC)=O)C=NC=N1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""9E5E2FBCE984D798_853F0FC5881DB7B9_6039_UN""","""C[C@H](OCC1=CC=C(C=C1)C2=CC=CS2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1D97767A5E490857_145BE6FC3D089D74_6039_UN""","""C[C@H](OCC1=CC=C(C=C1)OCC2CC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""527062290123C907_497DCD61A79B95BA_6039_UN""","""C[C@H](OCC1=NC=C[N]1C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""78858695F12D6330_790799FDB388217D_6039_UN""","""C[C@H](OCC1=NC(=CS1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""9B8B72D5A5B3C962_1290D09523870078_6039_UN""","""C[C@H](OCC1=NC(=CS1)C2CCCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""634EC533650EC9DC_3BA48AF11B602481_6039_UN""","""C[C@H](OCCCC2=NC1=C(C=CC=C1)[NH]2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""AB049EA84816B347_03711C6E522B7F89_6039_UN""","""C[C@H](OCCCC1=N[N](C)C=C1C(=O)O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B24FBC95A446BD02_E21B17922F067BF3_6039_UN""","""C[C@H](OCC1=NN=N[N]1C2CCOCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""B94EF596CA63D995_6FAA842D68A14964_6039_UN""","""C[C@H](OCC(N(C)CC1=CC=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""47865C21B11A8C79_A56ADE0D0017499B_6039_UN""","""C[C@H](OCC[S](=O)(=O)CC1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""85DC461AEEAB75C7_B633592075AA991A_6039_UN""","""C[C@H](OCC(=O)C1(CC1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""ED663D99947EFAFC_C7086A5C43B52374_6039_UN""","""C[C@H](OCC1=NC(=N[NH]1)C2=NC=NC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""5CCFBA3CD73565E0_63F103B275BA587E_6039_UN""","""C[C@H](OCCCB1OC(C)(C)C(O1)(C)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B6224B98A079D6D2_0969EABFC5A87900_6039_UN""","""C[C@H](OCC(C1=CC=C(CCC)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""9FF975B2EABC1741_B1DDB579CFC6B128_6039_UN""","""C[C@H](OCC1=CC=C(C(CC)(C)C)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""4FCC1D6612CE5758_50C94AFC1C0A972C_6039_UN""","""C[C@H](OCC2=CC1=C(OC(F)(F)O1)C=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""B690260527E388C3_735959DC5AC3C046_6039_UN""","""C[C@H](OCC(C(CC)(CC)C(=O)OC)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""37C377A57CC984EE_4BC64EAFBDF57CC4_6039_UN""","""C[C@H](OCC1=CC=CC(=C1)OCC(C)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3F5C701BF41669E7_0CA0C1066407A02D_6039_UN""","""C[C@H](OCCC(C1=CC=C(OC)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C8CE6685E5F0759B_7F398DB74A18BEB1_6039_UN""","""C[C@H](OCC(N[C@H](C(OC)=O)C(C)C)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""4F9C1DEB82C1E7A7_53FBCB328E58327E_6039_UN""","""C[C@H](OCC1=CN=N[N]1C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""6BAD701B91C71A0C_3E8BFC312B9934C6_6039_UN""","""C[C@H](OCC1=N[NH]C(=C1C(OCC)=O)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""91E259555636A01E_DD7BCA4FAB918F09_6039_UN""","""C[C@H](OCC1=NOC(=C1C(OCC)=O)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""D08953E1080FAAA5_68B849504E60F0AA_6039_UN""","""C[C@H](OCC1=C(C=CC(=C1)C)OC(F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""E12ACF26BD7E6EEB_A192CDE7BF22D87E_6039_UN""","""C[C@H](OCC(OC(C)C)C1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1E735A4B397C961F_57D10903E284D31D_6039_UN""","""C[C@H](OCC1=C(CC)N=C(C=C1)C(C)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""F542225D05C174A0_B0E4CFA7F379494A_6039_UN""","""C[C@H](OCC(=O)NCCC1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""695E7487D054EC49_75A834F74B031BC7_6039_UN""","""C[C@H](OCC(NC1=C(OC)C=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""5F14E6C2DF724FC8_EDC02DB22BB46DCD_6039_UN""","""C[C@H](OCC1=CC=C([S](CC)(=O)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""CF17335089B2AF31_633CAF294B8FA4AC_6039_UN""","""C[C@H](OCC(=O)NC1=CC=C(C=C1)C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""E9A5F1428BAA535D_62A15A659652EFEB_6039_UN""","""C[C@H](OCC1=C([N](=O)=O)C=CC=C1C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""F88055B11A285F9B_37CFAAC809DEDA0F_6039_UN""","""C[C@H](OCC1=NN=N[N]1C2CCCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""0136DFCEF59DB262_CD90D20768ABD462_6039_UN""","""C[C@H](OCCN2N=C1C=CC=CN1C2=O)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""87148015E82F6E7A_BC977679D5D3108D_6039_UN""","""C[C@H](OCC2=CC1=C([N](N=C1C)C)N=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F82BF523F827FF4E_E4F7C6CE4F7D73A6_6039_UN""","""C[C@H](OCC2=C1N=CC=CC1=C(F)C=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""503436CE91A2A1AD_72E7C94A6308E9D6_6039_UN""","""C[C@H](OCCCOC1=C(C)C=CC=C1C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""80E61B4D8E5949E6_E23803ABADDFAB75_6039_UN""","""C[C@H](OCC(C1=C(OCC)C=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2A2B532FD1DD0031_06C8CC7D525F96B3_6039_UN""","""C[C@H](OCCCOC1=CC(=C(C)C=C1)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C8CCF882C74008B3_5717AAF0E0C7AA8B_6039_UN""","""C[C@H](OCC(N(C)CC1=C[N](N=C1)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""33C8CA1619E008E6_9ED125490AE45F42_6039_UN""","""C[C@H](OCC(N(C(C)C)CC(F)(F)F)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""7119771A55EC6408_B804776DBCD57015_6039_UN""","""C[C@H](OCC(NC(CCCCCC)C)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""22D592D160EDAAF4_81DB0DB442B63F1F_6039_UN""","""C[C@H](OCC1=CN=C(C(OCC)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""050F7FB2E8F897A8_04352E1A670AE06C_6039_UN""","""C[C@H](OCC(C(C)(C)C1=CC=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""398AF16A75CAF758_3AE57D2CDAE02BDC_6039_UN""","""C[C@H](OCC1=C(OC)C=C(C=C1)[N](=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""8C375755B0104470_B008649B61517AD4_6039_UN""","""C[C@H](OCC1=CC=C(C=C1)N2CCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""CE334416F50D6AAA_223DD40489273CB4_6039_UN""","""C[C@H](OCC(C1=CC=C(C(OC)=O)O1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""77ABB86E214B2D4C_01EE139CDBE48912_6039_UN""","""C[C@H](OCC(C(C1=NC(=CS1)C)C#N)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""D2BC426666330235_24F4D87A290D65BF_6039_UN""","""C[C@H](OCC1=CC2=C(C=C1)OC(C)(C)C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1F9E7B34B3151F49_5DC77895BA9AF638_6039_UN""","""C[C@H](OCC(=O)NC1=NC(=NO1)C2CC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""EFEEE8D9B91094A8_E3C09C7FD4038706_6039_UN""","""C[C@H](OCCC(NC1=C(F)C=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""8468CA1DD48324B4_65F1A6DF6CC254B0_6039_UN""","""C[C@H](OCC1=CC=C(C=C1)[N]2C=CC=N2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1B3D85ABBD07892D_62FD04A18BA3C83D_6039_UN""","""C[C@H](OCC1=NC(=NO1)C2=NC=NC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""7DA5DFA1A0C50A26_3C8DBE6663418801_6039_UN""","""C[C@H](OCC1=CSC(=N1)C2=NC=CC=N2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""EE634BE3B98A89DE_9C2DA9FDEE723CD2_6039_UN""","""C[C@H](OCC(N(C(C)C)C1CCCC1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""EFEE6348A7506C08_314D132A9572DF5E_6039_UN""","""C[C@H](OCC(NCC(NC(C)(C)C)=O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""0A11DAE2D7D99B5B_03C0433031E49BBD_6039_UN""","""C[C@H](OCCCCCCCCCC(O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""10FF62C944010C8D_39DDB123C0E20174_6039_UN""","""C[C@H](OCCC(C1=C(C=C(F)C=C1)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7DB72B328C273F38_2ACCC337EB805437_6039_UN""","""C[C@H](OCC1=C(C(=C(F)C(=C1F)F)F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C18C6DA78DB77C69_4BCFF44ADD330CC1_6039_UN""","""C[C@H](OCC1=NC=C(C(OCC)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B21E4EBAEFC11711_D893354C751BF79E_6039_UN""","""C[C@H](OCC(C1=CC(=C(C=C1F)F)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1E29CF7EA3C4A3F9_457E756BEFD7E0D9_6039_UN""","""C[C@H](OCC1=C(C(OC)=O)C=CN=C1F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2C591D3EE0F746E5_E75D4159559F0DA5_6039_UN""","""C[C@H](OCC1=C(C=C(C(OC)=O)C=C1)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""9C3CDF0E540982A1_6E28C50697403F8F_6039_UN""","""C[C@H](OCC2=NC1=C(C=CC=C1)NC2=O)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""65609377D091D23A_E4820E98E5466FC7_6039_UN""","""C[C@H](OCCOC1=C([N](=O)=O)C=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2BF4BA5F3A998AF1_B93B3549619C79E8_6039_UN""","""C[C@H](OCC1=NOC(=N1)C2CCOCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""DF61A2F713E262AC_9B605AABC743D2CE_6039_UN""","""C[C@H](OCC1=NC(=CS1)C2=CN=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""012E73DB3CA12977_BC1090AA53399589_6039_UN""","""C[C@H](OCC(=O)CC1=CC=C(C=C1)C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""420D5B85CAE5D7F3_7837169B736EB241_6039_DP""","""C[C@H](OCC(N[C@@H]([C@H](CC)C)C(=O)O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""832A4A129D74679D_BE06109E1E5EED8C_6039_DP""","""C[C@H](OCC(N[C@H](CC(C)C)C(=O)O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""5B716765D5A82C00_2A81D42A749CF7AA_6039_UN""","""C[C@H](OCC2=CC1=C(C=CC(=C1)C)N=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""05B25C6131818129_26FF88EBA81E5E6E_6039_UN""","""C[C@H](OCC(NC1=C(F)C=CC=C1F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""0EAEB5009F1E7F98_4B091CECA2AB4B4E_6039_UN""","""C[C@H](OCC1=CC=CC(=C1)OC(F)(F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3A871E3D45A5700B_F834805F53643C16_6039_UN""","""C[C@H](OCCC=CC1=CN=CC(=C1)OC)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""404CE5BCD0F8D9D4_5C628DB8526576C1_6039_UN""","""C[C@H](OCCOC(CC)C1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""52D2FBB91FA19A4F_055CACE913540C0D_6039_UN""","""C[C@H](OCC1=CC=C([S](N(C)C)(=O)=O)S1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""0CB3C3FD6770C362_46233A4D80AEE00A_6039_UN""","""C[C@H](OCC1=C([N](=O)=O)C=C(C=C1)C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B391CAF06CF895CF_0565D8E6E646150C_6039_UN""","""C[C@H](OCC1=C(OC)C=CC(=C1)C(C)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3FD8E409DA43A87D_1D8700C3E8C61AF0_6039_UN""","""C[C@H](OCC1=CN=C([N]1C)SC(F)(F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""297D3166007D144D_3472312670C33CBE_6039_UN""","""C[C@H](OCC1=C(OC(F)F)C=CC(=C1)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""96BF86D393264354_6348128C623124F7_6039_UN""","""C[C@H](OCC1=CC=C(C[S](C)(=O)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""75D6F0F260AF81BC_7879F6ED1593DF43_6039_UN""","""C[C@H](OCC1=C(OC(F)F)C(=CC=C1)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""A5D8FE05FAB3FF66_6DC27B615E5893E6_6039_UN""","""C[C@H](OCC1=CC=CC2=C1OC(F)(F)O2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""D8B994A76FBC4560_0DB037F309DA62FF_6039_UN""","""C[C@H](OCCOCCN1C(=O)CSC1=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""31E206194D03B47A_F2E86474DD4D3EF6_6039_UN""","""C[C@H](OCC2CN=C(C1=C[N](C)N=C1)O2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""FB13334651841E97_BD8CA63C45860E02_6039_UN""","""C[C@H](OCC(COC1=CC=C(F)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""94C1D88EFD3C1AD4_30F9CB886CFA853C_6039_UN""","""C[C@H](OCC2=NC1=C(C=CC=C1)C(=O)N2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""EA910921B0760ABD_DC6BAE0517FF5DAD_6039_UN""","""C[C@H](OCC1=NC(=NO1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""70581E4FD772CA5A_449C48733F5C8147_6039_UN""","""C[C@H](OCC1=CC=C([S](NC)(=O)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7B5E5F0C2CA398AC_D43634ECA0E579CC_6039_UN""","""C[C@H](OCC1=NN=C(O1)C2CCCOC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""2F2B2123DEB40F5F_C15EA431437C8BC5_6039_UN""","""C[C@H](OCC(N[C@H](C)C1=CC=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""DF27B28CAE876F6A_5B06E4EFF63A0C34_6039_UN""","""C[C@H](OCC1=CN=C(O1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""7932376D1FF8162F_490E45B945ADDAE0_6039_UN""","""C[C@H](OCC(CCNC(C(F)(F)F)=O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""F3979650C77047E2_5C066DA54C23F1D1_6039_UN""","""C[C@H](OCC(N(CCC)CC(F)(F)F)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""7F264011CF46F8C6_C62DC62439616B15_6039_UN""","""C[C@H](OCC(C1=CC=C(C(OC)=O)S1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""4D545019F0530E63_0D3243DA771B1730_6039_UN""","""C[C@H](OCCN(C)CC1=CC=C(C=C1)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""E04EC902277C2B86_9ED207DD1B5510F2_6039_UN""","""C[C@H](OCC2=CC1=C(OC(N1C)=O)C=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""D1A9A3E4E72DF5F1_94F15CE813650522_6039_UN""","""C[C@H](OCC1=CC=CC(=N1)C(OCC)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""EF138EF74130C053_59D212BC377B5E9C_6039_UN""","""C[C@H](OCC1=COC(=N1)C2=NC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""B4398FC6BABD12FB_B79323AFDC463174_6039_UN""","""C[C@H](OCC1=COC(=N1)C2=CC=NC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1178D768522C108A_33F6D82BCC881432_6039_UN""","""C[C@H](OCC1=NC(=NO1)C2=CN=C[N]2C)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F6C16A324D8F14C3_E1665DEABE98784E_6039_UN""","""C[C@H](OCC2=NC1=C(COCC1)C(=O)N2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""49AD1E1666C47826_E933C5AE5D37E834_6039_UN""","""C[C@H](OCC1=CNC(=O)C2=C1C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""2D339485CD977C5F_A700BB55CC3CBAC0_6039_UN""","""C[C@H](OCC1=NOC2=C1CC(C)(C)CC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""A01396411BE940D3_31B52D50A2DC2A33_6039_UN""","""C[C@H](OCC1=CSC(=N1)C2=N[N](C)C=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""46BBB0C38A942E9C_C79ACE2CFFE9FF19_6039_UN""","""C[C@H](OCC1=NN=C2[N]1C=CN(C)C2=O)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""313866C99485A436_7B02F36AF3F1FC19_6039_UN""","""C[C@H](OCC2CCC1(CCOCC1)CO2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""48C1380FB946E315_79A9832DCA4BE378_6039_UN""","""C[C@H](OCC2OC1=C(C=C(OC)C=C1)C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""542B12D6752BE516_2BFBD18BBE7199BE_6039_UN""","""C[C@H](OCC(NC1=CC=CC(=C1)CC)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""424938C1297E108D_C2E22DE9DBD31471_6039_UN""","""C[C@H](OCC(NC1=CC=CC(=C1)SC)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7EF41E53D0C572A4_525720E357259B73_6039_UN""","""C[C@H](OCCCC[S](NC(C)(C)C)(=O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""2DE4C9B8C43A3CBC_130B14942BF97D63_6039_UN""","""C[C@H](OCC1=CC=C(C(N(C)C)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""BF85A0BE20A3A9D5_FF91E692AC35A2B2_6039_UN""","""C[C@H](OCC(N1CC(C)OC(C1)(C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""89002E222824E116_4F779A4EFFE7168E_6039_UN""","""C[C@H](OCC(C1=CC=CC(=C1)[N](=O)=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""BF361DFDB7DE76B7_87D97533F7E9B224_6039_UN""","""C[C@H](OCC1CCC(O1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""2647F028D1715B44_E7CF879BF136D2E3_6039_UN""","""C[C@H](OCC1=C[N]2C(=N1)N=C(C)C=C2C)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1A2A6B6328A6E95F_00CB200B914B5868_6039_UN""","""C[C@H](OCC(NC1=C(C)C=CC=C1C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""EEE6D0121AFE2495_1D4321703D988464_6039_UN""","""C[C@H](OCC1=C(C(=C(C)C(=C1C)C)C)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""47B44225F5D66D36_B19AC9C2B4A3FFCE_6039_UN""","""C[C@H](OCC1=C(OC)C=CC(=C1)C(=O)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7129F57A2612D2C1_5F84DBF8064DFFEF_6039_UN""","""C[C@H](OCC(=O)NC1=C(C=CC=C1)C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""CE6566D374FB44E6_D423AF144D5E4BE6_6039_UN""","""C[C@H](OCC(NC1=CC=C(CC)C=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""FC0B8C5AD06D20C1_11A8E9B72362DD07_6039_UN""","""C[C@H](OCC(N(CC)C1CCCCC1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""CD9F48AAFCC3600E_A523AB616418A40D_6039_UN""","""C[C@H](OCC(N(CC)C1=CC=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""657CC5890C779D7C_5C9E7D6F95CA516D_6039_UN""","""C[C@H](OCC(N1CCC(C(O)=O)CC1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""73F61217DF9B4D3B_6B5612C43058BCB6_6039_UN""","""C[C@H](OCCC2C1CC3CC(C1)CC2C3)CN4CCCC4""",21,"""84B363E7BB3ACD30"""
-"""AA9315D1A7BF797E_D83A70B98387B0BD_6039_UN""","""C[C@H](OCCOC1=CC2=C(C=C1)OCO2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""E3B424968B0683CB_6395204B215A894D_6039_UN""","""C[C@H](OCCC1=CC=CC(=C1)C(F)(F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""E6A6CA529D444D7E_F739D1F5CD4CB258_6039_UN""","""C[C@H](OCCC1=CC=C(C(F)(F)F)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""9695B9EDABC2F1C1_F8912CC51E2D5E51_6039_UN""","""C[C@H](OCC2=NC1=C(C=CC(=C1)OC)[NH]2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""90C04BE7F2E6CCC5_3A7F64D1B1412BC7_6039_DP""","""C[C@H](OCC1OC(CC12CCNCC2)=O)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""9ADC8AEE3FE3B25B_19D8076CFD7F6CF4_6039_UN""","""C[C@H](OCC1OC(=O)CC12CCOCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1A428AE34283E51B_914340FF605FD1BF_6039_UN""","""C[C@H](OCC(=O)NC1=CC=C(C=C1)C#C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""5155B628EA46C305_EDFE1F4CDF1DFD81_6039_UN""","""C[C@H](OCC1=C(C)C=CC(=C1)[S](=O)(=O)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""F9B10A8D9FB0412B_4FEC77B43EC195E1_6039_UN""","""C[C@H](OCCCCCCCCCC1CC1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""A795C4B97A40AB98_C04A3162033C012F_6039_UN""","""C[C@H](OCC1=C(C)C=CC(=C1)[S](=O)(=O)Cl)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""5A23729552CD4AFB_D9449F039A7694AE_6039_UN""","""C[C@H](OCC2CCC1(CCCCCC1)O2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""DF1B9B67F385C06B_EE8C3A5244FDCC9F_6039_UN""","""C[C@H](OCC(=O)CCCC1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""36B4C790D278FFF4_7B777A79CFC5D7CF_6039_UN""","""C[C@H](OCC1=CC(=C(OC)C=C1)C(=O)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""6F6A616D5F7F4C06_FE61572E23EACE87_6039_UN""","""C[C@H](OC[C@@H]1CCC[C@@H](C(OCC)=O)O1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""FB8C1588622F5286_DF33091A0C681B60_6039_DP""","""C[C@H](OCC2CCC1(CCNCC1)CO2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""32D54245B581EE18_1B5DB8AEFA094AC7_6039_UN""","""C[C@H](OCC1=N[N](C=C1)C2CCCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""C6FC8A37A574F3FA_5F71BC06C344E40E_6039_UN""","""C[C@H](OCC1=CSC(=N1)COCC(F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7877D25ECFD0E945_B3D52F5FA0D362A8_6039_UN""","""C[C@H](OCC(C1=CSC(=N1)C(C)(C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""FB1A0D2BE0905FCA_F3C77E4372EBF8C6_6039_UN""","""C[C@H](OCC2CC1(CCOCC1)C(=O)N2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""016095D533344635_56ACF9673341064F_6039_UN""","""C[C@H](OCC(=O)NC(=O)C1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3477B85AAA5BEC01_3D37EAD424B083D5_6039_UN""","""C[C@H](OCC(=O)NCCC[N]1C=CC=N1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""0E1F8AD5122D4D6C_F675AA989F4F925C_6039_UN""","""C[C@H](OCC1=CC(=C(C=C1)[N](=O)=O)OC)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""5C19B1F7C0654E65_620E0831C83B4010_6039_UN""","""C[C@H](OCC1=CC=C(N[S](C)(=O)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7F8F7519A53BE08B_E9F50B8CFB10F5E7_6039_UN""","""C[C@H](OCC1=NN=N[N]1C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F3B723E130B5D619_402D16C228C7D7EE_6039_UN""","""C[C@H](OCC1=NC=C(S1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""0AA2A70BFBBCD158_342180ED8C5F30D3_6039_UN""","""C[C@H](OCC(C1=C(OC)C=CC(=C1)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""F3F594A94ADF673B_DE6BFB5095288A01_6039_UN""","""C[C@H](OCC(=O)N1CCOCC1C2CC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F743678105785265_80763D8F1FEC31F6_6039_UN""","""C[C@H](OCC(=O)C2=CC1=C(C=CC=C1)O2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F673EE78AEE5446E_66B9A39F44904D0C_6039_UN""","""C[C@H](OCCOC1=C(C(C)=O)C=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""F22CE7529522CD04_0DC01A415B88A801_6039_UN""","""C[C@H](OCC=NNC(=O)C1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""918AA885D7264E33_A5CB695BDFDC4327_6039_UN""","""C[C@H](OCC(NC1=CC=CC(=C1)OC)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B63A0E88D2897150_E86B39C0DEACA908_6039_UN""","""C[C@H](OCCC(=O)NC1=C(C=CS1)C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""6752FC89AB1DD7C1_BAD50EF6367BF4AD_6039_UN""","""C[C@H](OCC(N(CCCC)C(C)CC)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""DC875E10469BFFB8_794F35160EEAE676_6039_UN""","""C[C@H](OCC(NCCCC(OCC)=O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""86E36EDD5AF81C66_7C5E8440691A83C8_6039_UN""","""C[C@H](OCC1=CC=C(C=C1)[N]2C=NC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""0A9C87ECE4673EE2_0C6B94758F5DEE8E_6039_UN""","""C[C@H](OCC1=CC=C(OC(F)(F)F)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""8876FD5A635F04C1_CFB10CA42E3E20DF_6039_UN""","""C[C@H](OCCCOC1=C(C=CC(=C1)C)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""744780806D4BCCB7_428B7A640AB19E14_6039_UN""","""C[C@H](OCC(NCC1=C(C)C=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""61B07AD9166096CB_C7F6A1359CA6CE65_6039_UN""","""C[C@H](OCC1=CC(=C(C(OC)=O)C=C1)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""D84ABE8CBB881689_1ED5F290DDDA8DC2_6039_UN""","""C[C@H](OCC1=N[N](C(=C1[S](=O)(=O)N)C)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B51482F707A3CC0D_C728062D92DDE23D_6039_DP""","""C[C@H](OC[C@@H]1C[C@](OC)(CN1)C(F)(F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2364D0DC50FF3287_3B337746D128B85D_6039_UN""","""C[C@H](OCC(NC1=C([N](N=C1C)C)C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""188AB3FCAE012403_1545833160DF0B97_6039_UN""","""C[C@H](OCC1=NN=C(O1)C2CCOCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""EDEC890EAAD0E5AE_DD58C7876B012D33_6039_UN""","""C[C@H](OCCC(C(F)F)N1CCOCC1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""4BD62FDDE8CDF472_AE91F5A416A0F1BA_6039_UN""","""C[C@H](OCC(N(CCOC)CCOC)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""F4AB7192507924AA_F393B04E139E2935_6039_UN""","""C[C@H](OCC1=NOC(=N1)N2CCOCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1EEAE1E78C434934_E6E5B0ACBAF62F16_6039_UN""","""C[C@H](OCC1=CC=C(C=C1)C2CCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""96143D9CF2C4E0EF_9217DAB83A4F3CC3_6039_UN""","""C[C@H](OCC1=NC(=NS1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""32B8944235A501F9_4F51F5004F26B4F0_6039_UN""","""C[C@H](OCC1=CC(=CC(=C1)OC(C)=O)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""33C4158440831AFA_F8D92525B3DE9CBA_6039_UN""","""C[C@H](OCC1=CC(=CC=C1)OCC2CC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""449FEB3763D10BF6_660667146B1B362C_6039_UN""","""C[C@H](OCC2=NC1=C(CCCC1)C(=O)N2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""0CDDBD2AE21A0474_E4A72B5D7B6EFE06_6039_UN""","""C[C@H](OCC(=O)C2=CC1=C(C=CC=C1)[NH]2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""96509E071BA6DD9D_BAB7DF2C705D3AE7_6039_UN""","""C[C@H](OCC2=NC1=C(CC(C)(CC1)C)S2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""DBD69D5B2EFE92E1_8B25E48E29EABC66_6039_UN""","""C[C@H](OCC(=O)C1=CN=C2N=CC=C[N]12)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""65BA8C666217C3AC_828483E40EC6FFFE_6039_UN""","""C[C@H](OCC(C1=C[N](C)N=C1C(F)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""E3B85E05C2F15065_2970212304E631E2_6039_UN""","""C[C@H](OCC(=O)C2=CC1=C(C=CC=C1)S2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""80A3C532D2470E71_3D94312166864DBE_6039_UN""","""C[C@H](OCC(=O)C1=CN=C2[N]1C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""FA68717569D76290_4587AD8FFBEC62BB_6039_UN""","""C[C@H](OCC1=NN=C([N]1C)C2=CC=CS2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""86F6CC9D3A8B0BA6_74F20C45775C4CD6_6039_UN""","""C[C@H](OCC(=O)C1=CC2=C(C=C1)OCO2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""3493EBBFB6304418_D193651367287383_6039_UN""","""C[C@H](OCC1=CC(=C(C(OC)=O)N=C1)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3E17BCE2BAC1A583_6F20724979432A4E_6039_UN""","""C[C@H](OCC(C1=CSC(=C1)C(OC)=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""DE256C86038F2FF4_65726979885F5830_6039_UN""","""C[C@H](OCC1=CC=CC2=C1OC(C)(C)C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""51BC0705C00FC847_AA1F640A37E872CC_6039_UN""","""C[C@H](OCC1=CC(=C(C=C1)C)C(OC)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""D88FB7A119A8366E_9AF57ABAE3CE8D6B_6039_UN""","""C[C@H](OCC1=NC=N[N]1C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""D36A86609ED0872A_892ADAE46429208F_6039_UN""","""C[C@H](OCC2=NC1=C(C=C(OC)C=C1)S2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""5A3ADF9A2697864A_1C3D57CB3FF92F44_6039_UN""","""C[C@H](OCCC(C)OCC1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""CAB07D7C42385C6E_F0D71D348400B122_6039_UN""","""C[C@H](OCC1=NN=C[N]1C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""3B3E85BAD6DF234C_BF241BE3D7D0B2A3_6039_UN""","""C[C@H](OCC1=C(OC(F)(F)F)C=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""DAD19F46FE1FDFD6_0CD9C8B8773CADDF_6039_UN""","""C[C@H](OCC(C1=CC(=C(C=C1)C#N)F)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""FFBB1795475C0A7A_7807E0A6B6EA8364_6039_UN""","""C[C@H](OCC1=CC=CC(=C1F)C(F)(F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""F2215FAA44C842F0_4B24F72CF5411823_6039_UN""","""C[C@H](OCC1=CC(=CC(=C1)C(F)(F)F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""A7764695D7CC0437_ED8C8EF5E184F886_6039_UN""","""C[C@H](OCC1=C(C=CC(=C1)F)C(F)(F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""7211404ADAE98FF3_AEFA007B685F3827_6039_UN""","""C[C@H](OCCC1=CC=C(NC(C)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""B37D3217AEF9B730_35471AEBC363BC73_6039_UN""","""C[C@H](OCC1=CC(=C(F)C=C1)C(F)(F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""47B9DA3AC0B38761_92A1CA1E6944B1F5_6039_UN""","""C[C@H](OCCC1=CC(=C(OC)C=C1)OC)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""1DEFA38EB2DEE980_3568A7429DC8EE2E_6039_UN""","""C[C@H](OCC1=CC=C(O[S](F)(=O)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""22EFDA241E4F9A62_EC553779E3BE0598_6039_UN""","""C[C@H](OCCC1=CC=CC(=C1)NC(C)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""025D3E3E61DB7306_11E5D6A270D4D307_6039_UN""","""C[C@H](OCC1=C(C)C=C(C=C1)C(F)(F)F)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""3D5F7AA96F3DF6E1_2067135BC2A5BB3F_6039_UN""","""C[C@H](OCCC1=C(C(F)(F)F)C=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""02E265898F6366C2_15F9CAD34DCC6A27_6039_UN""","""C[C@H](OCCC1=C[N](C)C2=C1C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F41BADDAAE18C036_57F350786791B413_6039_UN""","""C[C@H](OCC(=O)NCCCCCN=[N]#N)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""75D389CD36998C66_35350A611DCF83CC_6039_UN""","""C[C@H](OCCC1CCCC(C(F)(F)F)C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""8C4BE45E1D0FC962_CADFE0418C41F9E0_6039_UN""","""C[C@H](OCC1=CC=C(C=C1)C2CC(=O)C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""93D35B8427035627_782C3F12263D08A8_6039_UN""","""C[C@H](OCC(C1=CSC=C1C(OC)=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""DA2946C55C60C67D_1243A2653D99F839_6039_UN""","""C[C@H](OCC(=O)C2=C1C=CC=C[N]1C=N2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""0BDDDDEB3EF2A759_C0DB647DDA7F1D0D_6039_UN""","""C[C@H](OCC1=C(C(=N[N]1C)C)[S](=O)(=O)Cl)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""C7732EA2B393A7A2_1FF51ED55CD69410_6039_UN""","""C[C@H](OCC(C1=C(C)OC(=C1)C(=O)N)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2B6810E546820448_6F4B8AAC623C08FE_6039_UN""","""C[C@H](OCC1=NN=C(O1)N2CCCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""A314269AFBB39955_5566E0949163B93A_6039_UN""","""C[C@H](OCC1COC(O1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""D688A90A5009B9A7_842F129D8462E44B_6039_UN""","""C[C@H](OCC1=NN=C(O1)N2CCOCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F19D71324BC9434B_3F79788199E28897_6039_UN""","""C[C@H](OCC1=CC=C(C=C1)C2=NC=CO2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""C39FDEE2751C834D_E3361972FEC904CC_6039_UN""","""C[C@H](OCC1=N[N](CCC(F)(F)F)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""095B46A6E78F156D_18D85A1A0042F72D_6039_UN""","""C[C@H](OCC#CC1=CC(=CC(=C1)F)C#N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""8BC0561D8147A6C0_24741274368A8FD6_6039_UN""","""C[C@H](OCC1=CC(=N[NH]1)C2=CC=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""DC85029A7BA9BB33_6AC16C53DD021939_6039_UN""","""C[C@H](OCC1=CC=CC(=C1)SCCCC)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""0F69E7810174AFE1_44DEC5AF264B8F2E_6039_UN""","""C[C@H](OCC2=CC1=C(N(C)C(=O)S1)C=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""54EEB207882D6402_1FD99A4337916C60_6039_UN""","""C[C@H](OCC1=CC=CC(=C1)CCCOC)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""436BA77D9B64ABE1_4A8F66348AF56F06_6039_DP""","""C[C@H](OCC1=CC(=NO1)C2CCNCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""3CFE424149733606_65092EA7A419FD75_6039_UN""","""C[C@H](OCCC(C(F)F)C1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""5C564B7B09F5E888_F5E1D656B78E6CF6_6039_UN""","""C[C@H](OCC1=CC=C(CNC(C)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""758200BA3E829EE0_33717E84F32CC9F4_6039_UN""","""C[C@H](OCC1=NC=C(O1)C2CCOCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1A392C978D5E4602_3893437F364EAB03_6039_UN""","""C[C@H](OCCCCO[S](C(F)(F)F)(=O)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""0C01C1B6F83ED38E_E0CC763A99ED3236_6039_UN""","""C[C@H](OCC(N=[S](N(C)C)(=O)N(C)C)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""BA377D10A63149D2_7F6E3A7653B3B2B2_6039_UN""","""C[C@H](OCC2=CC1=C([N](CC)N=N1)C=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""E00EE0387100F868_67982C0E94C8B2E1_6039_UN""","""C[C@H](OCC1=CC=C(NC(OC)=O)C=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""087BD44E15228372_44A7506F8B9839E2_6039_UN""","""C[C@H](OCC1=CN=C(C(OC)=O)C=C1C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""6668F448352C1832_0A6385DECE8882AF_6039_UN""","""C[C@H](OCC1=N[N](C=C1C(OCC)=O)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""0DE6900BC5EFA758_377DB2C01FF04266_6039_UN""","""C[C@H](OCCC1=NOC2=C1C=CC(=C2)F)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""1C9B9C51AA33652F_6CE9F4D389DEE37A_6039_UN""","""C[C@H](OCC(=O)N2CC1=C(C=CC=C1)C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""0C565EF443ABDD1C_F83EE19B92CDFC4A_6039_UN""","""C[C@H](OCC2=CC1=C(N(C)C(=O)O1)C=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""93D61EDC6D09B6AE_67C9DD74E84EA43F_6039_UN""","""C[C@H](OCC1=CC(=NC(=N1)CC2CC2)C)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""BAB16E8374C5BC3F_5CF64B116A9B6AA6_6039_UN""","""C[C@H](OCC1=CC(=NC(=N1)C2CCC2)C)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""F3A528BAEB2382FA_11411FF3B6E8203A_6039_UN""","""C[C@H](OCC1=CC(=NC(=N1)C(F)(F)F)C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""F95BDD4CA5315174_3E2BC78F99AA42A4_6039_UN""","""C[C@H](OCC1=CC=N[N]1C2CCCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""8BC6BC643D27EC8E_7636DE683C559C7B_6039_UN""","""C[C@H](OCC(C1CCN(C(C)=O)CC1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""074247D0C050E1D0_6113F3D2E21A9719_6039_UN""","""C[C@H](OCC2CC1(CCOCC1)C(=O)O2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""913ADE641883E30D_911F40044ADF84D7_6039_UN""","""C[C@H](OCC1=C(C(=N[N]1C)C)[S](=O)(=O)N)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2258A35C097E2505_218B63E0DB672053_6039_UN""","""C[C@H](OCC(C(CC(OCC)=O)(C)C)=O)CN1CCCC1""",21,"""84B363E7BB3ACD30"""
-"""6CB208E37D06B7B6_BB6E21C6EB41822E_6039_UN""","""C[C@H](OCC1=C(C(OCC)=O)C=N[N]1C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""2C711CB83CB69ECF_34920D841D43D13F_6039_UN""","""C[C@H](OCC[N]1N=C(C(OC)=O)C=C1C)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""91B4A6EC9D4A901F_C8911255E3C18462_6039_UN""","""C[C@H](OCC(=O)C1CCCC2=C1C=CS2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""A5BBF87B313CC5C8_45717CA053E88C2A_6039_UN""","""C[C@H](OCC1=NC=C(O1)C2CCCCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""FD2D124E1B809569_3741BE04426F7FFD_6039_UN""","""C[C@H](OCC1=NC2=C([N]1CC)C=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""D43CD2469444C540_B2B1573325F37837_6039_UN""","""C[C@H](OCC1=C(C)C=C(C=C1)CC(=O)O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""00096AA195370353_F7DB362970073367_6039_UN""","""C[C@H](OCC1=CC(=NC(=N1)C2CC2C)C)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""A008E052023AEFD0_A15A1FDC4A153723_6039_UN""","""C[C@H](OCC1=C(CC)C=CC(=C1)[N](=O)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""734D458383AB2B21_DE31B8D6755865E7_6039_UN""","""C[C@H](OCC(C1CCCN(C(C)=O)C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""00A76EF04F2C6E9B_F674DDF7634F0053_6039_UN""","""C[C@H](OCC1=C(F)C=CC2=C1N=CC=C2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""E5541DD1AA67FCAF_B92005E55348F87C_6039_UN""","""C[C@H](OCC1=CSC(=N1)COC2CCC2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""590A56B5E2AA859C_E79345A91260CDC0_6039_UN""","""C[C@H](OCC2=NC1=C(C(=CC(=C1)F)F)[NH]2)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""80A3C532D2470E71_836C6114453990DC_6039_UN""","""C[C@H](OCC(=O)C1=CN=C2C=CC=C[N]12)CN3CCCC3""",21,"""84B363E7BB3ACD30"""
-"""845671714D486405_E0076FA17996654E_6039_UN""","""C[C@H](OCC(F)(F)C(=O)C1=CC=CC=C1)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
-"""74211AEA241C2F85_8555621EB3E05DE4_6039_UN""","""C[C@H](OCC(CC1=C(OC)C=CC=C1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
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-"""7864831D517A03C4_44595437C886F5C9_6039_DP""","""C[C@@H]3CC[C@H](OCC1=C(C)OC(=N1)C2=CC=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
-"""78E8E7F42A427F61_BF4EFB9A75BF1244_6039_DP""","""C[C@@H]3CC[C@H](OCC1=NC2=C([N]1C(F)F)C=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
-"""248058DCA3EB6E2E_B819D1F94AC9DC5D_6039_DP""","""C[C@@H]3CC[C@H](OCC1=COC(=N1)C2=CC=C(C)C=C2)CN3""",21,"""CF192C8E56414A6F"""
-"""6055CB94DD33CB93_A205FF5967AEF6D5_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=CC=C(CC(OC)=O)S1)=O)CN2""",21,"""CF192C8E56414A6F"""
-"""2918C3124387B9E2_698BA9189B9DB530_6039_DP""","""C[C@@H]3CC[C@H](OCC1=COC(=N1)C2=CC=C(F)C=C2)CN3""",21,"""CF192C8E56414A6F"""
-"""E834E103EC5891A6_55ACD4E539605854_6039_DP""","""C[C@@H]3CC[C@H](OCC1=NC=C[N]1CC2=CC=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
-"""5C4F380025704EFA_F7AAF2DF1A3F3C47_6039_DP""","""C[C@@H]2CC[C@H](OCC(=O)NCCSCC1=CC=CS1)CN2""",21,"""CF192C8E56414A6F"""
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-"""AEC517C24B2737D2_83D5D660EC3F3143_6039_DP""","""C[C@@H]3CC[C@H](OCC(=O)N1CCCC1C2=CC=CS2)CN3""",21,"""CF192C8E56414A6F"""
-"""7D449C028C167F28_EA4D930CBED37433_6039_DP""","""C[C@@H]1CC[C@H](OCC(N(C)CC(=O)NC(C)(C)C)=O)CN1""",21,"""CF192C8E56414A6F"""
-"""BE6D94461CEF4B0C_26857328A4994848_6039_DP""","""C[C@@H]2CC[C@H](OCC(OC1=CC=C(OCC)C=C1)=O)CN2""",21,"""CF192C8E56414A6F"""
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-"""C255644501769810_3135A77FBAD8ECF2_6039_DP""","""C[C@@H]2CC[C@H](OCC(N=C1C=CNN1CC(C)C)=O)CN2""",21,"""CF192C8E56414A6F"""
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-"""697C827D163078A9_E4B42AEE8B45493D_6039_DP""","""C[C@@H]3CC[C@H](OCC(=O)N1CCCC1C2=CSC=C2)CN3""",21,"""CF192C8E56414A6F"""
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-"""4339F11DB4499CFD_8A5F384BC9B1DFEE_6039_DP""","""C[C@@H]3CC[C@H](OCC(C1=C[NH]C2=CC=CC(=C12)C)=O)CN3""",21,"""CF192C8E56414A6F"""
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-"""727A488C960288A6_5404627144025E05_6039_DP""","""C[C@@H]2CC[C@H](OCCOC1=C(OC)C=C(C=C1)C#N)CN2""",21,"""CF192C8E56414A6F"""
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-"""5D0FAAAA407F3EFB_2FF939596359D72D_6039_DP""","""C[C@@H]3CC[C@H](OCC2=NN=C(C1=CC=CC(=C1)F)O2)CN3""",21,"""CF192C8E56414A6F"""
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-"""081F3547395F8156_CB43D33FE648AE96_6039_DP""","""C[C@@H]3CC[C@H](OCC[N]1N=CC(=C1)C2=CC=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
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-"""A85B3C12D76AF1B2_62D323F08286B420_6039_DP""","""C[C@@H]2CC[C@H](OCC(NC1=NN=C(C(C)(C)C)S1)=O)CN2""",21,"""CF192C8E56414A6F"""
-"""4E37D1653B687031_DA535E28BADD5CBE_6039_DP""","""C[C@@H]3CC[C@H](OCC1=NN=C([N]1C)C2=CC=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
-"""11FD8667324A96A2_9A4A5644CDA1354D_6039_DP""","""C[C@@H]2CC[C@H](OCCC1=CC=CC(=C1)OC(F)(F)F)CN2""",21,"""CF192C8E56414A6F"""
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-"""8087B14A23E92F6D_F817F48579179C3A_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=C(C(=C(C)[NH]1)C(C)=O)C)=O)CN2""",21,"""CF192C8E56414A6F"""
-"""306234D061992309_2577D6C5C520887E_6039_DP""","""C[C@@H]3CC[C@H](OCC(=O)N1CCSC2=C1C=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
-"""EFCBC6B93564686C_88771195F0A05FEA_6039_DP""","""C[C@@H]2CC[C@H](OCC1=C(C=C(C(N)=O)C=C1)[N](=O)=O)CN2""",21,"""CF192C8E56414A6F"""
-"""E0354D6C1AEF6151_8DA05220AC814950_6039_DP""","""C[C@@H]2CC[C@H](OCCC(=O)NC(=O)NC1CCCC1)CN2""",21,"""CF192C8E56414A6F"""
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-"""732AC18821A07BBE_398BB765D5359BC1_6039_DP""","""C[C@@H]2CC[C@H](OCC(N1CCN([S](C)(=O)=O)CC1)=O)CN2""",21,"""CF192C8E56414A6F"""
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-"""9409D447D8EA6AEE_D721C6691393D8F2_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=C([N](C(C)C)C(=C1)C)C)=O)CN2""",21,"""CF192C8E56414A6F"""
-"""DBCAF7FFA464EB9B_D956AD015D13DAB3_6039_DP""","""C[C@@H]1CC[C@H](OCCC(NC(NCC(F)(F)F)=O)=O)CN1""",21,"""CF192C8E56414A6F"""
-"""23698B0736876EEA_AE9F047AF18CEFD8_6039_DP""","""C[C@@H]2CC[C@H](OCC(N(C(C)C)C1CCCCC1)=O)CN2""",21,"""CF192C8E56414A6F"""
-"""3A9230DEA581FE12_4130CD64C398ED42_6039_DP""","""C[C@@H]3CC[C@H](OCC(=O)C1CCCC2=C1C=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
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-"""20E55A396CBADC74_84145BE4EAE3BECE_6039_DP""","""C[C@@H]2CC[C@H](OCC(=O)N(CC=C)CC1=CC=CS1)CN2""",21,"""CF192C8E56414A6F"""
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-"""3D87C7C645486675_59BA526753C1630A_6039_DP""","""C[C@@H]4CC[C@H](OCC3CC1(CC2(C1)OCCO2)CO3)CN4""",21,"""CF192C8E56414A6F"""
-"""F6576570A23EA26D_85D2514595B48D68_6039_DP""","""C[C@@H]2CC[C@H](OCC1=NOC(=N1)C(OCC)OCC)CN2""",21,"""CF192C8E56414A6F"""
-"""3762FE5093DEB2A2_DEE3295639C5F6E0_6039_DP""","""C[C@@H]3CC[C@H](OCC(=O)N1CCO[C@@H]2CCCC[C@H]12)CN3""",21,"""CF192C8E56414A6F"""
-"""6FB53AEC447429CE_CA95C5A2B636BAD0_6039_DP""","""C[C@@H]4CC[C@H](OCC2OC(=O)C1(CCC1)C23CCC3)CN4""",21,"""CF192C8E56414A6F"""
-"""27E65EF27258E3AE_BB37CFC98725EC32_6039_DP""","""C[C@@H]2CC[C@H](OCCOCCOCC1=CC=CC=C1)CN2""",21,"""CF192C8E56414A6F"""
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-"""554227DAEED5DF0F_76DFC1849482E964_6039_DP""","""C[C@@H]2CC[C@H](OCC(=O)NCC=CC1=CC=CC=C1)CN2""",21,"""CF192C8E56414A6F"""
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-"""F4320FE4C0F51465_F276361FF2455886_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=C([N](CCC)C(=C1)C)C)=O)CN2""",21,"""CF192C8E56414A6F"""
-"""BC7304A0504CEF8B_68C951EC78D0CC4B_6039_DP""","""C[C@@H]2CC[C@H](OCC(NCC1=CC=C(OC)C=C1)=O)CN2""",21,"""CF192C8E56414A6F"""
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-"""DE17FE189696E923_5C8D77E5EDDA3BA1_6039_DP""","""C[C@@H]2CC[C@H](OCC(N(C)CC1=CC=C(C=C1)C)=O)CN2""",21,"""CF192C8E56414A6F"""
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-"""4780D35C6123D6C6_A516E9E91FC02012_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=CN=C(C(F)(F)F)C=C1)=O)CN2""",21,"""CF192C8E56414A6F"""
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-"""EF115481F5B39519_62291AB921805527_6039_DP""","""C[C@@H]2CC[C@H](OCC(N=C1C=CNN1CCCC)=O)CN2""",21,"""CF192C8E56414A6F"""
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-"""E3994AADF8B9905D_855269F240E82823_6039_DP""","""C[C@@H]2CC[C@H](OCC(N[C@H](C)C1=CC=C(C=C1)F)=O)CN2""",21,"""CF192C8E56414A6F"""
-"""9868C677C4582C43_9258E4B905375ECA_6039_UN""","""COC(=O)C1CC(OCC(NOC)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""5CE9C7E61FC04AFA_2DDD6D01F71AC5AC_6039_UN""","""COC(=O)C1CC(OCCC(OC)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""D5D06DE4B202A286_A8DA3629B9A1E31D_6039_UN""","""COC(=O)C1CC(OCC(OC)OC)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""BC68549A27D3314A_E2285A7937FF66B2_6039_UN""","""COC(=O)C1CC(OCC(C(O)=O)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""F49712357ECB81ED_A76222F0258A4DC7_6039_UN""","""COC(=O)C1CC(OCCOC(C)C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""B0F100729FED4D59_21557B1668735DDE_6039_UN""","""COC(=O)C2CC(OCC1OCCO1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""7878167A003C2254_89C25ABDD24A5029_6039_UN""","""COC(=O)C2CC(OCC1CCCO1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""A9FCDAA04C365608_B93CD09BCD5A8BCD_6039_UN""","""COC(=O)C1CC(OCCC(NC)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""AE3DCC8C7A5957A9_E4DBD4DFA8E6039D_6039_UN""","""COC(=O)C1CC(OCCCN=C=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""638DA5F78793BD74_10A1BF9C7C583BF9_6039_UN""","""COC(=O)C2CC(OCC1=NC=NO1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""F3CFADDECCEBA644_3DD7704A4F94EC7B_6039_UN""","""COC(=O)C2CC(OCC(=O)C1CC1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""AF1D82810DFEB5B8_0E5AE8AD84A4A68B_6039_UN""","""COC(=O)C1CC(OCC(CCC)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""483C6F973B04AC42_862EAE0219630B1F_6039_UN""","""COC(=O)C1CC(OCC(C(C)C)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""0FEA52C29F4CF57D_9C8366E195D71178_6039_UN""","""COC(=O)C1CC(OCCCCOC)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""1CC9296744E2A720_477D36FFC6FA9537_6039_UN""","""COC(=O)C1CC(OCCCN(C)C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""BB9FA072F6197A99_8CCCE05299B45E88_6039_UN""","""COC(=O)C1CC(OCCCOCC)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""2A035599E7F5F55D_A770E5F9EAA90B9E_6039_UN""","""COC(=O)C1CC(OCCCC(C)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""0263F3790AE944C2_65C781B0A7B8424B_6039_UN""","""COC(=O)C2CC(OCC1=NOC=N1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""4588EB83CFC6D763_3FC196C0B479FD42_6039_UN""","""COC(=O)C1CC(OCCC(C)(C)C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""D16CF9D52AB9551D_8AECB8E77E644296_6039_UN""","""COC(=O)C2CC(OCC1=CSC=N1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""85CB5B0DA5E17465_10E27B8F0D4DC4DB_6039_UN""","""COC(=O)C2CC(OCC1=NN=N[NH]1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""D22301C1BC9588E7_177585F9C9E130DD_6039_UN""","""COC(=O)C2CC(OC[CH]=[C]1C[CH2]C1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""5109B20F45CA5917_1B50D9D38F762DA5_6039_UN""","""COC(=O)C1CC(OCC(N(C)C)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""4B61DE5F9EE8D967_154B715B1F422618_6039_UN""","""COC(=O)C1CC(OCC#CCOC)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""F6765AA29FA24F1B_A18E69330F2C4499_6039_UN""","""COC(=O)C1CC(OCCC(Cl)(Cl)Cl)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""30FE887E07F16329_3EF1897C9C2E85D1_6039_DP""","""COC(=O)C1CC(OCCCC(O)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""EC96A8A2E6719D6A_91E51BD8A6CA5199_6039_UN""","""COC(=O)C2CC(OCC1=C[NH]C=N1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""4020F4459A25C713_362617B89570E4ED_6039_UN""","""COC(=O)C1CC(OCCC=CCC)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""DEC9D45BFD4FA76B_5ED7F009683A33DE_6039_UN""","""COC(=O)C1CC(OCCCC(C)C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""90DC16ED81FD85FC_BE5A4DC88FE63EF0_6039_DP""","""COC(=O)C1CC(OCCOCCN)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""9D1D3D07E37C7B07_1684979584AF3733_6039_UN""","""COC(=O)C1CC(OCCC(NO)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""01AB8788E0B4C53B_9CB028BE3846A7F4_6039_UN""","""COC(=O)C2CC(OCC1=C[NH]N=C1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""F572DDE59F1968F7_876D4687810E6B97_6039_UN""","""COC(=O)C1CC(OCC[S](C)(=O)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""F00D91EE7B3655A0_541278CDFB220671_6039_UN""","""COC(=O)C1CC(OCC(COC)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""AB9DF5CEE9854A17_C6C50AEFF4C34FFB_6039_DP""","""COC(=O)C2CC(OCCC1CNC1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""0AFBDE59D7CC4210_CB3FCBAF3B85341D_6039_UN""","""COC(=O)C1CC(OCCCCCF)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""59D81A86BB6DE3FB_95182EAA961A2AE5_6039_UN""","""COC(=O)C1CC(OCCSC(C)C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""8603E79568CD9966_D8A0C4024AA14E50_6039_UN""","""COC(=O)C2CC(OCC1=C[NH]N=N1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""89E057E8CF2EC1B3_5321C68377407CC4_6039_UN""","""COC(=O)C1CC(OCC(OCC)=N)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""9E952AD8DFAF82F8_897D8E8043724687_6039_UN""","""COC(=O)C2CC(OCC1=CC=N[NH]1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""6923502F4BB6685A_C7ADEAF82DCB2D55_6039_UN""","""COC(=O)C1CC(OCC(C(C)=O)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""532190B0560AF34F_DF8DF22141FCFEBF_6039_UN""","""COC(=O)C2CC(OCC1=CN=NS1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""B1A70903B60DA9D1_E9A7F50326A33BFE_6039_UN""","""COC(=O)C1CC(OCC[S](F)(=O)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""1B6CC20FC486B8DA_61DC0566E471F047_6039_UN""","""COC(=O)C2CC(OC[C@H]1CCCO1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""EB93EA57885ACDF6_B28DC1F0A9575DFF_6039_UN""","""COC(=O)C1CC(OCC[Si](C)(C)C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""4536B1A1683FCB87_0F9CF132611D012A_6039_UN""","""COC(=O)C1CC(OCC(NCC)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""11E63D0B826787E0_A816B715159BB434_6039_UN""","""COC(=O)C1CC(OCCOCC=C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""5AF9BDC4F967CDD5_2C46CD7594823C9D_6039_UN""","""COC(=O)C2CC(OCC1=CSC=C1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""ACB1A51F7B9388A3_3980D57CED5E067F_6039_UN""","""COC(=O)C2CC(OCC1=COC=C1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""CA8982521AEF1C48_45E9270876F2DF8E_6039_UN""","""COC(=O)C1CC(OCC#CC(O)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""F0D8948156724493_AEB4BCCCE9AF6E3E_6039_UN""","""COC(=O)C2CC(OCC1=NC=C[NH]1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""FA507903C082A899_1CD6126218FD3926_6039_UN""","""COC(=O)C2CC(OCC1=CSN=N1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""204C91CDFE4A2D47_6CF1799496096AC9_6039_UN""","""COC(=O)C2CC(OCC1=NON=C1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""4E68F7394E3F7F57_3CDB1F8BAC625E72_6039_UN""","""COC(=O)C2CC(OCC1=NOC=C1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""5555A758A927CE41_13113FB46D2C57C7_6039_UN""","""COC(=O)C1CC(OCCCCC=C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""6A16BA818FA1B256_C21D695B752AEF5E_6039_UN""","""COC(=O)C2CC(OCC1=NSN=C1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""2981F0300FE960B9_BDE15AF946B0A21E_6039_UN""","""COC(=O)C2CC(OCC1=CC=NO1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""F3F8BDDB640A8DB8_AEBC38A669DF6095_6039_UN""","""COC(=O)C2CC(OCC1=CON=C1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""EFC78D73D8CED4BF_F83109D3DDB62055_6039_UN""","""COC(=O)C2CC(OCC1COCO1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""B6635D211248B155_6E87405783D0462C_6039_UN""","""COC(=O)C1CC(OCCSC(C)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""4ACFD2F49945882B_9417CBD0CEB3A213_6039_UN""","""COC(=O)C1CC(OCC(CC)OC)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""3BB2BBD536E6C063_C21235CFBBEA1E2D_6039_UN""","""COC(=O)C2CC(OCC1=NN=CO1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""97A06097B713811A_6E489A16068AFF02_6039_UN""","""COC(=O)C1CC(OCCC(F)(F)Cl)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""16E65C7DFD00DF92_49E6AF2B56F87FEA_6039_UN""","""COC(=O)C1CC(OCC[S](O)(=O)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""96EEB9B514784607_BB0D64F69F6BBF6F_6039_UN""","""COC(=O)C2CC(OCCOC1CC1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""D0153E05EA903F44_72EF83F4B30E09AC_6039_UN""","""COC(=O)C2CC(OCC1=CN=CS1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""87EE92B133D36357_8C99678AAF058248_6039_UN""","""COC(=O)C2CC(OCC1=CC=NS1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""91A1490624E54ABB_4B2E9679BF5196BF_6039_UN""","""COC(=O)C2CC(OCC1CC(=O)O1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""25D867591B95302C_7697CF4F22164104_6039_UN""","""COC(=O)C1CC(OCCOC(C)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""A7FB64C76D4D1140_60D34D3DCA665F6F_6039_UN""","""COC(=O)C1CC(OCCOCC#C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""6F2B5F7961EF4131_DCF83C2274F42770_6039_UN""","""COC(=O)C1CC(OCC(CC)(F)F)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""187AD330F3772133_B7792209CDF937D7_6039_DP""","""COC(=O)C2CC(OC[C@H]1CCCN1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""FB94207FBBB83DAF_647AAD498598EBBE_6039_UN""","""COC(=O)C2CC(OCC1OC1(C)C)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""B8DFBFDB519FED18_A00BF8DF80BEE2A7_6039_DP""","""COC(=O)C1CC(OCC(C=CO)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""39D35E9759B9EF39_82000868F0B11E93_6039_UN""","""COC(=O)C2CC(OCC1=CSN=C1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""0B71B0B9D5C35F49_65D01DDA1E6F1109_6039_UN""","""COC(=O)C2CC(OCC1=NCCO1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""D7A013779EACBA6D_F96883BFBC36A06B_6039_UN""","""COC(=O)C2CC(OCC1=NN=CS1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""FACDC00B37D3F753_88DD52F8EFC4043B_6039_UN""","""COC(=O)C2CC(OCCCC1CC1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""671E23A885775C07_D6AC756330618BB5_6039_UN""","""COC(=O)C1CC(OCC(C(F)F)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""8D1127B69605952C_F9A12F970AC2D5BD_6039_UN""","""COC(=O)C2CC(OCC1=NOCC1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""AB777B7FB61476F7_C8F24C8C44BA1ACF_6039_UN""","""COC(=O)C1CC(OCC(OCC)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""E1070BBAD3BA0571_9B8A5B6F23C152CF_6039_UN""","""COC(=O)C1CC(OCC[S](N)(=O)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""30D523B76037FDE9_BD8E5D9F02966176_6039_UN""","""COC(=O)C1CC(OCCCCC#N)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""9BD2DA3ABB527A45_42DF9F6AEB2BFCF3_6039_UN""","""COC(=O)C1CC(OCCC=CC=C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""169922E89CD4E495_95835C6E92D07868_6039_UN""","""COC(=O)C1CC(OCCNC(C)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""014593085B92DA64_D8D1620B9363B5D9_6039_UN""","""COC(=O)C1CC(OCC[S](=O)(=O)Cl)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""DFF2CF555EB86EA4_96213DE61D8AA8B4_6039_UN""","""COC(=O)C1CC(OCCCCCC)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""639C79E69DB9AC03_8765A08C4CE084A4_6039_UN""","""COC(=O)C1CC(OCCC(CC)C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""80AE9C5263E04DAB_B0044FA6EE269264_6039_UN""","""COC(=O)C1CC(OCCCC(C)=C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""E2789427C6742703_0F2F3ACE2E27EAAD_6039_UN""","""COC(=O)C1CC(OCC(=C)CC#N)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""7AE2CA66CF11D134_7E03A9DD641DA7A8_6039_UN""","""COC(=O)C1CC(OCCCC(F)F)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""2721CAFEB80B1A42_DB10FE191ADF2AC4_6039_UN""","""COC(=O)C1CC(OCCC=C(C)C)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""39C5CBA8ED280D0D_65999B3A53D5E11C_6039_UN""","""COC(=O)C1CC(OCC=C(C)C#N)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""AE72C6206FB5660E_FC30D5C16C0AE460_6039_UN""","""COC(=O)C1CC(OCC(NCO)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""3A9DE1809DAF6F74_B13567BAB3866AA4_6039_UN""","""COC(=O)C1CC(OCCOC(F)F)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""A2C0FD4BDADDE339_B15780A2DBF69716_6039_UN""","""COC(=O)C2CC(OCCC1(C)CC1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""90F6FCAE005C04DF_D39DE4B8D5770090_6039_UN""","""COC(=O)C2CC(OCC#CC1CC1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""741D0F15C768B762_1284210901BF26A2_6039_UN""","""COC(=O)C2CC(OCCC1COC1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""73E52F8B7E97451C_9E9EF0B09362B7DA_6039_UN""","""COC(=O)C1CC(OCCCC(N)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
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-"""E02662F5EF53AA85_1EBB575A75F616BE_6039_DP""","""COC(=O)C1CC(OCC([C@@H](C)N)=O)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""7F84028700CCD3B0_375C1E1EDC83D6A9_6039_UN""","""COC(=O)C2CC(OCCN1CCC1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
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-"""C6F01385D8117DC8_69D0CEAAB1F9BE65_6039_UN""","""COC(=O)C1CC(OCCCN=[N]#N)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
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-"""56CBCB3C75A1D0A1_3B449ACF7FAFEE71_6039_DP""","""COC(=O)C1CC(OCCCCCO)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""9B7EED69C07B7962_4933A65FC89B9479_6039_UN""","""COC(=O)C1CC(OCCOCCC)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
-"""3C35804CC6E486FB_237254ED10EBE184_6039_UN""","""COC(=O)C2CC(OCC1=NC=CS1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
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-"""A24F5AC96186FDB7_BB3D5A6171A854E6_6039_UN""","""COC(=O)C2CC(OCCCC1CO1)CC(C2)C(=O)OC""",21,"""5FAF2C46D6D93649"""
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-"""39991FCDBDBE2F9C_09AE8C7E38435657_6039_UN""","""COC(=O)C1CC(OCCCC=CC)CC(C1)C(=O)OC""",21,"""5FAF2C46D6D93649"""
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-"""F3276B140FF2AF3B_6D4B500D15B5423E_6039_DP""","""COC(=O)[C@H](COCC(=O)NCCCN1CCCC1=O)N""",21,"""900EDC69AE6D7356"""
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-"""84697A6E1AFA3D03_A3D1EB209C30E99A_6039_DP""","""COC(=O)[C@H](COCCCC(OC1=CC=C(F)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
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-"""430FDCBC1078AC2F_BBBCC7C17686FA99_6039_DP""","""COC(=O)[C@H](COCC(=O)NC2=NC1=C(C=CC=C1)S2)N""",21,"""900EDC69AE6D7356"""
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-"""FB9678D8ECDE8F56_686BC8024B4E7312_6039_DP""","""COC(=O)[C@H](COCC(=O)NCCCC1=CC=CC=C1)N""",21,"""900EDC69AE6D7356"""
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-"""1A38647DF9CB51F7_BFA13726A677AA49_6039_DP""","""COC(=O)[C@H](COCC(C1=CC=C(C(C)(C)C)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""C5FC79213AEE1F68_FD001B5CB98CE757_6039_DP""","""COC(=O)[C@H](COCC(NCC1=CC=CC(=C1)OC)=O)N""",21,"""900EDC69AE6D7356"""
-"""8F7DFE44F5C05306_E795900A516C1257_6039_DP""","""COC(=O)[C@H](COCC1=C(OCC)C=CC(=C1)C(=O)C)N""",21,"""900EDC69AE6D7356"""
-"""2044377C7CBCAB48_8C331A15A8609523_6039_DP""","""COC(=O)[C@H](COCC2=NC1=C(C(=C(C)S1)C)C(N2)=O)N""",21,"""900EDC69AE6D7356"""
-"""7DBFECDFB44CA5F8_181C365A59CF504A_6039_DP""","""COC(=O)[C@H](COCC(=O)NC(=O)NC1CCCCC1)N""",21,"""900EDC69AE6D7356"""
-"""8BB9B72C2929B17B_1A3BB226FC4C98F2_6039_DP""","""COC(=O)[C@H](COCC(C1=CC(=C(OC)C=C1)OC)=O)N""",21,"""900EDC69AE6D7356"""
-"""49F66F1617961D77_C67378FB8760EDD8_6039_DP""","""COC(=O)[C@H](COCC(NC1=NN=C(CC(C)C)S1)=O)N""",21,"""900EDC69AE6D7356"""
-"""C7582A3FA8CE9BDD_D84BC7DA399F2295_6039_DP""","""COC(=O)[C@H](COCC(C1=CC=C(CNC(C)=O)O1)=O)N""",21,"""900EDC69AE6D7356"""
-"""E3FA050E2DA761E4_086852FE3CCF1C58_6039_DP""","""COC(=O)[C@H](COCC(C1=C(C)[N](C(=C1)C)CC=C)=O)N""",21,"""900EDC69AE6D7356"""
-"""DEA64991D3DCCCD4_5CD20DE0C454899A_6039_DP""","""COC(=O)[C@H](COCC(C1=C(C)[NH]C2=C1C=CC=C2)=O)N""",21,"""900EDC69AE6D7356"""
-"""D88904E7267B8DF0_975E207C36E401F3_6039_DP""","""COC(=O)[C@H](COCC(C1=C(C=C(OC)C=C1)OC)=O)N""",21,"""900EDC69AE6D7356"""
-"""0327F87B23A04D8D_63BCED9C514B7B3F_6039_DP""","""COC(=O)[C@H](COCC(=O)NNC(=O)C1=CC=CC=C1)N""",21,"""900EDC69AE6D7356"""
-"""A2E3BEDB4A97083A_C3BD4497B76849AE_6039_DP""","""COC(=O)[C@H](COCC(C1=CC=C(CCCC)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""8016B99CCADB1855_C1ABE616EE229B4A_6039_DP""","""COC(=O)[C@H](COCC(N(CC)CC(=O)NC(C)C)=O)N""",21,"""900EDC69AE6D7356"""
-"""03B5F5263B011BF9_CF1684A1E048A79C_6039_DP""","""COC(=O)[C@H](COCCC(NC1=CC=C(OC)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""0153FDD1F6CEEA12_8055D44D85E0CD36_6039_DP""","""COC(=O)[C@H](COCCOC1=CC=C(C(C)(C)C)C=C1)N""",21,"""900EDC69AE6D7356"""
-"""1CD966093E78D609_2B1E4D8200A66E32_6039_DP""","""COC(=O)[C@H](COCC(NCCC1=C(C)C=CC=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""3F8F5A09D9395748_E6D19FA89BDAB6D0_6039_DP""","""COC(=O)[C@H](COCC(NC1=CC=CC(=C1)C(O)=O)=O)N""",21,"""900EDC69AE6D7356"""
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-"""E5E42FBC8916C43A_BC1865FA3291F0B1_6039_DP""","""COC(=O)[C@H](COCC(=O)NC1=CC=C(C=C1)CC#N)N""",21,"""900EDC69AE6D7356"""
-"""A4D164C2BC26604A_9C86A4C7F18C5116_6039_DP""","""COC(=O)[C@H](COCC(C1=C(C=CC(=C1)CC)CC)=O)N""",21,"""900EDC69AE6D7356"""
-"""5F956FB097E5272C_9BE12D9404965846_6039_DP""","""COC(=O)[C@H](COCC(N(C)C1(CCCCC1)C#N)=O)N""",21,"""900EDC69AE6D7356"""
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-"""FBA3AC89D0F610BE_8A8846B8728DC2CC_6039_DP""","""COC(=O)[C@H](COCC(C1=C(C(=C(C)C=C1C)C)C)=O)N""",21,"""900EDC69AE6D7356"""
-"""402ABEE50353142B_DDFF36524C776E44_6039_DP""","""COC(=O)[C@H](COCC1=NC(=NO1)C2=CC=C(C)C=C2)N""",21,"""900EDC69AE6D7356"""
-"""6E2263D0D46B523A_9A80C461FBA859B8_6039_DP""","""COC(=O)[C@H](COCC1=CC=CC(=C1)[S](N(C)C)(=O)=O)N""",21,"""900EDC69AE6D7356"""
-"""4EA86206B2A5AD19_933B300797D2B7CE_6039_DP""","""COC(=O)[C@H](COCC(C1=C(C)[N](C(=C1)C)C2CC2)=O)N""",21,"""900EDC69AE6D7356"""
-"""2BFB1133E22DBEB4_9BAC1885BBA6A5EF_6039_DP""","""COC(=O)[C@H](COCC1=NN=N[N]1CC2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""6D91BF40AC903630_250E4FC8B792DBC0_6039_DP""","""COC(=O)[C@H](COCC(N(C)CC1=CC(=CC=C1)F)=O)N""",21,"""900EDC69AE6D7356"""
-"""5D93ACF1541B7A4B_1B4EA4D030AACCF0_6039_DP""","""COC(=O)[C@H](COCC1=C(C)OC(=N1)C2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""96B6AC1938DF9429_E0590B7D8D932B7D_6039_DP""","""COC(=O)[C@H](COCC1=NC2=C([N]1C(F)F)C=CC=C2)N""",21,"""900EDC69AE6D7356"""
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-"""026FCBFF3240085B_FD120FBE9F82CFEC_6039_DP""","""COC(=O)[C@H](COCC(C1=CC=C(CC(OC)=O)S1)=O)N""",21,"""900EDC69AE6D7356"""
-"""72B4851444E46398_369C59FF63B18C09_6039_DP""","""COC(=O)[C@H](COCC1=COC(=N1)C2=CC=C(F)C=C2)N""",21,"""900EDC69AE6D7356"""
-"""A7D8C5E60BF99F6D_0ABB2402C14C616D_6039_DP""","""COC(=O)[C@H](COCC1=NC=C[N]1CC2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""5B83E30AF8BA630D_A8BD0238E213057E_6039_DP""","""COC(=O)[C@H](COCC(=O)NCCSCC1=CC=CS1)N""",21,"""900EDC69AE6D7356"""
-"""A5DC34B961D5AAFE_950FA24943BCFBDC_6039_DP""","""COC(=O)[C@H](COCC(NC1=C(C(=C(C)O1)C)C#N)=O)N""",21,"""900EDC69AE6D7356"""
-"""4948F04BCB6060A7_5A7FD05BA3B14762_6039_DP""","""COC(=O)[C@H](COCCC(=O)NC1=CC=C(C=C1)C#N)N""",21,"""900EDC69AE6D7356"""
-"""4BBC83D78B2E14EB_4E84EF48CADB11A9_6039_DP""","""COC(=O)[C@H](COCCC(=O)NC1=C(C=CC=C1)C#N)N""",21,"""900EDC69AE6D7356"""
-"""CB14E2B058396B7C_CD3CFF58C7D90751_6039_DP""","""COC(=O)[C@H](COCCC(NC1=C(OC)C=CC=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""50A39DCD0EFB041F_21BAA0AEED62EBCF_6039_DP""","""COC(=O)[C@H](COCCC(=O)NC1=CC(=CC=C1)C#N)N""",21,"""900EDC69AE6D7356"""
-"""B696C22535352662_DCC226871413087A_6039_DP""","""COC(=O)[C@H](COCC(=O)N1CCCC1C2=CC=CS2)N""",21,"""900EDC69AE6D7356"""
-"""93746B7E1D72299E_B55A63EB46FF4D0A_6039_DP""","""COC(=O)[C@H](COCC(N(C)CC(=O)NC(C)(C)C)=O)N""",21,"""900EDC69AE6D7356"""
-"""A10EFE5CC72A69FB_799283CF5CB57171_6039_DP""","""COC(=O)[C@H](COCC(OC1=CC=C(OCC)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""FBD170FFA7F2B702_C39B51F5DF541FAD_6039_DP""","""COC(=O)[C@H](COCC(C1=CC=C([S](C)(=O)=O)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""9AE50F138E6180FF_F2D55AB224BF72EF_6039_DP""","""COC(=O)[C@H](COCC(N(CC)C1CC[S](=O)(=O)C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""89A43785AC68F875_08B0E4D545436253_6039_DP""","""COC(=O)[C@H](COCC2=NN=C(C1=C(C)OC(=C1)C)O2)N""",21,"""900EDC69AE6D7356"""
-"""C7F0B7DF4B55C316_40C6D541A2405CB3_6039_DP""","""COC(=O)[C@H](COCC(C1=CC=C(CNC(C)=O)S1)=O)N""",21,"""900EDC69AE6D7356"""
-"""C5B01D3A10398073_CDF5BAF898435A5D_6039_DP""","""COC(=O)[C@H](COCC2=NN=C(C1=C(F)C=CC=C1)O2)N""",21,"""900EDC69AE6D7356"""
-"""C2C4A214CC2E7240_3838CA13CCD7A4E6_6039_DP""","""COC(=O)[C@H](COCC1=C(C=C(C(=C1C)C(C)=O)C)C)N""",21,"""900EDC69AE6D7356"""
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-"""032E98ECFE8D85A3_CCB2084BEC64EFB6_6039_DP""","""COC(=O)[C@H](COCC2=NC1=C(C=C([N](=O)=O)C=C1)[NH]2)N""",21,"""900EDC69AE6D7356"""
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-"""508B6CBAD5E288F9_1BA69F877307EEB9_6039_DP""","""COC(=O)[C@H](COCCCN1C(=O)OC2=C1C=CC=C2)N""",21,"""900EDC69AE6D7356"""
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-"""7FBE40F783F22521_A2618C45B55BD745_6039_DP""","""COC(=O)[C@H](COCC(C1=CC=C(CC(C)C)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""B3955271AD186DFD_D73C38C5E5235378_6039_DP""","""COC(=O)[C@H](COCC(C1=CC=C([S](N)(=O)=O)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""94C35C819EDD8777_168C4131A0E82176_6039_DP""","""COC(=O)[C@H](COCC(NC1=C(C(O)=O)C=CC=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""7CA148508A673F1E_A29C207979F4CF08_6039_DP""","""COC(=O)[C@H](COCC(=O)N(CC1=CC=CS1)C2CC2)N""",21,"""900EDC69AE6D7356"""
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-"""9A9405AAFE7EFB4A_61DA73C3363DC674_6039_DP""","""COC(=O)[C@H](COCC2=NC1=C(C)C=CC=C1C(N2)=O)N""",21,"""900EDC69AE6D7356"""
-"""BC90F036B0B92F4C_2A19BC28300AD39D_6039_DP""","""COC(=O)[C@H](COCC(=O)NC1(CCCCCC1)C#N)N""",21,"""900EDC69AE6D7356"""
-"""DB1DEA3AC918F85E_5467B2E0ECDC7992_6039_DP""","""COC(=O)[C@H](COCC(NC1=CC(=NO1)C(C)(C)C)=O)N""",21,"""900EDC69AE6D7356"""
-"""4B07C1FE0660D06C_F342CE2FA3767406_6039_DP""","""COC(=O)[C@H](COCC(C1=C(C)C2=C(O1)C=CC=C2)=O)N""",21,"""900EDC69AE6D7356"""
-"""7D59863E55E07EF0_E720C6A43F46F4BA_6039_DP""","""COC(=O)[C@H](COCC(C1=C(C=CC(=C1)OC)OC)=O)N""",21,"""900EDC69AE6D7356"""
-"""CA528E810F47C732_9E256E721348AD03_6039_DP""","""COC(=O)[C@H](COCC1=NC(=NO1)C2=C(C)C=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""28E10004CFB41F2E_D0F3FCF0858E0BF5_6039_DP""","""COC(=O)[C@H](COCCC[Si](OCC)(OCC)OCC)N""",21,"""900EDC69AE6D7356"""
-"""4F50E0C486EDC7FF_BF27EB46B5534AA5_6039_DP""","""COC(=O)[C@H](COCC(=O)N1CCCC2CCCCC12)N""",21,"""900EDC69AE6D7356"""
-"""D95BC483D0658233_77EBEBB3F634205F_6039_DP""","""COC(=O)[C@H](COCCN2C=NC1=C(C=CC=C1)C2=O)N""",21,"""900EDC69AE6D7356"""
-"""EA9313ADF49A5F06_EB0100BBB1906193_6039_DP""","""COC(=O)[C@H](COCC(NC(C)C1CC2CCC1C2)=O)N""",21,"""900EDC69AE6D7356"""
-"""ED1798695F437A78_DACDA2C7C58E324A_6039_DP""","""COC(=O)[C@H](COCC1=CC=C(C=C1)C2CCCCC2)N""",21,"""900EDC69AE6D7356"""
-"""72E84E5D9556D08A_53D4E6CC71C9419D_6039_DP""","""COC(=O)[C@H](COCC1=NC(=NO1)C2=CC=CC(=C2)C)N""",21,"""900EDC69AE6D7356"""
-"""A3EC0BEC5BB39402_D5E19FCEEB722FE7_6039_DP""","""COC(=O)[C@H](COCC(NC1=CC=CC(=C1)C(C)C)=O)N""",21,"""900EDC69AE6D7356"""
-"""2FD04B4E075AC8BF_FE4E8122FC5A95B5_6039_DP""","""COC(=O)[C@H](COCCC(NC1=CC=CC(=C1)OC)=O)N""",21,"""900EDC69AE6D7356"""
-"""242BD16B2D51CDEF_6027E24786E196D4_6039_DP""","""COC(=O)[C@H](COCC1=NOC(=N1)C2=CC=C(F)C=C2)N""",21,"""900EDC69AE6D7356"""
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-"""A059E8BDA532B701_D0E0930E75A97D45_6039_DP""","""COC(=O)[C@H](COCC(NC1=NC(=CC(=O)N1)OC)=O)N""",21,"""900EDC69AE6D7356"""
-"""4326F6DB01F2E174_F4A569E1C420546B_6039_DP""","""COC(=O)[C@H](COCC(=O)NCCCC1CCCCC1)N""",21,"""900EDC69AE6D7356"""
-"""854002D4CC743203_9D5E6F7D8BC8EF20_6039_DP""","""COC(=O)[C@H](COCC(NCCCN(C)[S](=O)(=O)C)=O)N""",21,"""900EDC69AE6D7356"""
-"""F01E99AF75168649_C46A5F0A8440C604_6039_DP""","""COC(=O)[C@H](COCC1=C(C=C(C(C)C)C=C1)C(C)C)N""",21,"""900EDC69AE6D7356"""
-"""2EDF288BDB8D043A_64E21428FDA31560_6039_DP""","""COC(=O)[C@H](COCC2=NC=C(C1=CC=CC(=C1)F)O2)N""",21,"""900EDC69AE6D7356"""
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-"""E77D0635B12FE406_9ACDB0B4C0B6E00B_6039_DP""","""COC(=O)[C@H](COCC2=N[N]1CCCC1=C2C(OC)=O)N""",21,"""900EDC69AE6D7356"""
-"""87D5A6B8355E4006_E3AEA3A88C6FF13B_6039_DP""","""COC(=O)[C@H](COCCC1(C(OCC)=O)CCCC1=O)N""",21,"""900EDC69AE6D7356"""
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-"""B6AE9A767AA7D7F9_C09C3D163F458DD9_6039_DP""","""COC(=O)[C@H](COCCCCCCOCCOCCC)N""",21,"""900EDC69AE6D7356"""
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-"""1C079170DBFC6AD8_88F779E0C48372B9_6039_DP""","""COC(=O)[C@H](COCC1=CN=C(N=C1)C2=CN=CN=C2)N""",21,"""900EDC69AE6D7356"""
-"""FAD2369655950599_23D8D4DC17BB11B7_6039_DP""","""COC(=O)[C@H](COCC1=CC(=C(C=C1)C#N)C(OC)=O)N""",21,"""900EDC69AE6D7356"""
-"""0E176C4CEDEDB094_94AE66B97F269C84_6039_DP""","""COC(=O)[C@H](COCC(=O)N(C1CC1)C2=CCCCC2)N""",21,"""900EDC69AE6D7356"""
-"""818088FE98545E81_5D26BDE198D99729_6039_DP""","""COC(=O)[C@H](COCC2CCC1(CCCCCCC1)O2)N""",21,"""900EDC69AE6D7356"""
-"""585AA76C29E0D089_440E14A75F6A4A8D_6039_DP""","""COC(=O)[C@H](COCC1=N[N](C=C1)CC2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""378AF663521B617D_9F3CB05BD21DAEE6_6039_DP""","""COC(=O)[C@H](COCC1=COC(=N1)CC2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""4F02A0AD2EC58665_969C7B5A9475C2B6_6039_DP""","""COC(=O)[C@H](COCC1=CC=CC(=C1)OCC(OC)=O)N""",21,"""900EDC69AE6D7356"""
-"""E375248CD11E674B_7F0882182A76C09A_6039_DP""","""COC(=O)[C@H](COCC1=CC=CC(=C1)[S](CCC)(=N)=O)N""",21,"""900EDC69AE6D7356"""
-"""01EE22B3B68621B1_C646F5353438FE59_6039_DP""","""COC(=O)[C@H](COCC1=C(C(OCC)=O)C=NC(=N1)C)N""",21,"""900EDC69AE6D7356"""
-"""1BC1D3090930CC14_B850B169AA727706_6039_DP""","""COC(=O)[C@H](COCC1=N[NH]C(=C1C)C2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""5B4C8B3DD96E845F_0ED88761722B5EB9_6039_DP""","""COC(=O)[C@H](COCC(C1=C(C)[N](C(=C1)C)CC#C)=O)N""",21,"""900EDC69AE6D7356"""
-"""B656377DF39AE8DE_EA00B8DF660FC2F6_6039_DP""","""COC(=O)[C@H](COCC1(O)CSC(=N1)C2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""20114D4F37B15047_5DFE70F27169FD2B_6039_DP""","""COC(=O)[C@H](COCC1=CC=C(CCC(OC)=O)C=C1)N""",21,"""900EDC69AE6D7356"""
-"""0AA5C4A40DB11A81_000039F128DCE551_6039_DP""","""COC(=O)[C@H](COCC(N(C(C)C)C1=CC=CC=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""AF990EC579F925A4_161311A2FB38E05A_6039_DP""","""COC(=O)[C@H](COCCOCCO[Si](C(C)(C)C)(C)C)N""",21,"""900EDC69AE6D7356"""
-"""3FD0F471F3012975_438DBB8C71FE8B4F_6039_DP""","""COC(=O)[C@H](COCC1=C(C=CC(=C1)OC)[S](=O)(=O)N)N""",21,"""900EDC69AE6D7356"""
-"""3D43BB0CF3147EA7_CE1E37F2A010BC86_6039_DP""","""COC(=O)[C@H](COCC2=N[N](C1=CC=C(C)C=C1)C=C2)N""",21,"""900EDC69AE6D7356"""
-"""C546CFDB7F3760A8_12EF8059EF9FE740_6039_DP""","""COC(=O)[C@H](COCC1=C(C=CC(=C1)OC)[S](=O)(=O)F)N""",21,"""900EDC69AE6D7356"""
-"""F963BEA66E0440EB_A14BB9C0B1FD2B05_6039_DP""","""COC(=O)[C@H](COCC1=C(C)N=C(S1)C2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""FA3751F395A98F5C_A158E39F5A669E32_6039_DP""","""COC(=O)[C@H](COCC1=C(C=CC(=C1)OC)[S](=O)(=O)Cl)N""",21,"""900EDC69AE6D7356"""
-"""D4C72128A1B58DD0_8CD7AAB2C93DC585_6039_DP""","""COC(=O)[C@H](COCC1=C(F)C=C(C=C1F)C(F)(F)F)N""",21,"""900EDC69AE6D7356"""
-"""1BD4658B82C5F3CF_C08EEBA20A669BD4_6039_DP""","""COC(=O)[C@H](COCC1=CC=CC(=C1[N](=O)=O)C(O)=O)N""",21,"""900EDC69AE6D7356"""
-"""C4C3A8B5944616D8_FCAE082B1C930C77_6039_DP""","""COC(=O)[C@H](COCC1=NC2=C([N]1CC)C=CC(=C2)F)N""",21,"""900EDC69AE6D7356"""
-"""E26190DEAE90E284_F8B99A67093C3AD8_6039_DP""","""COC(=O)[C@H](COCC1=NOC(=N1)C2=CC=CC(=C2)F)N""",21,"""900EDC69AE6D7356"""
-"""D65C2FD8A2C48435_66B19C006F30689F_6039_DP""","""COC(=O)[C@H](COCC1=NOC(=N1)C2=C(F)C=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""81A3C3787B46D6D3_C721A982B1FF1480_6039_DP""","""COC(=O)[C@H](COCC([C@@H]1CC[C@H](C(F)(F)F)CC1)=O)N""",21,"""900EDC69AE6D7356"""
-"""CFCF0C46E0430C5B_2B2306022E3292E5_6039_DP""","""COC(=O)[C@H](COCCOC1=CC=C(C(F)(F)F)C=C1)N""",21,"""900EDC69AE6D7356"""
-"""E03C562F31028175_C4BCD5060DDE7B43_6039_DP""","""COC(=O)[C@H](COCC(C1=CC=C(C(F)(F)F)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""778924ECBBD6781B_A2E88633F41B6A91_6039_DP""","""COC(=O)[C@H](COCC1=NC(=CC(=N1)C(OCC)=O)C)N""",21,"""900EDC69AE6D7356"""
-"""FDA2D6F4A9DFCF06_2F87C9BC23E9E2D5_6039_DP""","""COC(=O)[C@H](COCC1=CC(=NO1)C2=CC=C(C)C=C2)N""",21,"""900EDC69AE6D7356"""
-"""C912F17067C2230B_0DD4849292CD434B_6039_DP""","""COC(=O)[C@H](COCC1=CSC(=N1)CC2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""D14812A3981A500C_66D6F2C50DFBF4C2_6039_DP""","""COC(=O)[C@H](COCCCC1=CC2=C(C=C1)C=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""C59D17A07D0AA8D8_F53AF5E9126D59E0_6039_DP""","""COC(=O)[C@H](COCC2=NC1=C(C=CC=C1)C(N2C)=O)N""",21,"""900EDC69AE6D7356"""
-"""BB80030E1AD97944_364D86224E36E417_6039_DP""","""COC(=O)[C@H](COCC(NCC1=CC(=C(C)C=C1)F)=O)N""",21,"""900EDC69AE6D7356"""
-"""F0D424E7CDE7280C_F1524A7C61945981_6039_DP""","""COC(=O)[C@H](COCCC(NC(C)C1=CC=CC=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""8984D4289C8C58AD_F4014865A969D693_6039_DP""","""COC(=O)[C@H](COCCC(NC1=CC(=C(F)C=C1)F)=O)N""",21,"""900EDC69AE6D7356"""
-"""0378FDEDE9E9C20F_9510BFBCCEEFAA54_6039_DP""","""COC(=O)[C@H](COCC(NC1=NN=C(CCCC)S1)=O)N""",21,"""900EDC69AE6D7356"""
-"""CF5F4125D972EAC6_C9CC4164D59589D6_6039_DP""","""COC(=O)[C@H](COCC(=O)NCC#CC1=CC=CC=C1)N""",21,"""900EDC69AE6D7356"""
-"""2DA22EFE9589BEE3_068308A0268E270F_6039_DP""","""COC(=O)[C@H](COCC1=NOC(=N1)C2=CN=CC(=C2)C)N""",21,"""900EDC69AE6D7356"""
-"""D837EC81512E77FC_104B60F9F30DBE5B_6039_DP""","""COC(=O)[C@H](COCC(C1=C(OC(F)F)C=CC=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""91E82B30245CD222_9E645C8F41E5A409_6039_DP""","""COC(=O)[C@H](COCC1=C(OCC(F)(F)F)C=CC=C1)N""",21,"""900EDC69AE6D7356"""
-"""566E846C1FDA2A0C_A2A2ABA29BED7D62_6039_DP""","""COC(=O)[C@H](COCC(N1CCC(C(OC)=O)CC1)=O)N""",21,"""900EDC69AE6D7356"""
-"""1963D7C6CC226CFE_314D44F6EEE7ECE8_6039_DP""","""COC(=O)[C@H](COCC1=C(OC(F)F)C=C(C=C1)C#N)N""",21,"""900EDC69AE6D7356"""
-"""8C6323ADEFB368D3_5DC35266919BABD3_6039_DP""","""COC(=O)[C@H](COCC1=CN=C[N]1CC2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""827C0C0339A4306C_334D34A9B805ACD4_6039_DP""","""COC(=O)[C@H](COCC1=N[N](C(=C1)C)C2=CC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""685DC91DCDF33D9D_984FC5D46EF51CA4_6039_DP""","""COC(=O)[C@H](COCC1=CSC(=N1)C2=CC=C(C)C=C2)N""",21,"""900EDC69AE6D7356"""
-"""1991F0EEF0327819_FA01190EE7EC192B_6039_DP""","""COC(=O)[C@H](COCC(C1=CN=C(C(F)(F)F)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""6D6CC736C60289BF_CA8980A8BB5FDDCB_6039_DP""","""COC(=O)[C@H](COCCOC1=CC=C([S](C)(=O)=O)C=C1)N""",21,"""900EDC69AE6D7356"""
-"""3006680B322C87C5_8F37540A630CD7BB_6039_DP""","""COC(=O)[C@H](COCC1=C(C(F)(F)F)C=C(C=C1)C#N)N""",21,"""900EDC69AE6D7356"""
-"""8DD0E5D2830E53E1_3D3EEA5ED9AC6C1E_6039_DP""","""COC(=O)[C@H](COCC(N=C1C=CNN1CCCC)=O)N""",21,"""900EDC69AE6D7356"""
-"""F6C8D0F275FFDD00_1BE5A4F41EDEAFCD_6039_DP""","""COC(=O)[C@H](COCC(NCC1=CC(=CC(=C1)F)F)=O)N""",21,"""900EDC69AE6D7356"""
-"""44295F48CCE4F5CD_0CDBF904CCE96195_6039_DP""","""COC(=O)[C@H](COCC(N(C(C)C1=CC=CC=C1)C)=O)N""",21,"""900EDC69AE6D7356"""
-"""7152FB294A0166E5_F1B1B8BFD677247F_6039_DP""","""COC(=O)[C@H](COCCOC1=C(C(F)(F)F)C=CC=C1)N""",21,"""900EDC69AE6D7356"""
-"""82E6F7D8FD50E0B5_642A706007E1D255_6039_DP""","""COC(=O)[C@H](COCC(C1=CC=CC(=C1)[S](C)(=O)=O)=O)N""",21,"""900EDC69AE6D7356"""
-"""18FB7A2E186F273F_E8BE0C35EEC5F129_6039_DP""","""COC(=O)[C@H](COCC1=CSC(=N1)CC2=NC=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""4BAD34CD3861CFA9_5E99FB0920926F93_6039_DP""","""COC(=O)[C@H](COCC1=CC=C([S](C(C)C)(=O)=O)C=C1)N""",21,"""900EDC69AE6D7356"""
-"""AE98C879774513CF_8CAF1CAF26DC905A_6039_DP""","""COC(=O)[C@H](COCC(C1=CN=C(OC(F)F)C=C1)=O)N""",21,"""900EDC69AE6D7356"""
-"""943B2588DADA8AA1_2D79AC05E27E0988_6039_DP""","""COC(=O)[C@H](COCC(=O)C1CCOC2=C1C=CC=C2)N""",21,"""900EDC69AE6D7356"""
-"""BCCDC4B9FA427D20_DA459915B8C4111A_6039_DP""","""COC(=O)[C@H](COCC(N[C@H](C)C1=CC=C(C=C1)F)=O)N""",21,"""900EDC69AE6D7356"""
-"""F35EE42B87A1F2DB_3C4D8DFBAB71049D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC(C2=CC=C[N]2C)=O)=O""",21,"""6C777426576F7DEC"""
-"""1B05787466AE08E2_0C60F88B3532000F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC(=C(OC)C=C2)F)=O""",21,"""6C777426576F7DEC"""
-"""6D301C7DB34DF7F3_8C96049C603E35DE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N2CCCC(C(N)=O)C2)=O""",21,"""6C777426576F7DEC"""
-"""B8B4143228B4918D_AF97B411E03A13D0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2CN=C(O2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""4FBF9BFCF3B4BDBD_AC9388B3FCC808D8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCCCCCCCCCC""",21,"""6C777426576F7DEC"""
-"""9F9931031A833ED1_2B19B6F1D69F5EF3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N2CCC(C(N)=O)CC2)=O""",21,"""6C777426576F7DEC"""
-"""38D9EAF30108B403_C22C10FE1223B6A5_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCC3=NC2=C(C=CC=C2)O3""",21,"""6C777426576F7DEC"""
-"""BB2DCEDD19DB7CF3_C11078FD5BDF121E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC(=C(C)C=C2C)C)=O""",21,"""6C777426576F7DEC"""
-"""21C83251BB3E0CAC_EF6A118646032215_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C(C=C(C)C=C2)F)=O""",21,"""6C777426576F7DEC"""
-"""AF42A5676834CF14_3088FF58B3983DB1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC=C(OCC)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""855C38C64B3FF542_F526A1EB0EDB6ABF_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC2=CC=C(OCC)C=C2""",21,"""6C777426576F7DEC"""
-"""F1D1E550D5B6A497_CE41CA0959F7E467_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC(=O)NC2CCCC2""",21,"""6C777426576F7DEC"""
-"""A74B4190F1099808_ADE82AD623088357_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC(CCCC(C)C)C)=O""",21,"""6C777426576F7DEC"""
-"""AF35370A958D683B_CA7D1E268A3A67D1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCN[S](=O)(=O)C2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""7A9059229D0854A1_AA37BB709B3BB499_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=C(C=C(C)C=C2C)C)=O""",21,"""6C777426576F7DEC"""
-"""D7C9A82B938D24CF_AFF29FE85BADB47C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=COC(=N2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""3E2EC9D2A1FF17D5_7E2381A014640902_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC(=NO2)C(C)C)=O""",21,"""6C777426576F7DEC"""
-"""8006BA887A7031C9_EFD4AD9E1E3880AD_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)N(CC)C(=O)C""",21,"""6C777426576F7DEC"""
-"""3C0A4FE726B4B2AC_E2D04EB0C77DCFC2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC34CC2CC(CC(C2)C3)C4""",21,"""6C777426576F7DEC"""
-"""0A91AF6C4C38A1E3_7ECA3E2A371A692B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC=C(O2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""B868317226D180C8_C83D90B1B7C2738D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(OC)C=CC(=C2)[N](=O)=O""",21,"""6C777426576F7DEC"""
-"""9BD1D3BAE8B072E1_1816C6F87B17DE64_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=NO2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""59DF4C6105A5ED7F_FCA849747D8B2BCB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=C(OC)C=C(C=C2)C)=O""",21,"""6C777426576F7DEC"""
-"""D1E426E3F8108A65_A0D2198FA32C7F3B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NOC(=N2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""AFA2C8EBB255052E_384EC19EC7D01F94_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N[C@@H](CC(C)C)C(=O)O)=O""",21,"""6C777426576F7DEC"""
-"""A4EBCDFEF7CD0E12_F819079FF9999FC9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(NC2=CC=C(F)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""DFA5B9B74AB733FD_7A714838C389E33E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC(=C2C=CC=CC2=N3)C""",21,"""6C777426576F7DEC"""
-"""CA3C227BBE83CA83_8E2575C8BE349CFA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""A16FF05282E52CCA_5DCBA6464CB559A4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC=C(CC(N)=O)S2)=O""",21,"""6C777426576F7DEC"""
-"""137FD0785E72E074_93DD4B90836658D9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NNC(=O)C2=CC=CS2""",21,"""6C777426576F7DEC"""
-"""9E62681C1C0B33CA_2C075555B18EC1B4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(NC2=CC=CC(=C2)F)=O""",21,"""6C777426576F7DEC"""
-"""7ED6A23499D144E3_1E7F7B068433DA9F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NCC(=O)N2CCCC2""",21,"""6C777426576F7DEC"""
-"""111211B03F0E822B_6FCEAE3510C5D377_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=CC(=C(C=C2[NH]3)F)F""",21,"""6C777426576F7DEC"""
-"""E24FD381EB42A44A_C79381CE776114BD_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=C(OC)C=CC(=C2)F)=O""",21,"""6C777426576F7DEC"""
-"""484B8283D54D28E1_21757FD68D48B2C6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCOC2=CC=C(OC)C=C2""",21,"""6C777426576F7DEC"""
-"""A633E36A64A15630_0823731647A6CCFB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(CCCC)CCCC)=O""",21,"""6C777426576F7DEC"""
-"""4A0B2C394A0C8B75_58ADA58B15A4D399_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C2CCC(C)CC2)C)=O""",21,"""6C777426576F7DEC"""
-"""5E5AE14AA1533114_07C4EB8AD5ADCB49_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC(NC(COC)C)=O)=O""",21,"""6C777426576F7DEC"""
-"""7FC7EAD43ECC3D2F_93022CD08E550F1C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC=N[N]2C(C)C)=O""",21,"""6C777426576F7DEC"""
-"""899FB37117E4542D_2F961D38C1FAD74F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NOC(=C2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""756D82954176B5A1_86F6D00DCB2F1A6B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C)CC2=CC=C(C)O2)=O""",21,"""6C777426576F7DEC"""
-"""98394FD6394087C1_C272D42BCE757A6F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC(=NO2)C3=CN=CC=C3""",21,"""6C777426576F7DEC"""
-"""6C3A28662202619B_65CAC79DBF143219_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCN2C(NC(C)(C)C2=O)=O""",21,"""6C777426576F7DEC"""
-"""209EF4861784B970_AD98CCAC28E5A898_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC2=CC=CC(=C2)[N](=O)=O""",21,"""6C777426576F7DEC"""
-"""F1D2CBE2C5E4E2EC_0E91ED11B4315DAC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC2=C(OCC)C=CC=C2""",21,"""6C777426576F7DEC"""
-"""F97322CCF923974D_80B095F77CD3F2E2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOCCOC2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""3BD868DB688FF0F2_82CB52E8AAB54EB9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=CC3=C2N=CC=C3)F""",21,"""6C777426576F7DEC"""
-"""43566C9C5350186D_369C0B69D5209C48_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NOCC2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""5FEB6DD8C2EA0A03_7C7EC716055323F6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C[N](N=C2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""0A8A7F5EA6D3B9BA_FC0897C6042512E2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC(NCC(F)(F)F)=O)=O""",21,"""6C777426576F7DEC"""
-"""620F7CA25FF53B1E_18CB483D361A96E6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=C([N](CC)C(=C2)C)C)=O""",21,"""6C777426576F7DEC"""
-"""5D6D55E662AE76C1_15073DD7708782D0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCC2=C(F)C=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""7C9C99677C48CAFF_C1BC1F5C01308EEA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=C(C)N=C2C=CC=CC2=N3""",21,"""6C777426576F7DEC"""
-"""3D1716A83FA62375_B244EC58BA630E26_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CN=C(S2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""E0824E55FCD9B734_D256F7C33C4D7E4B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C)C2CC[S](=O)(=O)C2)=O""",21,"""6C777426576F7DEC"""
-"""6049D262DDBC04BE_52683154AC9C5BA1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC=C(C(C)C)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""6D69F07CE5526EF4_E71B20BFDA75E185_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C(C#N)C2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""1C7FD6EC67D170BD_D7B8712F0875E55A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC2=CC=C([N](=O)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""DCCD4ADD326DB65B_FECD3BB62B6BB149_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC(=CC(=C2)F)F)=O""",21,"""6C777426576F7DEC"""
-"""E36FEF6D188F9FC2_07053E94C54F83FA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=CC3=C(C=C2)OCC3""",21,"""6C777426576F7DEC"""
-"""BC0CB5577ED3A834_8D73FC5529D0C83A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCOCCC2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""9110232B221065E9_45FF76A9E1889452_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=C[N](C)C(=C2)C(=O)N)=O""",21,"""6C777426576F7DEC"""
-"""29A71751BADC3A8D_C98234992EC47217_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC2=NN=C(O2)C3CC3""",21,"""6C777426576F7DEC"""
-"""83F5268577F3B8B9_6671AFA9976348DC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)C3CCCCC3""",21,"""6C777426576F7DEC"""
-"""629DE9E131B47F62_DA4C3A0C69C016B1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)C3=CC=C(C)O3""",21,"""6C777426576F7DEC"""
-"""C2D8293D706FFF13_EE9CCD0CA42219AA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)CC(N(C)C)=O""",21,"""6C777426576F7DEC"""
-"""36665D11A9CE79AC_B32EEC5A9430AB59_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCC2=CC=CC(=C2)F)=O""",21,"""6C777426576F7DEC"""
-"""B5951AB62221354A_2E6062042274FD5E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C)CC2CCCCC2)=O""",21,"""6C777426576F7DEC"""
-"""E167006485311C36_0502B3D861A849C3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NCCC2CCCCC2""",21,"""6C777426576F7DEC"""
-"""993683912D3AB7B3_A2F619A33C9EBA4D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCC2=CC=C(CC)S2)=O""",21,"""6C777426576F7DEC"""
-"""AD6596903F7F37BF_FD73569D96552BDD_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC3=NC2=C(CCC2)S3""",21,"""6C777426576F7DEC"""
-"""33DE1123D61A33C7_830119A3A7C8362E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)N(C2CC2)C3CCCC3""",21,"""6C777426576F7DEC"""
-"""72454F80A3ADDC73_C34DA47275835314_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC=N[N]2CCC)=O""",21,"""6C777426576F7DEC"""
-"""37634A0BDFC42883_77BDA6B51DB7ED4F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NCC2CC[S](=O)(=O)C2""",21,"""6C777426576F7DEC"""
-"""EA5942C15DB6DE98_DF761E32553AD6A5_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=CC(=C2)C(N(C)C)=O""",21,"""6C777426576F7DEC"""
-"""75888E2C6EAA3DCE_692252DDA6315C52_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(C=N[N]2C)C(N3)=O""",21,"""6C777426576F7DEC"""
-"""36258620CB2F1F98_FB0B8A3DC57214AD_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=NC(=C(S2)C)CC)=O""",21,"""6C777426576F7DEC"""
-"""25165A6E393F72F2_DB4FE7350D7BAAB9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C([S](N(C)C)(=O)=O)O2""",21,"""6C777426576F7DEC"""
-"""1C786AD0939A2170_B79B481AAA9350D0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=N[N](C=C2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""D54EDE384BDBC123_B58181C2A072AB9E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=CC=C([S](N)(=O)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""BAB1B38C35764335_A10AB35160EFF382_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCCOCCC(C)C)=O""",21,"""6C777426576F7DEC"""
-"""EE8ABC80BE32419C_0CF15E8E0056E7D4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=CC3=C(C=C2)CCC3""",21,"""6C777426576F7DEC"""
-"""00DB28D5FD4D1AAD_8ED29266530C4868_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC(=O)NC2=CN=CC=C2""",21,"""6C777426576F7DEC"""
-"""A3186536EEC5FB1F_7F47AC57B505D4CA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCN(CCCC)CCCC""",21,"""6C777426576F7DEC"""
-"""E21875C71541ADC8_4613C2BD2203A926_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCC2=C(ON=C2C)C)=O""",21,"""6C777426576F7DEC"""
-"""C79D4904BE1D11A7_296D8A6D680AAD18_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC(=CO2)C(OC)=O)=O""",21,"""6C777426576F7DEC"""
-"""713EACD3405EB803_CF02092CF16C3728_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NN=C(C2=C(C)C=CO2)O3""",21,"""6C777426576F7DEC"""
-"""3CB109BFBF985B7C_8DC6F6F4B6248B2E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CN=C(C=C2)[N]3C=NC=C3""",21,"""6C777426576F7DEC"""
-"""10FD0DD08F2BEFC6_B4EF97B2FDAD68A4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C[N](N=N2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""82E7CD5E45F92390_50696D471C43A729_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C)OC(=N2)C3=CSC=C3""",21,"""6C777426576F7DEC"""
-"""1C6CFC692E94F391_E34E41A8F8A12DFC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=CC3=C(C=C2)C=CC=C3""",21,"""6C777426576F7DEC"""
-"""245217B7BEA706CC_C69618BDEEF709F1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2SC(=NC2)N3CCOCC3""",21,"""6C777426576F7DEC"""
-"""27446D98645C8A70_D238493618D17C91_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=C(C)OC(=C2)C(=O)O)=O""",21,"""6C777426576F7DEC"""
-"""9A0535C25FE0EC1A_B33BB710E0ABD1A4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NCC(=O)C2=CC=CS2""",21,"""6C777426576F7DEC"""
-"""ECB08222C94F975C_C4A4C164839648CA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCOC2=CC=C(C=C2)C#N""",21,"""6C777426576F7DEC"""
-"""F76E91729C312003_F30DEC71A59AA6DE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCC2=CC=CC(=C2)C)=O""",21,"""6C777426576F7DEC"""
-"""07DB2B18870504AC_D47D2C1B88510D0B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NOC(=N2)CCC(OC)=O""",21,"""6C777426576F7DEC"""
-"""F46739F1B0CE6A4D_DE4B9B6F5F39B1CE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=NC3=C2C=CC=C3)C""",21,"""6C777426576F7DEC"""
-"""07B75AD278F72C6A_2892D40A25391595_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C(C(=C(C)S2)C)C)=O""",21,"""6C777426576F7DEC"""
-"""5412E7AABA181A1E_F39378929F983B69_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC(=C(C)C=C2F)F)=O""",21,"""6C777426576F7DEC"""
-"""A2326812B3D89115_9850E03B923C2B5C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)N2CCN(CC2)CC#C""",21,"""6C777426576F7DEC"""
-"""E7A97F9ABF0BBE51_255A9B659722E9CA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCN[S](C2=C[N](C)N=C2)(=O)=O""",21,"""6C777426576F7DEC"""
-"""1660E399FEA45630_805AC7A74C39F541_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC=CC2=CC=CC(=C2)OC""",21,"""6C777426576F7DEC"""
-"""4F15B223C7F29533_980108ACE98952A9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C=CC(=C2)OC)[N](=O)=O""",21,"""6C777426576F7DEC"""
-"""4EFB4AE99FBCED6F_C592A21E7108D2A4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOCC2=CC=C(OC)C=C2""",21,"""6C777426576F7DEC"""
-"""DC8559418AF630C1_8BF5398AD2DA04CB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C)OC(=N2)C3=CC=CO3""",21,"""6C777426576F7DEC"""
-"""860A9105A8FB7706_D7A32BE378BD16D3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC2=CC=C(C=C2)CC#N""",21,"""6C777426576F7DEC"""
-"""C0443AF14AC193E7_54FBD658316BE0ED_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC(=C(C(=C2)C)F)C)=O""",21,"""6C777426576F7DEC"""
-"""93C7B4150F02FBC5_C9597154E61DCD45_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NOC(=N2)C3=C(C)N=CS3""",21,"""6C777426576F7DEC"""
-"""730B352D8A5F7238_E4D7D2E6514A5E49_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=C(C(OC)=O)C=C2)F""",21,"""6C777426576F7DEC"""
-"""B808208075A05871_19589108F5EED5AA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCN2C3=C(CCC2)C=CC=C3""",21,"""6C777426576F7DEC"""
-"""3BDD17DAABD555A3_753993D3F8A7F314_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCOC2=CC(=CC=C2)C#N""",21,"""6C777426576F7DEC"""
-"""84CFE378EF425117_1ACAE1BD9367DBE2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=NN=C(C(C)C)S2)=O""",21,"""6C777426576F7DEC"""
-"""3AE5D264F4B1CE9D_4896CE8F3EEA1B7B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=CSC3=C2C=CC=C3""",21,"""6C777426576F7DEC"""
-"""1D86E4D149B4D052_8AD40EE40A94491D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=CC(=C2)[N](=O)=O)OC""",21,"""6C777426576F7DEC"""
-"""5B9466128D83DC40_163C4889DC012289_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=C[N](CC(OC)=O)N=N2""",21,"""6C777426576F7DEC"""
-"""4DA9CE22E327E7BF_497FDE2C15EA40FE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCC2=NN=C(C(F)(F)F)O2""",21,"""6C777426576F7DEC"""
-"""D42142B283C9504E_4801E0D7CD3EB51B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(N(C)C2=CC=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""2D13562584EB7C5D_0411D1CABB13891C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC2(CCCCC2)C#N""",21,"""6C777426576F7DEC"""
-"""8453FBFE821A9EC7_4633D37691599888_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC=C(SC)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""86BE78282CD00743_68585403DA3CA318_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=C(O2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""5E8A5C407CFB9322_4FC37931D1237FC0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC(=NO2)C3=NC=CC=C3""",21,"""6C777426576F7DEC"""
-"""87F14489995B8F2D_5D1596C1EC2C9442_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=C[NH]C3=C2C=CC=C3""",21,"""6C777426576F7DEC"""
-"""0CBE4950A0A2C5CF_19B62A32AE629AD2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(CC(OC)=O)C=CC=C2""",21,"""6C777426576F7DEC"""
-"""0F6ED2C640BDA106_0EBC2B701233ADF3_6039_DP""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=CC(=C2)C(F)(F)F)N""",21,"""6C777426576F7DEC"""
-"""26B7D8B414BA0720_4352B583D6A4A134_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=NC3=C([N]2C)C=CC=C3""",21,"""6C777426576F7DEC"""
-"""B00BD565BE4FC781_010A16BFE161CB7A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCN2C=C([N](=O)=O)C=CC2=O""",21,"""6C777426576F7DEC"""
-"""E1A0ADEAB372B539_B0FA836A6A20884C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N2CCCCC2C(N)=O)=O""",21,"""6C777426576F7DEC"""
-"""D15396301546E8B4_BA372A2F29BD1669_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=C(OC)C=C2)[N](=O)=O""",21,"""6C777426576F7DEC"""
-"""28B3ED0DC6A22F71_AFB3F0B4204AD3B6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NN2C(C=C(C)N=C2S3)=O""",21,"""6C777426576F7DEC"""
-"""AEE59336E16CB606_8562E6CACCCC30B7_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2CCN(CC)CC2)=O""",21,"""6C777426576F7DEC"""
-"""4925B61C36D071F7_BED9AC4F805330A9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C2CCCCC2C)C)=O""",21,"""6C777426576F7DEC"""
-"""475AEC9AFD6D144E_FEF4A94AD1522D04_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C(C)C2CC2)C3CC3)=O""",21,"""6C777426576F7DEC"""
-"""CFEEAFAD4912B208_099B1036B9A89B26_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=CC3=C2OCOC3)F""",21,"""6C777426576F7DEC"""
-"""FAD11A1085C1624F_81A9E27285EDEC3F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCOC2=CC(=CC(=C2)C)C""",21,"""6C777426576F7DEC"""
-"""B0689E0BD0574635_E2F1414A2C39FE1E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C(CC)C)C(C)CC)=O""",21,"""6C777426576F7DEC"""
-"""A8E9EF119B2E3097_D0E678F45AC97BB3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=CC=C(C=C2)[S](=O)(=O)Cl""",21,"""6C777426576F7DEC"""
-"""1F0FC46B6EBA8C18_89AED7753EA1A421_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)N3CCC2=C(C=CS2)C3""",21,"""6C777426576F7DEC"""
-"""E0513506491E8A66_8EAE7C4B2ED8D03A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=C[N]2C=CC=CC2=C3C#N""",21,"""6C777426576F7DEC"""
-"""DE852F7CD6BE85A8_A08A4974FA7830EC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(C=CC=C2)C(=O)O3""",21,"""6C777426576F7DEC"""
-"""6D7439716546EDA7_994912B58A98FD66_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C)OC(=N2)C3=CC=CS3""",21,"""6C777426576F7DEC"""
-"""3AA9374F51F0DFEF_4773E18AE687EEA8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=CC3=C(C=C2)COC3""",21,"""6C777426576F7DEC"""
-"""B7607074B104C9E9_9D26B7407EF21CAC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(CC(NCCC)=O)C)=O""",21,"""6C777426576F7DEC"""
-"""3A6C31F687ACD226_A674BEBEE497F611_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NOC(=N2)C3CCCCC3""",21,"""6C777426576F7DEC"""
-"""C04E82B83221BD30_E07B96FAA65A5590_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC2=CC(=CC=C2)C#C""",21,"""6C777426576F7DEC"""
-"""2047C3EDDCADBDAD_7BC2E9EB9736A410_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C=CC=C2)N3CCCC3""",21,"""6C777426576F7DEC"""
-"""B110BC8C0C58373F_BDAE46986E6F3E9B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C)C=CC3=C2C=CC=C3""",21,"""6C777426576F7DEC"""
-"""E71785837B697FA1_C05E2B1F5F09B51A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(CC)OC(=C2)C(=O)OC""",21,"""6C777426576F7DEC"""
-"""491A4A29AE4AEBF0_47A122FD15C63722_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C(OC)=O)C=C(C=C2)F""",21,"""6C777426576F7DEC"""
-"""74432F979A239BC5_6ACC82B71B45A490_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=N[N](C=N2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""015E8ABAB790D559_E43F56A975FB37A2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=C[NH]C3=C2C=CC=N3""",21,"""6C777426576F7DEC"""
-"""75BDF7DB284A4D9A_4F3732F60A5CAB03_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(N=C(OC)C=C2)[NH]3""",21,"""6C777426576F7DEC"""
-"""01F68E851D206B36_B20939894964441F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCN2C(=O)OC3=C2N=CC=C3""",21,"""6C777426576F7DEC"""
-"""9400F0D82D4373B0_2383EED9BE16744A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCC2=CC=C(F)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""6470E7DE1D2BDA8B_ED2F4C3AE459C426_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C(C=C(F)C=C2)F)=O""",21,"""6C777426576F7DEC"""
-"""FE0487C1C6EF3EC1_3181BF2E7FCECFF6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NCCC2=CCCCC2""",21,"""6C777426576F7DEC"""
-"""CB4EFA4A92042EEC_3D15363C30C23B84_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=COC(=C2)[S](N(C)C)(=O)=O""",21,"""6C777426576F7DEC"""
-"""38F5BD679DCAE852_F8CFC446A9B06885_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=CC=C2)[N]3N=CC=C3""",21,"""6C777426576F7DEC"""
-"""4D1990E7D6698474_1AF0950E2580E4FB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=CC3=C(C=C2)OCCO3""",21,"""6C777426576F7DEC"""
-"""075C9378C489CCD3_3CBEECB1B14ED1DA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C(C=C(C)C=C2)C)=O""",21,"""6C777426576F7DEC"""
-"""CDE96211F070E3E5_DEEC8E6CAEECC85C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC=C(OC)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""3D8EA157520AC33B_F10B6A6D2F18923A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC2CCCCCCC2""",21,"""6C777426576F7DEC"""
-"""4BCACC07E46AFC46_4CBD1AB7CFFA157B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCC2=CC=C(C)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""B35D663F163D6038_24AE76371804139B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N2CCN(C(C)=O)CC2)=O""",21,"""6C777426576F7DEC"""
-"""2E9ECD375258627F_0921D23DAAB6FF57_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C(C=CC(=C2)F)F)=O""",21,"""6C777426576F7DEC"""
-"""93FAC65CA3E8FFD2_F9CC34751ECA384E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC=CC(=C2C)C)=O""",21,"""6C777426576F7DEC"""
-"""543594706B1FD643_CFA58F4E7FAB76A6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC2=CC(=CC=C2)C#N""",21,"""6C777426576F7DEC"""
-"""1E1D9535CD90BBAA_768CAE7287F4F40D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C(C=CC(=C2)C)C)=O""",21,"""6C777426576F7DEC"""
-"""97D219D80F3FF8BC_935947C8FE0455FE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC(=CC(=C2)C)C)=O""",21,"""6C777426576F7DEC"""
-"""B9FDDA7DA362D4F5_CAEF3B2653FCE678_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC(=C(C)C=C2)C)=O""",21,"""6C777426576F7DEC"""
-"""8142558DF13D0513_9D2B0D0DE3A68F63_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCC(C2=CC=C(F)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""AE8CB58299DAF346_968E2F2DF737CE2E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC(=O)NC2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""E1BD8A4E8FAB8531_98609BDCF315707C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C=CC(=C2)C(OC)=O)F""",21,"""6C777426576F7DEC"""
-"""74C89E9059D8F650_6D8A5489CDF82D74_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C(CC)C=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""081DA57EB30B0121_BBC93810E90C95F6_6039_DP""","""O(C1=CC(=C(N=C1)Br)Br)CCOC2=C(C(O)=O)C=CC=C2""",21,"""6C777426576F7DEC"""
-"""5D1A26F743456C0D_0E32E93660167ED5_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NN=C(C2CC2)[N]3C4CC4""",21,"""6C777426576F7DEC"""
-"""2B2AF1F0DE271637_0B554CD01D45EB0F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=C(S2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""260D999E25C5CC6D_B472E1348D78F51F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=NC=C2)OCCOC""",21,"""6C777426576F7DEC"""
-"""62AEA77595B2C471_CD76E33C2054AB68_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=C(C(OC)=O)C=CC=C2""",21,"""6C777426576F7DEC"""
-"""F2E1607E79A0EFC1_B441934B56B23D23_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)N2CCC3=C2C=CC=C3""",21,"""6C777426576F7DEC"""
-"""E3334930022166C4_199E26A99050CD90_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2CCCC(C)C2C)=O""",21,"""6C777426576F7DEC"""
-"""ED2D94A73943D659_62E0CA133E72CFFC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C(C)(C)C#N)C=C2""",21,"""6C777426576F7DEC"""
-"""BB2B0B9935ACA4C0_9AC167CCDDA96568_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC(=C(F)C=C2)F)=O""",21,"""6C777426576F7DEC"""
-"""1CAE4039C733960C_2414F41A1B9EAABB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)N(CCC#N)CCC#N""",21,"""6C777426576F7DEC"""
-"""094213A7094097AE_CF6270B05CB03DB3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(CC2=CC=C(OC)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""703655B54E722667_889BE7BE791629B7_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC=C([N](=O)=O)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""9E8017DDA1689E12_E605E538560D89E2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC[S](=O)(=O)C2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""FE36DA8E11E9D6AD_D95C94CA22E2EDB5_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=NO2)C3=C[N](C)N=C3""",21,"""6C777426576F7DEC"""
-"""342860DB7491A805_E96EA53C599F7AEE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCN2CCN(C(C)C)CC2""",21,"""6C777426576F7DEC"""
-"""F37773F7EA329661_45EEE639D5377920_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C(C)C(=O)O)C=C2""",21,"""6C777426576F7DEC"""
-"""59A1C69F65D2293A_8228806D4C56082A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C(OCC)=O)C=NC=N2""",21,"""6C777426576F7DEC"""
-"""577C8E22E7DEC8FF_6DFB180464480765_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C=C2)C3=CC=CS3""",21,"""6C777426576F7DEC"""
-"""C7D9813FC5C44CAF_FC9FF13DD15D2DA8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C=C2)OCC3CC3""",21,"""6C777426576F7DEC"""
-"""26F2D6E4E7FC2BDA_A1B9DAA04BCE2566_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC=C[N]2C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""B258E461FD119E95_91C38E3C5FDD91A1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC(=CS2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""F6406D140B96259B_FA54C754CFD2B0A4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC(=CS2)C3CCCCC3""",21,"""6C777426576F7DEC"""
-"""9B3E315E355823C3_D3609D30F735945D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCC3=NC2=C(C=CC=C2)[NH]3""",21,"""6C777426576F7DEC"""
-"""72A9FAB0C4CFBD7F_EBB50BAFBE7ECF55_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCC2=N[N](C)C=C2C(=O)O""",21,"""6C777426576F7DEC"""
-"""A72A2245D52BEAE7_0ADF0053C353CB2F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=N[N]2C3CCOCC3""",21,"""6C777426576F7DEC"""
-"""4569C4C7B46AFEC9_876E93EC84F4F9B8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C)CC2=CC=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""7A88A7F6D63E7F77_4DAEC9CCEC42F947_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC[S](=O)(=O)CC2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""88C7DF0D15B95457_5EF74EE199FF29C6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2(CC2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""90394C26DD82FC6D_2FCC7D9DAFE093A8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC(=N[NH]2)C3=NC=NC=C3""",21,"""6C777426576F7DEC"""
-"""0548CB6FDE080F3C_8B35147399EFE8A2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCB2OC(C)(C)C(O2)(C)C""",21,"""6C777426576F7DEC"""
-"""3C958991CA0F71EA_E1ADFD7E29FDC9DC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC=C(CCC)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""99BD8865646C0A50_5919A2B8239301F4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C(CC)(C)C)C=C2""",21,"""6C777426576F7DEC"""
-"""0C2E4FA04D6CBE27_B80D5D3DF05F27F0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=CC2=C(OC(F)(F)O2)C=C3""",21,"""6C777426576F7DEC"""
-"""E8404BEB93157A7E_9B9D4E1DB696709A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C(CC)(CC)C(=O)OC)=O""",21,"""6C777426576F7DEC"""
-"""264F265C09E0923E_A302596E51A0CC18_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=CC(=C2)OCC(C)C""",21,"""6C777426576F7DEC"""
-"""B0C0D259B39D259B_E464D6C7885210F1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(C2=CC=C(OC)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""16EB5A8AC9BCD789_97FD9A76A64D0E6D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N[C@H](C(OC)=O)C(C)C)=O""",21,"""6C777426576F7DEC"""
-"""6DDC1D433D9CDA59_BB3FDCF3620D82A2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CN=N[N]2C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""D8D7699EE0532222_D64FEBF0C7CC841A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=N[NH]C(=C2C(OCC)=O)C""",21,"""6C777426576F7DEC"""
-"""B0B0713FBFD5401D_35BFDD8E47C43FD5_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NOC(=C2C(OCC)=O)C""",21,"""6C777426576F7DEC"""
-"""5BE4B01BED74CC78_807C5E91A2354076_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C=CC(=C2)C)OC(F)F""",21,"""6C777426576F7DEC"""
-"""D6464DE3E5444175_4956DA26537768A2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(OC(C)C)C2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""D37AA6E4B99461CF_BF151EC20ED163C1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(CC)N=C(C=C2)C(C)C""",21,"""6C777426576F7DEC"""
-"""21BC7136226C8DBC_5820D8661F2CF996_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NCCC2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""D26B8141CA969B42_9D6C2336A756AB1B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C(OC)C=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""7670C14BF8A7BB8A_05043A73C7E1DD11_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C([S](CC)(=O)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""2B8129C9F92721E3_8BF8B8E8A7DA1470_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC2=CC=C(C=C2)C#N""",21,"""6C777426576F7DEC"""
-"""47A4DEE40E9392FC_8A654DA47A075F37_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C([N](=O)=O)C=CC=C2C#N""",21,"""6C777426576F7DEC"""
-"""26C1157D9C287C74_DF0BBD09E58B6AD3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=N[N]2C3CCCCC3""",21,"""6C777426576F7DEC"""
-"""3C050FEC95DE47A1_2554C5C684FE64BE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCN3N=C2C=CC=CN2C3=O""",21,"""6C777426576F7DEC"""
-"""FBC9C60451E3EE8F_545361B83986A051_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=CC2=C([N](N=C2C)C)N=C3""",21,"""6C777426576F7DEC"""
-"""13AED99BC187BCD8_0C33D10FA328C37A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=C2N=CC=CC2=C(F)C=C3""",21,"""6C777426576F7DEC"""
-"""04A114906F41B40D_9A23DE8B8F5D590A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCOC2=C(C)C=CC=C2C""",21,"""6C777426576F7DEC"""
-"""CB0B456025565837_0AFC146A418A1BA9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=C(OCC)C=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""121EE148EFF606C3_EE0CDBBCBE0A266F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCOC2=CC(=C(C)C=C2)C""",21,"""6C777426576F7DEC"""
-"""34E0570534F200A3_BFD3BD310C921A57_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C)CC2=C[N](N=C2)C)=O""",21,"""6C777426576F7DEC"""
-"""E39B1233EBCB8173_76153288E6B1EF9E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C(C)C)CC(F)(F)F)=O""",21,"""6C777426576F7DEC"""
-"""5ACD63669D53CA47_50C060AC5080C0C9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC(CCCCCC)C)=O""",21,"""6C777426576F7DEC"""
-"""51B7BA91934324AD_691F1A75AEE38FC3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CN=C(C(OCC)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""E0DB6C1A1BBE313E_ECF139DB8B5F50B0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C(C)(C)C2=CC=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""2ED3109FDAEB0606_D2216AED36B59B00_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(OC)C=C(C=C2)[N](=O)=O""",21,"""6C777426576F7DEC"""
-"""3548535F38A206C2_58CC735A8D04CA08_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C=C2)N3CCCC3""",21,"""6C777426576F7DEC"""
-"""6236BA11DFFEF06C_CAF9C3C565728C68_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC=C(C(OC)=O)O2)=O""",21,"""6C777426576F7DEC"""
-"""ECA3BC8C5BF20921_E92A045D37B139CE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C(C2=NC(=CS2)C)C#N)=O""",21,"""6C777426576F7DEC"""
-"""23151C1626B13952_CC30CFBBC558D563_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC3=C(C=C2)OC(C)(C)C3""",21,"""6C777426576F7DEC"""
-"""79ECED03BF8B0EDE_B5036F5456CF46E4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC2=NC(=NO2)C3CC3""",21,"""6C777426576F7DEC"""
-"""6005588DA805DA39_0B048BBE385637DA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(NC2=C(F)C=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""62FDA9D1559CAC5C_8D35B11E8097E46C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C=C2)[N]3C=CC=N3""",21,"""6C777426576F7DEC"""
-"""EF606E9FCB0A0E89_8A39136067F678E1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC(=NO2)C3=NC=NC=C3""",21,"""6C777426576F7DEC"""
-"""436CD7DB730507FE_D449A9A78F1438DD_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)C3=NC=CC=N3""",21,"""6C777426576F7DEC"""
-"""0C7B865C47419BB4_74E9BE3C02278C0E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C(C)C)C2CCCC2)=O""",21,"""6C777426576F7DEC"""
-"""9881A8247127B2B3_D98904EB79276F82_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCC(NC(C)(C)C)=O)=O""",21,"""6C777426576F7DEC"""
-"""F7A6BF36389B2619_EB0454F1DDB12B61_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCCCCCCCC(O)=O""",21,"""6C777426576F7DEC"""
-"""C0576E799155D38B_D119A6E22CB7B1A8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(C2=C(C=C(F)C=C2)F)=O""",21,"""6C777426576F7DEC"""
-"""F24E8E6AFEA0BC1A_C208D4F607D5E4EB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C(=C(F)C(=C2F)F)F)F""",21,"""6C777426576F7DEC"""
-"""C23A9C86BE8FF09C_A30BE38B3166BC1D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC=C(C(OCC)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""42642FAD6D9D4D85_3057228D994E4742_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC(=C(C=C2F)F)C)=O""",21,"""6C777426576F7DEC"""
-"""73C759DB7D025434_ADBA62AA03825005_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C(OC)=O)C=CN=C2F""",21,"""6C777426576F7DEC"""
-"""A22CD2316D150B5D_0F995698B9CABD79_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C=C(C(OC)=O)C=C2)F""",21,"""6C777426576F7DEC"""
-"""C57D1ABF658928A1_86ECD2C77B158F53_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(C=CC=C2)NC3=O""",21,"""6C777426576F7DEC"""
-"""18D6222CE2247367_0C4619590913DF1B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC2=C([N](=O)=O)C=CC=C2""",21,"""6C777426576F7DEC"""
-"""076D1D64BB1A72F5_51FF22888DC9C934_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NOC(=N2)C3CCOCC3""",21,"""6C777426576F7DEC"""
-"""310DC46D8A7AB004_73A44D6A2B166212_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC(=CS2)C3=CN=CC=C3""",21,"""6C777426576F7DEC"""
-"""EF8C1C05EF51D93C_54D4876BBF6C2555_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)CC2=CC=C(C=C2)C#N""",21,"""6C777426576F7DEC"""
-"""62DF3B236B81C629_90F3015A9F3B029D_6039_DP""","""O(C1=CC(=C(N=C1)Br)Br)CC(N[C@@H]([C@H](CC)C)C(=O)O)=O""",21,"""6C777426576F7DEC"""
-"""1AAD542EA326DF86_56C2075FF20B5D50_6039_DP""","""O(C1=CC(=C(N=C1)Br)Br)CC(N[C@H](CC(C)C)C(=O)O)=O""",21,"""6C777426576F7DEC"""
-"""113204FA565710D0_C245C3EB98C94776_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=CC2=C(C=CC(=C2)C)N=C3""",21,"""6C777426576F7DEC"""
-"""57C2FA194F2B515B_CE3B9F2A444BEEB2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C(F)C=CC=C2F)=O""",21,"""6C777426576F7DEC"""
-"""1C152046EF46782E_A3CD0B2D4EFEFB92_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=CC(=C2)OC(F)(F)F""",21,"""6C777426576F7DEC"""
-"""CD79144FCB2518F6_10F0979EBF318CCA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC=CC2=CN=CC(=C2)OC""",21,"""6C777426576F7DEC"""
-"""2D702A0F2BB63D9E_B4A69A79BE30C61D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC(CC)C2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""1AF0DE31714397E2_ED98BB28FF01BCD1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C([S](N(C)C)(=O)=O)S2""",21,"""6C777426576F7DEC"""
-"""A85525609456378F_AEE72D8C6CFB50D6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C([N](=O)=O)C=C(C=C2)C#N""",21,"""6C777426576F7DEC"""
-"""B72D552E325E789F_EDA1CF270A13A5D0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(OC)C=CC(=C2)C(C)C""",21,"""6C777426576F7DEC"""
-"""3A724408F0323CED_F54317020493AA2C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CN=C([N]2C)SC(F)(F)F""",21,"""6C777426576F7DEC"""
-"""0C74717684781654_DCB626E79C968C62_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(OC(F)F)C=CC(=C2)F""",21,"""6C777426576F7DEC"""
-"""CA5A48E9DA0A55BE_8B8C054D8E64942B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C[S](C)(=O)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""D45993EAC380A649_90BDE12CF9C66F9F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(OC(F)F)C(=CC=C2)F""",21,"""6C777426576F7DEC"""
-"""59D9054B23A6095C_85066CA0B20D233A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=CC3=C2OC(F)(F)O3""",21,"""6C777426576F7DEC"""
-"""8F50AC8841072BC4_E5742032E58FD223_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOCCN2C(=O)CSC2=O""",21,"""6C777426576F7DEC"""
-"""2FBE93B5882AB6AB_1A2C73B531188E2A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3CN=C(C2=C[N](C)N=C2)O3""",21,"""6C777426576F7DEC"""
-"""D6082922C889F022_5548B1FDA9D3BEDE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(COC2=CC=C(F)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""B0C3EBBB82360178_D83DDC4980AF35E0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(C=CC=C2)C(=O)N3""",21,"""6C777426576F7DEC"""
-"""E9E9635F386385F1_34AFB9C4FBAAED71_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC(=NO2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""48AAF58A524CF7A4_AC585FB2D309319B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C([S](NC)(=O)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""616FC70F31A90605_3CF2232D4CB0C910_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=C(O2)C3CCCOC3""",21,"""6C777426576F7DEC"""
-"""FDC242164EBC914E_299AB3F0AF293B19_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N[C@H](C)C2=CC=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""3DD58501D2204F72_B3C2F32E1A6FBCE8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CN=C(O2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""6289CA5A8BD03E9B_A1CA5278A9F86A3C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(CCNC(C(F)(F)F)=O)=O""",21,"""6C777426576F7DEC"""
-"""E87BFA5C5DB2BCCB_B4C27A64A076410D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(CCC)CC(F)(F)F)=O""",21,"""6C777426576F7DEC"""
-"""F7C6786D8D8F0E94_2EE9D1E5D534DBC9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC=C(C(OC)=O)S2)=O""",21,"""6C777426576F7DEC"""
-"""34EA5C6AE9F6ACD4_E5F6541B9B4EA7EC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCN(C)CC2=CC=C(C=C2)F""",21,"""6C777426576F7DEC"""
-"""386DB0820045C8A3_7616101CF700A02E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=CC2=C(OC(N2C)=O)C=C3""",21,"""6C777426576F7DEC"""
-"""C32762A78897B58D_7C354B29FF30B5FE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=CC(=N2)C(OCC)=O""",21,"""6C777426576F7DEC"""
-"""157F7616BCEE57D2_B116057DDB2EEE40_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=COC(=N2)C3=NC=CC=C3""",21,"""6C777426576F7DEC"""
-"""1A4FD5D3AF712137_5F57346E301381A8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=COC(=N2)C3=CC=NC=C3""",21,"""6C777426576F7DEC"""
-"""612E70963EDFE130_DB32CFEA20DDA4EE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC(=NO2)C3=CN=C[N]3C""",21,"""6C777426576F7DEC"""
-"""9A44F52815201D7F_09A24A2B52CDC892_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(COCC2)C(=O)N3""",21,"""6C777426576F7DEC"""
-"""4EACD4DBCFD97F88_01F7D26FB16258E8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CNC(=O)C3=C2C=CC=C3""",21,"""6C777426576F7DEC"""
-"""E0AC7C9B0B78E9A7_4FC4AC9420690A1C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NOC3=C2CC(C)(C)CC3""",21,"""6C777426576F7DEC"""
-"""6B075269855E7999_D9713A914E899AEF_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)C3=N[N](C)C=C3""",21,"""6C777426576F7DEC"""
-"""3966F8474EB724D2_2F5ED9ED13BC4FC5_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=C3[N]2C=CN(C)C3=O""",21,"""6C777426576F7DEC"""
-"""1AFA98AFFAE3D5D2_93C6E4AB1FA44CC5_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3CCC2(CCOCC2)CO3""",21,"""6C777426576F7DEC"""
-"""C519F5A5BB685B85_916D94EC261E53A4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3OC2=C(C=C(OC)C=C2)C3""",21,"""6C777426576F7DEC"""
-"""D358DBF100D73D40_C33FC64A52242962_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC=CC(=C2)CC)=O""",21,"""6C777426576F7DEC"""
-"""59FF8417A07755D2_2A263A283786A4AD_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC=CC(=C2)SC)=O""",21,"""6C777426576F7DEC"""
-"""9EFB85CFAC2242E9_BA933722BB702BAF_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCC[S](NC(C)(C)C)(=O)=O""",21,"""6C777426576F7DEC"""
-"""14F8F4B50A6DED8D_FBCF0355C7ACCDBF_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C(N(C)C)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""407921525F3410FB_1755F1534060126E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N2CC(C)OC(C2)(C)C)=O""",21,"""6C777426576F7DEC"""
-"""712EC96B36F4F1C6_A7B38D8F13B2A652_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC=CC(=C2)[N](=O)=O)=O""",21,"""6C777426576F7DEC"""
-"""0020FEB30A0C834A_6F1D62F21BBC02F8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2CCC(O2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""BFAC10B90354A9C5_0F0B905A1D63623F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C[N]3C(=N2)N=C(C)C=C3C""",21,"""6C777426576F7DEC"""
-"""986764B0A53B7350_E80F37CA7D1EE8B4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C(C)C=CC=C2C)=O""",21,"""6C777426576F7DEC"""
-"""25A0B0499D9E7070_F58736B1D1CD34B8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C(=C(C)C(=C2C)C)C)C""",21,"""6C777426576F7DEC"""
-"""75FA2D7FD12D78C3_595EDE0358F64F12_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(OC)C=CC(=C2)C(=O)C""",21,"""6C777426576F7DEC"""
-"""C32C032F6A7D3010_B740CC39EA184F33_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC2=C(C=CC=C2)C#N""",21,"""6C777426576F7DEC"""
-"""923F46D5B700C5E8_3CE7B8D5A10BFB3A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC=C(CC)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""1F73B0C3EE0BC508_F96CFE76CF376DDB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(CC)C2CCCCC2)=O""",21,"""6C777426576F7DEC"""
-"""AC45DACF1FEAE580_4DE7BCA0884D14D1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(CC)C2=CC=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""FE221B70D504968A_B45A6AAE799FE1B1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N2CCC(C(O)=O)CC2)=O""",21,"""6C777426576F7DEC"""
-"""F54FBAC8A8169952_83920505DC0D0C6A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC3C2CC4CC(C2)CC3C4""",21,"""6C777426576F7DEC"""
-"""13893BCF6869CFBB_30FE67786FD20061_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC2=CC3=C(C=C2)OCO3""",21,"""6C777426576F7DEC"""
-"""20014027C571EBCA_8B51378ACD0F3991_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=CC=CC(=C2)C(F)(F)F""",21,"""6C777426576F7DEC"""
-"""B772C44AA40D6B62_1FFDC63421190284_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=CC=C(C(F)(F)F)C=C2""",21,"""6C777426576F7DEC"""
-"""76F5655BE15A0824_10553B04F278EE8D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(C=CC(=C2)OC)[NH]3""",21,"""6C777426576F7DEC"""
-"""7082E27258918DF8_D2BB73105D149B1B_6039_DP""","""O(C1=CC(=C(N=C1)Br)Br)CC2OC(CC23CCNCC3)=O""",21,"""6C777426576F7DEC"""
-"""D0C7149BB0EB9709_F11C10AD112ADC28_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2OC(=O)CC23CCOCC3""",21,"""6C777426576F7DEC"""
-"""7D53A8DCF2845D68_7987573E8C0A6163_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC2=CC=C(C=C2)C#C""",21,"""6C777426576F7DEC"""
-"""CEF58EDBF60FF6AF_053A088D33484D5D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C)C=CC(=C2)[S](=O)(=O)F""",21,"""6C777426576F7DEC"""
-"""BBDEFF9145EAADB0_A7286075D294253D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCCCCCCCC2CC2""",21,"""6C777426576F7DEC"""
-"""AFDA932B1DCA4F06_288E26A3EF69B1F3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C)C=CC(=C2)[S](=O)(=O)Cl""",21,"""6C777426576F7DEC"""
-"""463A37CC3482B54B_318088C276232472_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3CCC2(CCCCCC2)O3""",21,"""6C777426576F7DEC"""
-"""0FB98D92E5B5B38B_06482D93A8A87C43_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)CCCC2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""CDA5C10F7A58BE69_93B36DB823906713_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=C(OC)C=C2)C(=O)C""",21,"""6C777426576F7DEC"""
-"""73CC5B75FBFB1250_16A540EFCFBF7E5B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)C[C@@H]2CCC[C@@H](C(OCC)=O)O2""",21,"""6C777426576F7DEC"""
-"""01F2CFC44DCD566B_37F71EDBE03DABBC_6039_DP""","""O(C1=CC(=C(N=C1)Br)Br)CC3CCC2(CCNCC2)CO3""",21,"""6C777426576F7DEC"""
-"""D507E9E841E4C880_F399AF6F165CFA1B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=N[N](C=C2)C3CCCCC3""",21,"""6C777426576F7DEC"""
-"""E25F36A90CF971D5_B7B5ABC72F1154D2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)COCC(F)F""",21,"""6C777426576F7DEC"""
-"""00F598ACF0620AF2_5B11389E4C86D274_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CSC(=N2)C(C)(C)C)=O""",21,"""6C777426576F7DEC"""
-"""4E77FBB678A70E84_1B0369829EBE481A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3CC2(CCOCC2)C(=O)N3""",21,"""6C777426576F7DEC"""
-"""F42C0AA6F02BF3A3_BE68EEA6DF14B693_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC(=O)C2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""B2FD35D4DBEB61C6_D5F3FD15C8E53309_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NCCC[N]2C=CC=N2""",21,"""6C777426576F7DEC"""
-"""1DCA317BBCA29F0B_1EB1BD59731A2280_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=C(C=C2)[N](=O)=O)OC""",21,"""6C777426576F7DEC"""
-"""7AF8073646A3E51F_8ACA1FF0246EF0CC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(N[S](C)(=O)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""AB6E2FD436EE5C0E_01311C4D1745453B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=N[N]2C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""F8D5F126E45A094C_A8E90103C4926732_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC=C(S2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""FA81327A42AB26C4_DCE5972C600A800F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=C(OC)C=CC(=C2)C)=O""",21,"""6C777426576F7DEC"""
-"""EFCDEB71E42BB66B_36AFEC91797D3ADD_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)N2CCOCC2C3CC3""",21,"""6C777426576F7DEC"""
-"""125C56FAF2E0A783_68B22A4EF3B9812A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C3=CC2=C(C=CC=C2)O3""",21,"""6C777426576F7DEC"""
-"""551CDBA1DC18D95E_8E7DB45EA8C5FDD0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCOC2=C(C(C)=O)C=CC=C2""",21,"""6C777426576F7DEC"""
-"""F56A168F98891617_E5040D80B7DD18DD_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC=NNC(=O)C2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""0EF4E58F2DCCA91D_4D0F7E9A3389F3FB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC=CC(=C2)OC)=O""",21,"""6C777426576F7DEC"""
-"""1A11CF5B3388F32A_00AF2E0132F919D4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(=O)NC2=C(C=CS2)C#N""",21,"""6C777426576F7DEC"""
-"""FB974725C554DD14_52111937DA2E4471_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(CCCC)C(C)CC)=O""",21,"""6C777426576F7DEC"""
-"""465AD2B4CF36BD34_918B22D7E2BF56AA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCCCC(OCC)=O)=O""",21,"""6C777426576F7DEC"""
-"""B57F7442E7520AB8_949A9381854F3314_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C=C2)[N]3C=NC=C3""",21,"""6C777426576F7DEC"""
-"""A3BEFA8465FF478A_E4AF83B463085E52_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(OC(F)(F)F)C=C2""",21,"""6C777426576F7DEC"""
-"""F7267C9497039A7A_27751B65C26B9003_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCOC2=C(C=CC(=C2)C)C""",21,"""6C777426576F7DEC"""
-"""BB81EB47ACF749B9_AA4F6DA5E6E42EC8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NCC2=C(C)C=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""9BA093543C22CB92_2F32B6F470F37EB9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=C(C(OC)=O)C=C2)C""",21,"""6C777426576F7DEC"""
-"""24DEDE7DD5F4537A_F611E551318F3D1E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=N[N](C(=C2[S](=O)(=O)N)C)C""",21,"""6C777426576F7DEC"""
-"""15D915093B0232C4_2FEC11EC7E8852E1_6039_DP""","""O(C1=CC(=C(N=C1)Br)Br)C[C@@H]2C[C@](OC)(CN2)C(F)(F)F""",21,"""6C777426576F7DEC"""
-"""0F453B100002AE00_D3F760873D7D0881_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=C([N](N=C2C)C)C)=O""",21,"""6C777426576F7DEC"""
-"""8C9A43B3A963E63A_FD8194F08C8ABB4B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=C(O2)C3CCOCC3""",21,"""6C777426576F7DEC"""
-"""8F6E4676ABD00073_359CD04687549DEF_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(C(F)F)N2CCOCC2""",21,"""6C777426576F7DEC"""
-"""22D3ABFC83820E13_4655E265FAF54166_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(CCOC)CCOC)=O""",21,"""6C777426576F7DEC"""
-"""824AFB75D6691F3E_1B57A78FFFCB99E9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NOC(=N2)N3CCOCC3""",21,"""6C777426576F7DEC"""
-"""42EE981BBE375A8F_0E21A76D56A39FCA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C=C2)C3CCCC3""",21,"""6C777426576F7DEC"""
-"""0674920C77493FA3_7AD3CD79D61A8C1F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC(=NS2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""0DA51F08914A9727_A795E2C1A373042C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=CC(=C2)OC(C)=O)C""",21,"""6C777426576F7DEC"""
-"""28BD27D03B8289A7_101D32E45F8B2C66_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=CC=C2)OCC3CC3""",21,"""6C777426576F7DEC"""
-"""E0A02B9EF83D0CCD_8EC270D5874E86F0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(CCCC2)C(=O)N3""",21,"""6C777426576F7DEC"""
-"""D51D8380A841745C_0C633C9C973B4EDA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C3=CC2=C(C=CC=C2)[NH]3""",21,"""6C777426576F7DEC"""
-"""2B430C05679FFD12_5273C8ED9C088A3B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(CC(C)(CC2)C)S3""",21,"""6C777426576F7DEC"""
-"""833404A3845DC4C9_63E1F34FC5BF0CBA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=CN=C3N=CC=C[N]23""",21,"""6C777426576F7DEC"""
-"""BC3BD228DCF4E138_6A409425E2934F22_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=C[N](C)N=C2C(F)F)=O""",21,"""6C777426576F7DEC"""
-"""65160F69FC048C9E_C1B436E2E8B3813E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C3=CC2=C(C=CC=C2)S3""",21,"""6C777426576F7DEC"""
-"""79DC29970BBB0256_D55026E08AD3FD62_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=CN=C3[N]2C=CC=C3""",21,"""6C777426576F7DEC"""
-"""75551335EC5354C7_AD43BA4E17B9D267_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=C([N]2C)C3=CC=CS3""",21,"""6C777426576F7DEC"""
-"""91F7C59E964375E0_9C361B849B09FC0A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=CC3=C(C=C2)OCO3""",21,"""6C777426576F7DEC"""
-"""83013A3F45BDE58C_395772D28B7DC35F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=C(C(OC)=O)N=C2)F""",21,"""6C777426576F7DEC"""
-"""221DABA7DF9940F7_87E4658895169A92_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CSC(=C2)C(OC)=O)=O""",21,"""6C777426576F7DEC"""
-"""88E5DC271EE5C79D_8DB67EB8640AE8EC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=CC3=C2OC(C)(C)C3""",21,"""6C777426576F7DEC"""
-"""4BA68B608EEDE2D0_42DB73CBDBBDC210_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=C(C=C2)C)C(OC)=O""",21,"""6C777426576F7DEC"""
-"""A044325CC1F07BDF_72316D7B0F9B3DB7_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC=N[N]2C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""AEDE48AAC20457C6_61EECD25887C9053_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(C=C(OC)C=C2)S3""",21,"""6C777426576F7DEC"""
-"""7A99582398D9AFA0_F4F9400AD3AC9F98_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(C)OCC2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""0E6A7179059F2E89_18130AF5685501FE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=C[N]2C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""2342BCFB757CFAF5_57E00C223B85027F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(OC(F)(F)F)C=CC=C2""",21,"""6C777426576F7DEC"""
-"""418252C4889AF401_E41DDF799B691D03_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CC(=C(C=C2)C#N)F)=O""",21,"""6C777426576F7DEC"""
-"""FD09AE548748A547_90C3F7675ABF33B8_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=CC(=C2F)C(F)(F)F""",21,"""6C777426576F7DEC"""
-"""04010901B56E1596_A3E0E0ED1914A8FF_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=CC(=C2)C(F)(F)F)F""",21,"""6C777426576F7DEC"""
-"""AC134E935A69A201_054899340DD1485A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C=CC(=C2)F)C(F)(F)F""",21,"""6C777426576F7DEC"""
-"""7F33FE0035D2DFD3_463E17BA840A88FB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=CC=C(NC(C)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""96CB5D8DE2839FCD_DD830D2A2F360CAF_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=C(F)C=C2)C(F)(F)F""",21,"""6C777426576F7DEC"""
-"""4A71D0AEBDEDF4BF_7A65DDDF85110129_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=CC(=C(OC)C=C2)OC""",21,"""6C777426576F7DEC"""
-"""EF14FE2A037BA6C3_DDACB083719D5EF2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(O[S](F)(=O)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""B017C39CF3F35D01_049120B80FEBB544_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=CC=CC(=C2)NC(C)=O""",21,"""6C777426576F7DEC"""
-"""3F4328F90B869875_F921C1639C8163DB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C)C=C(C=C2)C(F)(F)F""",21,"""6C777426576F7DEC"""
-"""06C7E178D73775FD_C8A3049A2EF00BE3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=C(C(F)(F)F)C=CC=C2""",21,"""6C777426576F7DEC"""
-"""576F687186AD1906_FD3DDD12A199DAFB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=C[N](C)C3=C2C=CC=C3""",21,"""6C777426576F7DEC"""
-"""A416079FE26D6EE9_BF3747B98BC404CF_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NCCCCCN=[N]#N""",21,"""6C777426576F7DEC"""
-"""FDA6D64FE2BD71D8_DDF11DA0F19A3310_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2CCCC(C(F)(F)F)C2""",21,"""6C777426576F7DEC"""
-"""D5E99DE36D669256_221BF7806014493C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C=C2)C3CC(=O)C3""",21,"""6C777426576F7DEC"""
-"""095C66BBCCFECB27_90E828D3CA68B874_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=CSC=C2C(OC)=O)=O""",21,"""6C777426576F7DEC"""
-"""01F92B0C12984F22_FA87B5A4D1CC48E5_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C3=C2C=CC=C[N]2C=N3""",21,"""6C777426576F7DEC"""
-"""775915D4E0E57B24_281F73BC362AADD1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C(=N[N]2C)C)[S](=O)(=O)Cl""",21,"""6C777426576F7DEC"""
-"""F21E49653206B2A3_F7310914B08324CC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2=C(C)OC(=C2)C(=O)N)=O""",21,"""6C777426576F7DEC"""
-"""17FBA9989637663D_878F9D6D8E69B822_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=C(O2)N3CCCCC3""",21,"""6C777426576F7DEC"""
-"""B09D327159FBA98E_BDA2F7557D3609E6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2COC(O2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""6B374C4763A74F20_6CEB055C68375497_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NN=C(O2)N3CCOCC3""",21,"""6C777426576F7DEC"""
-"""F643775F2F241BAA_D7BD6F4075B7384B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C=C2)C3=NC=CO3""",21,"""6C777426576F7DEC"""
-"""DA77DB1B71AA21D7_0BF20EB3129CB410_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=N[N](CCC(F)(F)F)C=C2""",21,"""6C777426576F7DEC"""
-"""41D3673BEE804BCE_F01C4DDBEC1747F1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC#CC2=CC(=CC(=C2)F)C#N""",21,"""6C777426576F7DEC"""
-"""239D2D41645F8B98_CCB005B5DADF3F0A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=N[NH]2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""0BF7E00870FCD004_82057B923157A9E5_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=CC(=C2)SCCCC""",21,"""6C777426576F7DEC"""
-"""EA428E12B7F05115_AC1AD26ECA1E3FF2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=CC2=C(N(C)C(=O)S2)C=C3""",21,"""6C777426576F7DEC"""
-"""9F738A02D4B27BBB_F71D8D82DBC4DCBC_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=CC(=C2)CCCOC""",21,"""6C777426576F7DEC"""
-"""51745768AA2565F8_A24B71F566A0DFDA_6039_DP""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=NO2)C3CCNCC3""",21,"""6C777426576F7DEC"""
-"""CBA585E5391710A1_8DCD3966484C4DA9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(C(F)F)C2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""7D356CD96733758D_1D25C1975BDBDC2A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(CNC(C)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""74A0D8E9B16D8702_DBB569451F797928_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC=C(O2)C3CCOCC3""",21,"""6C777426576F7DEC"""
-"""EDEBC679485A89E1_D05754BEDA1B1BDF_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCCO[S](C(F)(F)F)(=O)=O""",21,"""6C777426576F7DEC"""
-"""7AACE81C2CE459B7_080861FB75B882EA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N=[S](N(C)C)(=O)N(C)C)=O""",21,"""6C777426576F7DEC"""
-"""076D1325D60D7693_97AA2DB7BFE6026E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=CC2=C([N](CC)N=N2)C=C3""",21,"""6C777426576F7DEC"""
-"""AA55740E95E5F943_8F5C3BCF789D023D_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(NC(OC)=O)C=C2""",21,"""6C777426576F7DEC"""
-"""EFAACFD568AA2C24_AC6347AE67CD893E_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CN=C(C(OC)=O)C=C2C""",21,"""6C777426576F7DEC"""
-"""802840777CA69347_E2A7921F22DD3273_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=N[N](C=C2C(OCC)=O)C""",21,"""6C777426576F7DEC"""
-"""29AF11E83024CB2F_DFB9A501F3A5F2BA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC2=NOC3=C2C=CC(=C3)F""",21,"""6C777426576F7DEC"""
-"""3F3A3DE9B84B1E8C_842DE312658B53A6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)N3CC2=C(C=CC=C2)C3""",21,"""6C777426576F7DEC"""
-"""87EFAF8A9E238AB4_10FAF65A7E984C96_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=CC2=C(N(C)C(=O)O2)C=C3""",21,"""6C777426576F7DEC"""
-"""5B3A299565DE2BE4_8F0DCAB5041B14E3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=NC(=N2)CC3CC3)C""",21,"""6C777426576F7DEC"""
-"""30D8DA6C097C02E0_B4325CD086CEDA7A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=NC(=N2)C3CCC3)C""",21,"""6C777426576F7DEC"""
-"""60C68561A5F9BF2F_F98508325ABD90E6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=NC(=N2)C(F)(F)F)C""",21,"""6C777426576F7DEC"""
-"""5B7DFF21F7BADDCD_D6EFD04E75FFF278_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=N[N]2C3CCCCC3""",21,"""6C777426576F7DEC"""
-"""DA2DED5065DB61A2_9EF2C9A9D0002CA7_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2CCN(C(C)=O)CC2)=O""",21,"""6C777426576F7DEC"""
-"""F3B259D81903EFD4_89D7E4130E4F27C5_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3CC2(CCOCC2)C(=O)O3""",21,"""6C777426576F7DEC"""
-"""FCC8C063A8FF811C_79DB57C5A68A340B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C(=N[N]2C)C)[S](=O)(=O)N""",21,"""6C777426576F7DEC"""
-"""699C29130122532A_C94F74213732908F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C(CC(OCC)=O)(C)C)=O""",21,"""6C777426576F7DEC"""
-"""F4DA2C4E312D2A6C_53AA3607071432F2_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C(OCC)=O)C=N[N]2C""",21,"""6C777426576F7DEC"""
-"""11986BC9EA86C366_DC561A45F11661E3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC[N]2N=C(C(OC)=O)C=C2C""",21,"""6C777426576F7DEC"""
-"""D79A7FA6BA95C435_205505940F9434BE_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2CCCC3=C2C=CS3""",21,"""6C777426576F7DEC"""
-"""3E6AABA2DF641515_ADB56B61BFBD3CF6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC=C(O2)C3CCCCC3""",21,"""6C777426576F7DEC"""
-"""79E731D069A38860_DF85A9C5AE3ACF21_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=NC3=C([N]2CC)C=CC=C3""",21,"""6C777426576F7DEC"""
-"""EB114ED18C96051C_5A7540F2C9A6C8EB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C)C=C(C=C2)CC(=O)O""",21,"""6C777426576F7DEC"""
-"""B19649F109CAB4DA_1F1F21E89C5283BB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC(=NC(=N2)C3CC3C)C""",21,"""6C777426576F7DEC"""
-"""B60A4B08364C70EF_499E081DA64087FF_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(CC)C=CC(=C2)[N](=O)=O""",21,"""6C777426576F7DEC"""
-"""D1B75B8AC0037F98_36F5AF17990DD53B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(C2CCCN(C(C)=O)C2)=O""",21,"""6C777426576F7DEC"""
-"""452E6A7A28D3CD46_1EB0CA368F1AB08F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(F)C=CC3=C2N=CC=C3""",21,"""6C777426576F7DEC"""
-"""6EC6868E49158A3C_51E41224BF1D48A0_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)COC3CCC3""",21,"""6C777426576F7DEC"""
-"""0CFA7D6C80558E88_0F575268FE357D1C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC3=NC2=C(C(=CC(=C2)F)F)[NH]3""",21,"""6C777426576F7DEC"""
-"""79DC29970BBB0256_6BA876D5A96C2000_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=CN=C3C=CC=C[N]23""",21,"""6C777426576F7DEC"""
-"""8C12EF80A60D24EB_08C3786095C3D592_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(F)(F)C(=O)C2=CC=CC=C2""",21,"""6C777426576F7DEC"""
-"""389CECBDCAF6AD6F_6D9175DF5FB5ED38_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(CC2=C(OC)C=CC=C2)=O""",21,"""6C777426576F7DEC"""
-"""10D4890FD4D73C0B_5F69AF09C7B976C4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CN=C(C=C2)[N]3C=CC=N3""",21,"""6C777426576F7DEC"""
-"""BBEB6D3AC4977537_A88A963EBB4744EB_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2(C)CC[S](=O)(=O)C2)=O""",21,"""6C777426576F7DEC"""
-"""BFAAAF9782CAE5AB_4138F2B89B864F85_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCC(C2=CC=C(CC)C=C2)=O""",21,"""6C777426576F7DEC"""
-"""574DDE552D70628F_483439D1FF7680B9_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=N[S](=O)(=O)C3=C2C=CC=C3""",21,"""6C777426576F7DEC"""
-"""E6F2B763661D32F1_F01EFD05F7333F2F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)NC2CCCCNC2=O""",21,"""6C777426576F7DEC"""
-"""B437C9D060104335_CC57570BCDE43373_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=CC(=C(C)C=C2)F)=O""",21,"""6C777426576F7DEC"""
-"""F57E6E05E4DB2847_C1BF1C2D61B27885_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(NC2=NC=C([N](=O)=O)S2)=O""",21,"""6C777426576F7DEC"""
-"""3E65783A915F2BEF_6CA6C9F7E9514F8F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=N[N](N=C2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""0C645148FFD4B604_1C8977595FBAA6E1_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC[N]2N=C(C)C(=C2C)C(=O)O""",21,"""6C777426576F7DEC"""
-"""F8E399DEEF39E6E1_1433A655B4AB4B18_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2CC(=NO2)C3CCCCC3""",21,"""6C777426576F7DEC"""
-"""5C69FA94744B0F67_D151FA65D5DB5EBA_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCN2C(=O)OC3=C2C=CC=C3""",21,"""6C777426576F7DEC"""
-"""629BB2EAA10A515B_E18A814C6289DE2F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCCC[N]2N=C(C)N=C2C""",21,"""6C777426576F7DEC"""
-"""CFCA9BCE372D0CDA_B38E9E7B5962FC6A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C=C([N](=O)=O)C=C2F)F""",21,"""6C777426576F7DEC"""
-"""11B003CF6987D1FF_654178F1BF5BF109_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CN=C([NH]2)C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""896B6023C5ECE2AD_3347F8F2268D9977_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)C3=C[N](C)N=C3""",21,"""6C777426576F7DEC"""
-"""7C3CB5DBDE14187F_36AA18D35B45EE9F_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CSC(=N2)C3=NC=CC=C3""",21,"""6C777426576F7DEC"""
-"""4193223ADC1C8CE6_76BE453BEC9F6DF6_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=N[N](C(=C2[S](=O)(=O)Cl)C)C""",21,"""6C777426576F7DEC"""
-"""FB7032EB14088F6A_072F7CC6458EA162_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=C(C=C2)C3=CSC=C3""",21,"""6C777426576F7DEC"""
-"""DA1863C625E17C43_863CF50AA8031A1C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)C2=CC3=C(N=C2)OCO3""",21,"""6C777426576F7DEC"""
-"""1AA67BAFC2B6EBC5_33B0A8EB40F83F7A_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=CC=CC(=C2)SC(F)(F)F""",21,"""6C777426576F7DEC"""
-"""BADD3FF2DE7DBF9C_8E43853C6169D42B_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(OC)CC2=CC=C(C=C2)F""",21,"""6C777426576F7DEC"""
-"""3132484C3738EA4B_5DA51DEE7AB101A3_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC2=C(C(C)(C)C#N)C=CC=C2""",21,"""6C777426576F7DEC"""
-"""981F60C6FA89AC42_6280A28F89394877_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(N(C)C2=CC=C(C=C2)C)=O""",21,"""6C777426576F7DEC"""
-"""8F30B96F3B5BC314_D2D71CAB53C7FAF4_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CC(=O)[C@@H]2C[C@H]2C3=CC=CC=C3""",21,"""6C777426576F7DEC"""
-"""BFB6335509FFB311_6BB71FA51379773C_6039_UN""","""O(C1=CC(=C(N=C1)Br)Br)CCCCCCCCCN=[N]#N""",21,"""6C777426576F7DEC"""
-"""3D25E4EDD55BC5B1_BAB489D7863B2922_6039_UN""","""CC(OCC(=O)NCCCN1CCCC1=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""0154B815AD5C54FB_75D8DCA67AE14A93_6039_UN""","""CC(OCC(=O)NCCOC1=CC=CC=C1)CCCC#C""",21,"""47F105B33DE3184A"""
-"""06B27234FC45A44C_742E32FA0FBE8286_6039_UN""","""CC(OCCCC(OC1=CC=C(F)C=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""EE78232089870505_DCAE835C92932403_6039_UN""","""CC(OCC1=NOC(=N1)C2=CC=C(C)C=C2)CCCC#C""",21,"""47F105B33DE3184A"""
-"""52C473CF3C464FDB_E36431AC228C12E8_6039_UN""","""CC(OCCC(NC1=C(SC)C=CC=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""4B54DE785195AFD2_8963CDB06972EFC0_6039_UN""","""CC(OCC1=C(C(OCC)=O)CNC(N1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""2230B57C234774F7_125CA55C3188EB3C_6039_UN""","""CC(OCC(=O)NC2=C1N=[S]=NC1=CC=C2)CCCC#C""",21,"""47F105B33DE3184A"""
-"""BCE178407E7E8BDB_FCEA91444CE47485_6039_UN""","""CC(OCCOC1=CC=C(OCCC)C=C1)CCCC#C""",21,"""47F105B33DE3184A"""
-"""93E5330F8DADD4A7_6C431E1BE5089185_6039_UN""","""CC(OCC(=O)NC2=NC1=C(C=CC=C1)S2)CCCC#C""",21,"""47F105B33DE3184A"""
-"""33759C07D0E1C788_839A09DA05FAD2AA_6039_UN""","""CC(OCC(N(CC)CC1=CC=CC=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""5BC7C314069C9953_083C7D8F40A60768_6039_UN""","""CC(OCC(=O)C2=C1C=CC=CC1=CC=C2)CCCC#C""",21,"""47F105B33DE3184A"""
-"""CF411B7C9541EE21_BF9411D8D8C0180E_6039_UN""","""CC(OCC(=O)NCCCC1=CC=CC=C1)CCCC#C""",21,"""47F105B33DE3184A"""
-"""1F3D6D3CABC3E4D1_862B63790F7CED39_6039_UN""","""CC(OCC(C1=CC=CC(=C1)C(F)(F)F)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""964F949CCA636842_21DB14904A6634EE_6039_UN""","""CC(OCC2=NN=C(C1=CC=C(C)C=C1)O2)CCCC#C""",21,"""47F105B33DE3184A"""
-"""44CC8BD440BFC9C8_685EEEFC35F9C155_6039_UN""","""CC(OCC(C1=CC=C(C(C)(C)C)C=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""64EDA428DB99AFF3_2AFFC2862A028C4B_6039_UN""","""CC(OCC(NCC1=CC=CC(=C1)OC)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""2DB5AF30AF0BA370_306A49D0C2E2794B_6039_UN""","""CC(OCC1=C(OCC)C=CC(=C1)C(=O)C)CCCC#C""",21,"""47F105B33DE3184A"""
-"""01A6F2555994F14A_5BCCC3CF3BEEFE3F_6039_UN""","""CC(OCC2=NC1=C(C(=C(C)S1)C)C(N2)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""56B0AD665AC766EE_CFE3EF80CA413B56_6039_UN""","""CC(OCC(=O)NC(=O)NC1CCCCC1)CCCC#C""",21,"""47F105B33DE3184A"""
-"""215AA0B6AB4858B1_CDC46BFC6FC2F3EE_6039_UN""","""CC(OCC(C1=CC(=C(OC)C=C1)OC)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""35A3F8BA4062243F_118CA12114EE86C4_6039_UN""","""CC(OCC(NC1=NN=C(CC(C)C)S1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""CE1900626B5F99ED_0FB41E00AA114989_6039_UN""","""CC(OCC(C1=CC=C(CNC(C)=O)O1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""F194BD78BF4A1F5C_DF978B24AF417744_6039_UN""","""CC(OCC(C1=C(C)[N](C(=C1)C)CC=C)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""374DC7A425CBB28E_8B2DD43A57DAE286_6039_UN""","""CC(OCC(C1=C(C)[NH]C2=C1C=CC=C2)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""B9F9D34C7A269946_40A1F9A6A56A6AEF_6039_UN""","""CC(OCC(C1=C(C=C(OC)C=C1)OC)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""2D9CB75D5BB46812_B4433446C2C51023_6039_UN""","""CC(OCC(=O)NNC(=O)C1=CC=CC=C1)CCCC#C""",21,"""47F105B33DE3184A"""
-"""76D59EC36CB31A22_14429D4D24E622B2_6039_UN""","""CC(OCC(C1=CC=C(CCCC)C=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""2262E0EF4D958718_16543FCC7DACF056_6039_UN""","""CC(OCC(N(CC)CC(=O)NC(C)C)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""4908776252281B97_18E95D7B73C6CC80_6039_UN""","""CC(OCCC(NC1=CC=C(OC)C=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""89399C04E71F6B82_57AA0D97166EA62A_6039_UN""","""CC(OCCOC1=CC=C(C(C)(C)C)C=C1)CCCC#C""",21,"""47F105B33DE3184A"""
-"""3A0A03255FE55AC6_FCE194589328052E_6039_UN""","""CC(OCC(NCCC1=C(C)C=CC=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""970C7224DFEC9810_312E46720854DDCC_6039_UN""","""CC(OCC(NC1=CC=CC(=C1)C(O)=O)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""FAD017D8FE1E8DEF_331FCEE31E558FEA_6039_UN""","""CC(OCC(=O)NC(=O)NCC1=CC=CS1)CCCC#C""",21,"""47F105B33DE3184A"""
-"""2CA3E36328BCB6BA_7028144601AB0A23_6039_UN""","""CC(OCC(NC(C)C1=CC=C(C=C1)F)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""730EF50E81C1EC45_BD0F2C578501CB23_6039_UN""","""CC(OCC(NC1CCN(C(C)=O)CC1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""2376477D925C169B_920392DE3FAB1BE5_6039_UN""","""CC(OCC(C1=C(C(F)(F)F)C=CC=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""82210ABC5B9DDFE6_B15315FF4588E96B_6039_UN""","""CC(OCC(C1=CC=CC(=C1)OC(F)F)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""534C30D202F544D7_DA760D65E8BD6BAE_6039_UN""","""CC(OCCOC1=CC(=C(C(C)C)C=C1)C)CCCC#C""",21,"""47F105B33DE3184A"""
-"""CC5DE7AE42B6282C_6BE7BC20A11F9BAD_6039_UN""","""CC(OCC(=O)NC1=CC=C(C=C1)CC#N)CCCC#C""",21,"""47F105B33DE3184A"""
-"""7368980F48600973_4B797D1D62023A0A_6039_UN""","""CC(OCC(C1=C(C=CC(=C1)CC)CC)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""1BDA5DAB5F08A35E_4C1EF44E9718335A_6039_UN""","""CC(OCC(N(C)C1(CCCCC1)C#N)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""64879936155A3F32_4D44FA0915E072FF_6039_UN""","""CC(OCC1=C(C)C=C(C=C1C)C(C)(C)C)CCCC#C""",21,"""47F105B33DE3184A"""
-"""A6A8881BFD767179_5D779F62E103A9D0_6039_UN""","""CC(OCC(C1=C(C(=C(C)C=C1C)C)C)=O)CCCC#C""",21,"""47F105B33DE3184A"""
-"""84A762D929405783_0A00EF88DFF90558_6039_UN""","""CC(OCC1=NC(=NO1)C2=CC=C(C)C=C2)CCCC#C""",21,"""47F105B33DE3184A"""
-"""3F63B06ED0305CB5_4D7F1DBB682632A4_6039_UN""","""CC(OCC1=CC=CC(=C1)[S](N(C)C)(=O)=O)CCCC#C""",21,"""47F105B33DE3184A"""
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-"""190297C14A3C6946_4C53C15F2828CEF3_6039_UN""","""CC(OCC1=NN=N[N]1CC2=CC=CC=C2)CCCC#C""",21,"""47F105B33DE3184A"""
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-"""A32AFC099331CA52_7B59EE32F0AB7275_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=CN=NS3""",21,"""FB7B3055678EBA83"""
-"""91A68978AFF42BD5_4D73E91097F4B734_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC[S](F)(=O)=O""",21,"""FB7B3055678EBA83"""
-"""829BA6086EBA6E6A_C508197555267C8D_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OC[C@H]3CCCO3""",21,"""FB7B3055678EBA83"""
-"""0AA2A0C1FDCC61B0_1659DDE31800D135_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC[Si](C)(C)C""",21,"""FB7B3055678EBA83"""
-"""B61414A71CD103FC_AB48ED21D04A8DE0_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC(NCC)=O""",21,"""FB7B3055678EBA83"""
-"""51AAC748547C9669_0CC2AB06A4CC38FE_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCOCC=C""",21,"""FB7B3055678EBA83"""
-"""F2057A5925C730B2_8892D16625D5B057_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=CSC=C3""",21,"""FB7B3055678EBA83"""
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-"""B89F88C5906464D9_C8256587275EE603_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=NON=C3""",21,"""FB7B3055678EBA83"""
-"""CB4836C60B6E246A_980F03981D35D2B8_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=NOC=C3""",21,"""FB7B3055678EBA83"""
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-"""691A3A48669821DD_2C094EEB5E9388F1_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCC3CC3""",21,"""FB7B3055678EBA83"""
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-"""C31DDE91D3BC30B5_5D753384BB955977_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=NOCC3""",21,"""FB7B3055678EBA83"""
-"""4139083B83FDE7C2_6C26509FF5ED9605_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC(OCC)=O""",21,"""FB7B3055678EBA83"""
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-"""A0BE787B311BCDDC_32F521F5ACDD247E_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCCCC""",21,"""FB7B3055678EBA83"""
-"""088D314D84D6AE09_23B1BC9FFDB7086E_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCC(CC)C""",21,"""FB7B3055678EBA83"""
-"""BD109072BD3BDB34_14D053B55F711EAE_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCC(C)=C""",21,"""FB7B3055678EBA83"""
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-"""F2BFDA3E62856477_DAD7B5CED54A2B62_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCC(F)F""",21,"""FB7B3055678EBA83"""
-"""D6151207AC317952_7FC4E20AAB88A60E_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCC=C(C)C""",21,"""FB7B3055678EBA83"""
-"""2F649FCE32CF7299_C14D8729E2826DD6_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC=C(C)C#N""",21,"""FB7B3055678EBA83"""
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-"""2507CCEC5459AE93_15E17BA902D1E66E_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCOC(F)F""",21,"""FB7B3055678EBA83"""
-"""6D046DBBBB246532_15839CB16AA11BDC_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCC3(C)CC3""",21,"""FB7B3055678EBA83"""
-"""AE24EFC87E6AF42E_7749F8AB64208C5A_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC#CC3CC3""",21,"""FB7B3055678EBA83"""
-"""2C5104421F4C71A5_B6503D1AB0E8AA68_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCC3COC3""",21,"""FB7B3055678EBA83"""
-"""AA15E79F6F1506B7_3A4AECA322353B10_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCC(N)=O""",21,"""FB7B3055678EBA83"""
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-"""F1CCCCC1707CFC2D_BA6F4B49C4A19A74_6039_DP""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC([C@@H](C)N)=O""",21,"""FB7B3055678EBA83"""
-"""BDF8D67446AD431E_9388020D6DD45A63_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCN3CCC3""",21,"""FB7B3055678EBA83"""
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-"""89DC444838A18EFA_9F9086DCCEF862BB_6039_DP""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCCCO""",21,"""FB7B3055678EBA83"""
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-"""0E5844386FA53C22_5A8141B499121B12_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCCC#C""",21,"""FB7B3055678EBA83"""
-"""73FBFF1966E1C148_DDBEFF69F23B03D3_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC(C)N(C)C""",21,"""FB7B3055678EBA83"""
-"""0873DC4C37D0B6DC_1FE94672C0FFD82C_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCC3CO3""",21,"""FB7B3055678EBA83"""
-"""A22BD76F2CA0EC07_83902E48D2ED887D_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCC3CCC3""",21,"""FB7B3055678EBA83"""
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-"""05AF68D2F9A82741_514205F02DD5956A_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3OC3CC""",21,"""FB7B3055678EBA83"""
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-"""54546847C05FF970_DCA0AF072CC0DA60_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=CN=CO3""",21,"""FB7B3055678EBA83"""
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-"""EB4F455161147126_0F22252928309421_6039_DP""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC([C@H](C)N)=O""",21,"""FB7B3055678EBA83"""
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-"""50F30F9DA6AF02BC_E822BA6B755D61DF_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCSCC""",21,"""FB7B3055678EBA83"""
-"""25EE56D4B9885D8E_00901CD8690CF67E_6039_UN""","""O(C1=CC2=C(N=C1)C(=CC=C2)C#N)CCCCCCCC""",21,"""D699F8C234797C1D"""
-"""34775522AB7B65DF_B92352F6B8051F63_6039_UN""","""O(C1=CC2=C(N=C1)C(=CC=C2)C#N)CC(=O)C3=CC=C[NH]3""",21,"""D699F8C234797C1D"""
-"""CAC7FA3C5FA19BB4_BE859F57F0064EE1_6039_UN""","""O(C1=CC2=C(N=C1)C(=CC=C2)C#N)CC(NC(OC)=O)=O""",21,"""D699F8C234797C1D"""
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-"""BD4F3602D12F5BDD_0F346DB76ECEB49F_6039_UN""","""O(C1=CC2=C(N=C1)C(=CC=C2)C#N)CCCCOC(C)=O""",21,"""D699F8C234797C1D"""
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-"""2F62E8AC1F2CAB8E_3ADC219CC3F15848_6039_DP""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=C(CN)OC=N3""",21,"""F0EBD3232513BB54"""
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-"""68F23575127AF39B_D31D506657078537_6039_DP""","""N1CCC3(CC1)CC(OCC=C(C)C)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""387037DB605C95C5_8CFBEA9B1475EFAE_6039_DP""","""N1CCC3(CC1)CC(OCC(F)(F)F)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""3B68167913E03F66_9F339296C484DC07_6039_DP""","""N1CCC3(CC1)CC(OCCN=C=O)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""27026726E3B84F2F_0E37DE0907AAA557_6039_DP""","""N1CCC3(CC1)CC(OCC(C)(F)F)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""E3FEB49CD51E88FB_8884FA3DA92F0F99_6039_DP""","""N1CCC3(CC1)CC(OCC[S](=O)Cl)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""FF2B03FA3ED5E182_4AC31730D39BB3AF_6039_DP""","""N1CCC3(CC1)CC(OCC(=C)C=C)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""79B022BE81F60F4A_DFCFD8B6A3679EC8_6039_DP""","""N1CCC3(CC1)CC(OCC(CC)=C)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""58CDA6881E8F6B7B_B92869D8E13A3FC0_6039_DP""","""N1CCC3(CC1)CC(OCC[S](C)=O)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""778B20C0EDCCB3E3_B94DFB81B5964139_6039_DP""","""N1CCC3(CC1)CC(OCC(CN)=O)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""50AE8D39F50722FA_241BB22FF1F3FEA5_6039_DP""","""N1CCC3(CC1)CC(OCCC(C)=C)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""C01B38D5FDA4849C_5CCEA3236B7B1471_6039_DP""","""N1CCC3(CC1)CC(OCCC=CC)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""E4FDE62F155E7B9A_4CDBF1FF413E7529_6039_DP""","""N1CCC3(CC1)CC(OCCSC#N)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""17FC231962978F13_2A702EF8602E590D_6039_DP""","""N1CCC3(CC1)CC(OCCC(C)N)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""5B1B14C8BB463DF6_0958E6D38942FA57_6039_DP""","""N1CCC4(CC1)CC(OCC2OC2C)C3=C(C=CC=C3)O4""",21,"""12F3D75AF83B7F12"""
-"""4349F84020F5FFBB_9E439605B8918E69_6039_DP""","""N1CCC3(CC1)CC(OCC[CH]=[C]=[CH2])C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""6FA7A271BDB81E40_AFAB7B8B98309BD5_6039_DP""","""N1CCC3(CC1)CC(OCCN=[N]#N)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""05D88812DA623864_FF485ECC376B2C72_6039_DP""","""N1CCC3(CC1)CC(OCC(CC)N)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""46EA764776789462_A4A22AFEEACCF79D_6039_DP""","""N1CCC4(CC1)CC(OC[C@@H]2CCO2)C3=C(C=CC=C3)O4""",21,"""12F3D75AF83B7F12"""
-"""9E5A8437F0F750E5_65BFBC929624A09E_6039_DP""","""N1CCC4(CC1)CC(OCC2CCO2)C3=C(C=CC=C3)O4""",21,"""12F3D75AF83B7F12"""
-"""F7C5E01135BF97D8_452D9FF74C610A1E_6039_DP""","""N1CCC4(CC1)CC(OC[C@H]2CCO2)C3=C(C=CC=C3)O4""",21,"""12F3D75AF83B7F12"""
-"""7ED09779220B445D_BB14B5A234ED5630_6039_DP""","""N1CCC4(CC1)CC(OCC2CCN2)C3=C(C=CC=C3)O4""",21,"""12F3D75AF83B7F12"""
-"""84F86148308FBB9B_4692E0C038F78155_6039_DP""","""N1CCC3(CC1)CC(OCCCCF)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
-"""B0D54E2C00AF9D1E_8C224097DE0052D7_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCC(N)=O)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""20BE5724BC541FF6_BBABE414DC8F40B5_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCC#CC)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""CDB8D0F6FE4678D7_F4F33DC8965093BE_6039_DP""","""NC(=O)[C@@H]1C[C@@H](OCC(O)=O)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""2E446D2BD0C38F3D_A48AFD1D8FFF4A3E_6039_DP""","""NC(=O)[C@@H]1C[C@@H](OCCCO)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""CF4CB04C6F38D084_0772F3B5A277D6A8_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCC(C)=C)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""D39ED8EE1F15E613_411AFFF63AEE058C_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCCC=C)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""98299B535305431E_E154EFA25D1A973A_6039_DP""","""NC(=O)[C@@H]1C[C@@H](OCC(C)N)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""D95A35B83756DEE5_69FD33AEF1C7AA8F_6039_DP""","""NC(=O)[C@@H]1C[C@@H](OCCNC)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""DAFF33FD2AF41946_6DD7D07C9C87D647_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCCC#N)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""A18007ABDC3441CE_A5DF903509DA1936_6039_UN""","""NC(=O)[C@@H]2C[C@@H](OCC1CO1)CN2C(=O)C3=CC=CC=C3""",21,"""DCC12CB1F04C802B"""
-"""2F14736DAFE057C3_C54B67A279C39497_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCCOC)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""56534F63901D109B_14A57A04D3C35EA8_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCCCC)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""A77F2E2DFBA108B1_F331C178D2EDBCCA_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCCC#C)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""87469A79562B3766_9662DE74CEF8CD55_6039_UN""","""NC(=O)[C@@H]2C[C@@H](OC[C@H]1CO1)CN2C(=O)C3=CC=CC=C3""",21,"""DCC12CB1F04C802B"""
-"""F63D9290E62A6234_3AC19E24EAE16A14_6039_UN""","""NC(=O)[C@@H]2C[C@@H](OC[C@@H]1CO1)CN2C(=O)C3=CC=CC=C3""",21,"""DCC12CB1F04C802B"""
-"""3199E1DC44A4B7B9_7106D8C97843020B_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCC(F)F)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""4C684443C82DD2C6_18FF4DB8F035724F_6039_DP""","""NC(=O)[C@@H]1C[C@@H](OCCCN)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""9E79BD7A3436A55E_6E9119984C6A8B62_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCC(C)F)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""4663D95DBA3A77B2_35D0B8FD22FFDA64_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCCCF)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""9BFC574B0A47334D_BC59450FDD8A1FC0_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCCSC)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
-"""A0F8D4AE57D43657_2FF48F5B89B57BB4_6039_UN""","""NC(=O)[C@@H]2C[C@@H](OCC1CS1)CN2C(=O)C3=CC=CC=C3""",21,"""DCC12CB1F04C802B"""
-"""E847E1E2E82BDB56_F2DE6CDD36ADD9E2_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(SC(F)F)C=CC=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""CD8D9DDE73BE10E7_E9118DA74035FC25_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)N(C2CC2)C3CC[S](=O)(=O)C3""",21,"""61AAA8EA1A3A9448"""
-"""DE178878B7CE067E_EFCD22265E04E07A_6039_UN""","""O(CC1=NN=N[NH]1)CC(N2C(CC)C3=C(CC2)SC=C3)=O""",21,"""61AAA8EA1A3A9448"""
-"""4FDBEA66F4D35EAF_5E1E154215CEA5BC_6039_UN""","""O(CC1=NN=N[NH]1)CC(N(C)C2=CC=C(C=C2)[N](=O)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""AF6ADD2EA3137CD9_888628652C56ED9F_6039_UN""","""O(CC1=NN=N[NH]1)CC(N(CC)CC(=O)NC(C)(C)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""184E5D6076D763C6_81F5BFBDD3DE0385_6039_UN""","""O(CC1=NN=N[NH]1)CC(N(CC2=C(OC)C=CC=C2)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""8C31931461FDC94B_808DEA8891AF0456_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C(=C(C#N)S2)C)C#N)=O""",21,"""61AAA8EA1A3A9448"""
-"""FB1969E9E7BD488C_DF7F72E4DADFF474_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=CC(=C2)C(F)(F)F)=O""",21,"""61AAA8EA1A3A9448"""
-"""1D402AF8CB39DB2F_1AA71FC41C76F756_6039_UN""","""O(CC1=NN=N[NH]1)CC(OCCCCCCCCCC)=O""",21,"""61AAA8EA1A3A9448"""
-"""EF61F96B20E609EB_3569372A3D844A03_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC34CC2CC(CC(C2)C3)C4""",21,"""61AAA8EA1A3A9448"""
-"""C45182BF90BB9E9D_54572B2FA4757F0D_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C)C=C(C=C2)[N](=O)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""54D55F6776C73A39_170FCA3E6ACFAB21_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=CC(=C2)NC(C)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""A2C4619FE8BD079D_357575A5C6BAE267_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC3=NC2=C(C=C(C)C=C2)S3)=O""",21,"""61AAA8EA1A3A9448"""
-"""DCACBFA058A182AF_AAC4FDA80835BEA1_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=CC=C(NC(CC)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""A938BD5669E483F4_5980AE79AEB7F8F4_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=NN=C(CCCCC)S2)=O""",21,"""61AAA8EA1A3A9448"""
-"""ADFD4AC625A36453_E7354DAB704AEDE3_6039_UN""","""O(CC1=NN=N[NH]1)CC(NNC(C2=CC=CC(=C2)C)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""7E9135E52841B7C4_20A0B2AAAE8168FA_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=C[NH]C3=C(CC)C=CC=C23)=O""",21,"""61AAA8EA1A3A9448"""
-"""800EBEF8F0CCC9F7_00AEB590A38CB0C9_6039_UN""","""O(CC1=NN=N[NH]1)CC4=NC2=C(C3=C(S2)CCC3)C(=O)N4""",21,"""61AAA8EA1A3A9448"""
-"""90ABC48D314BC5AA_87C3BC223184FC7D_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NC(=NO2)C3=CC=C(OC)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""A07A83068C792DA2_EE6A9D90D80386FA_6039_UN""","""O(CC1=NN=N[NH]1)CC3CN(CC2=CC=CC=C2)CCO3""",21,"""61AAA8EA1A3A9448"""
-"""577F18A8F45209B5_902AB033A7F19B95_6039_UN""","""O(CC1=NN=N[NH]1)CC(C3=CC2=C(NC(C2C)=O)C=C3)=O""",21,"""61AAA8EA1A3A9448"""
-"""9167DC175AB8C29E_5C5EC71D0B1E3D97_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=C([S](C)(=O)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""F9887F1E8B6C37A3_7B96A46D34485F3C_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=CC=C(CCNC(C)=O)S2)=O""",21,"""61AAA8EA1A3A9448"""
-"""BB2A71DBA0BB048E_71B36E0913B20CFF_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=CC(=C2)[S](C)(=O)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""120896B1FA58F7AC_8E4B6030CE07A7CF_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C([S](C)(=O)=O)C=CC=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""BB5154A6480E562F_4B0565CBD89CD572_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CSC(=N2)C3=CC=CC(=C3)OC""",21,"""61AAA8EA1A3A9448"""
-"""FFED9EB333F5423D_DAFA9585AFF56F44_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CSC(=N2)C3=C(OC)C=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""FD7DF5E83C4164AD_59A06DD8E3D65AB2_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=C(C=CC(=C2)C)OC(F)F)=O""",21,"""61AAA8EA1A3A9448"""
-"""93C9C1F11BF44575_4A7BE29E3217A5A7_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC(NC2CCCCC2C)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""10AE2EB7651A3FE9_CE17BFB5683C5E60_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=C(C(=C(C)C(=C2C)C)C)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""A12D161E2B7E151D_F6FD5FB47A72C0FD_6039_UN""","""O(CC1=NN=N[NH]1)CC3=CC=C([N]2N=C(C)C=C2C)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""0C387B9B43278CA8_6461B21F9415B498_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CC(=CC3=C2OCOC3)[N](=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""8E449D696222A1CE_55CDD0431438C0C0_6039_UN""","""O(CC1=NN=N[NH]1)CC2N[S](=O)(=O)N=C3CCCCCN23""",21,"""61AAA8EA1A3A9448"""
-"""B3A349424EFCAC2C_761B426D6FF59EC8_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CSC(=N2)NN=CC3=CC=CS3""",21,"""61AAA8EA1A3A9448"""
-"""467AB00BBF80487C_98AC9687D0CE5D81_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C(C(OCC)=O)C(NC(N2)=O)C""",21,"""61AAA8EA1A3A9448"""
-"""E2C1CFB049B7E7D5_E5F0EB9636ABE7FC_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C)C=CC(=C2)C(=O)O)=O""",21,"""61AAA8EA1A3A9448"""
-"""A0A3BBF25C975A9A_7A45DFD4190288B2_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC(=O)NCC2=CC=CC=C2""",21,"""61AAA8EA1A3A9448"""
-"""BC3979EBF4729F01_CC10657911C0CF48_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)C2=CN=C(S2)N3CCCCC3""",21,"""61AAA8EA1A3A9448"""
-"""E4BFCAFC8218E69A_BAEE5C8C9D5D85E0_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NC(=NO2)C3=CC=CC(=C3)OC""",21,"""61AAA8EA1A3A9448"""
-"""FB48D58FDB517198_8827CC0B5006B5ED_6039_UN""","""O(CC1=NN=N[NH]1)CC(N2C3=C(CCC2C)C=CC=C3)=O""",21,"""61AAA8EA1A3A9448"""
-"""6E0177D1EB8D20A9_A43D5737FB150B99_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=C(CC(O)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""2A55FCFDBE0FFC69_1F6F35D1E1D64A53_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CC(=NO2)C3=CC=C(OC)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""C31B9BEF88BD9F06_F79D490E3C1379F6_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=C([N](CCOC)C(=C2)C)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""A0FDA120EC613DEB_6C047415B59DD5E0_6039_UN""","""O(CC1=NN=N[NH]1)CC3=C2N=CC=CC2=C([N](=O)=O)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""25261D6A947922A1_3A81B27D4934ED1D_6039_UN""","""O(CC1=NN=N[NH]1)CCC(NC2=CC=CC(=C2)[N](=O)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""C5DA568907C8B355_0E61938A2EE808A6_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2CCCCC2C(F)(F)F)=O""",21,"""61AAA8EA1A3A9448"""
-"""BF9D05A8F068DA60_73B8E2D133A948FA_6039_UN""","""O(CC1=NN=N[NH]1)CC(NNC(C2=CC=C(F)C=C2)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""E2FE29C0450A70AC_FFBF747459BC4157_6039_UN""","""O(CC1=NN=N[NH]1)CC(N2C(CC(CC2(C)C)=O)(C)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""85CC28E60D671662_020C29FF6327B3E6_6039_UN""","""O(CC1=NN=N[NH]1)CCCC(=O)NC2=CC=C(C=C2)C#N""",21,"""61AAA8EA1A3A9448"""
-"""0F345CFFEFD4D3DF_2C1EEC09EC079AC9_6039_UN""","""O(CC1=NN=N[NH]1)CCC(=O)NC2=CC3=C(C=C2)OCO3""",21,"""61AAA8EA1A3A9448"""
-"""000063020FB65A9F_ECF56BF6772847AF_6039_UN""","""O(CC1=NN=N[NH]1)CC(N(CC)CC2=CC(=CC=C2)F)=O""",21,"""61AAA8EA1A3A9448"""
-"""6734EC60915D1E63_4C2E659AD29BB60D_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C(O)=O)C=CC(=C2)F)=O""",21,"""61AAA8EA1A3A9448"""
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-"""AD9D08C907833095_3147448BD74159EC_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)C2=CC3=C(C=C2)NC(=O)CC3""",21,"""61AAA8EA1A3A9448"""
-"""F214CC69974624CB_195DA5613BA2A786_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC(CCC)C2=CC=CC=C2)=O""",21,"""61AAA8EA1A3A9448"""
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-"""24A20EBADC692BB8_2044875ED882A47F_6039_UN""","""O(CC1=NN=N[NH]1)CCCN3C(=O)C2=C(C=CC=C2)C3=O""",21,"""61AAA8EA1A3A9448"""
-"""4ABC1ED96607B00C_FBD3560EF0567C79_6039_UN""","""O(CC1=NN=N[NH]1)CC2=COC(=N2)C3=CC=C(OC)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""B496B9108971A206_7928FE5D70E23854_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC3=C2C=CC=NC2=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""F299CF609E2E2CAA_4A6C01036A4661E7_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCC2(N(C)C)CCCCC2)=O""",21,"""61AAA8EA1A3A9448"""
-"""EBCB5C35DCED8E13_C5B1C61CDC1B0AA1_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=C(C(=C(C)[NH]2)C(OC)=O)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""ABD581F9640D0329_4AF6CB2D70869413_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCCSC2=CC=C(C)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""9B5AF0073C131940_77AFD9959728E8EC_6039_UN""","""O(CC1=NN=N[NH]1)CCCCC[N]2C3=C(N=C2)C=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""9C8B41FE9D82B405_BCD46E29DD0D0059_6039_UN""","""O(CC1=NN=N[NH]1)CC3=NC2=C(N(C(N(C)C2=O)=O)C)[NH]3""",21,"""61AAA8EA1A3A9448"""
-"""0BDD95A8F4554CDD_C0F7FDC635852672_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCCOC2=CC=CC(=C2)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""A7680A155F7BB986_50A89196A4DCDC20_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC(C2=CC=C(CC)C=C2)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""596E81838809372A_A615E76FCB272CD8_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C)C=CC=C2[N](=O)=O)=O""",21,"""61AAA8EA1A3A9448"""
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-"""091D55CA7C7E65E8_7D5A4165EE29B9B6_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NCCCCC2=CC=CC=C2""",21,"""61AAA8EA1A3A9448"""
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-"""06058982A3B6265D_CFD8871E1BB6FB2F_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCC2=CC=C(N(C)C)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""D72C5E9107F6A7A7_ACD431BFBA152F67_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC(C)C2=C(C=C(C=C2)F)F)=O""",21,"""61AAA8EA1A3A9448"""
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-"""834AD0BD8AB8BE01_1E930AE7A6D0C223_6039_UN""","""O(CC1=NN=N[NH]1)CCCC(NC2=C(C)C=CC=C2C)=O""",21,"""61AAA8EA1A3A9448"""
-"""C29211528CD9C188_BC83E11BEFCA173C_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)N(CC2=CC=CC=C2)C3CC3""",21,"""61AAA8EA1A3A9448"""
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-"""98A0D8A3C026F373_6402D82FC43AC469_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCCOC2CCCCC2C)=O""",21,"""61AAA8EA1A3A9448"""
-"""A99EB4C56F32D989_453BE7848475EDFF_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NCC3CC2=C(C=CC=C2)O3""",21,"""61AAA8EA1A3A9448"""
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-"""F864CAC38074198C_941F9B1EBCB8D624_6039_UN""","""O(CC1=NN=N[NH]1)CCCOC3=C2C=CC=CC2=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""71080211058AC9C8_439FD1B964C54FF1_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C[N](CC(NC)=O)N=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""D30C3E1073C2107C_44CE2BE0485905F9_6039_UN""","""O(CC1=NN=N[NH]1)CCCC2=NN=N[N]2C3=CC=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""E04008D7E97E32B0_B8FCD1135DCCAC41_6039_UN""","""O(CC1=NN=N[NH]1)CC2=COC(=N2)C3=CC=C(C=C3)C#N""",21,"""61AAA8EA1A3A9448"""
-"""E3408D3502334252_9CEADFC053807054_6039_UN""","""O(CC1=NN=N[NH]1)CC3=NC=C(C2=CC=C(OC)C=C2)O3""",21,"""61AAA8EA1A3A9448"""
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-"""4070469CA6B1AE03_E69DE667AC2035D1_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C(C=CC=C2)OC3=CN=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""388C3AB65716DFCE_3BB57040E35BCC15_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NN=N[N]2C3=C(C=CC(=C3)C)F""",21,"""61AAA8EA1A3A9448"""
-"""957AFD05026F9CC8_4DF45C2567942670_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=CC=C(N[S](C)(=O)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""184816BB5E51139B_780FF0ADCC471534_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NC3=C(N(C)C2=O)C=CC(=C3)F""",21,"""61AAA8EA1A3A9448"""
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-"""6FFCC53D7B309902_142E0797DECBA491_6039_UN""","""O(CC1=NN=N[NH]1)CCCOC2=CC=CC(=C2)C(C)(C)C""",21,"""61AAA8EA1A3A9448"""
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-"""958A04ED17594674_E08736A2815B9339_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=CC=C(CCC(N)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""0CC307B14A48A9D6_969A2EBB3C4E301D_6039_UN""","""O(CC1=NN=N[NH]1)CCOC2=C(C=C(OC)C=C2)[N](=O)=O""",21,"""61AAA8EA1A3A9448"""
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-"""4DB720A7ED3AB178_B8F3D5B7C7EF7035_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)C2=C[N](N=C2)C3=CC=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""A3F96F540B877FC8_19351E78B2A155F9_6039_UN""","""O(CC1=NN=N[NH]1)CC3=NC=C(C2=C(OC)C=CC=C2)O3""",21,"""61AAA8EA1A3A9448"""
-"""3D90AA8C1CA9870C_3C13CA2B1078DCCA_6039_UN""","""O(CC1=NN=N[NH]1)CC2CC(=NO2)CCC3=CC=CC=C3""",21,"""61AAA8EA1A3A9448"""
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-"""56C79BD244BE8813_FCF03DEA4F3A2790_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NCCCOC2CCCCC2""",21,"""61AAA8EA1A3A9448"""
-"""367201A456BD526A_11AB0AD3EC0F054A_6039_UN""","""O(CC1=NN=N[NH]1)CCCN2C(CSC2=CC(OC)=O)=O""",21,"""61AAA8EA1A3A9448"""
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-"""30C1A0FF6490BB65_7DE21F6069712C56_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NC(=NO2)C3=CC(=C(F)C=C3)F""",21,"""61AAA8EA1A3A9448"""
-"""63618E3B31B3CE83_711CAC5B72B2A3A0_6039_UN""","""O(CC1=NN=N[NH]1)CCCCN(C)CC2=CC=C(C=C2)F""",21,"""61AAA8EA1A3A9448"""
-"""91C29C905036D005_638783A000A0D746_6039_UN""","""O(CC1=NN=N[NH]1)CC3=NC2=C(C=CC(=C2)C(F)(F)F)O3""",21,"""61AAA8EA1A3A9448"""
-"""08B2982BF7CDA074_F4C44ABF98F2B94C_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCC(C)(C)N2CCOCC2)=O""",21,"""61AAA8EA1A3A9448"""
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-"""61A4207ACC91EB2E_C5A878BE38C6F1F6_6039_UN""","""O(CC1=NN=N[NH]1)CC(N(C(C)C2=CC=C(C=C2)F)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""269A6389D7597B05_8DDEF9693D2C9CCE_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC(=O)OCC2=CC=CC=C2""",21,"""61AAA8EA1A3A9448"""
-"""8905E59ACBC4895E_F3DA294A75658425_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)N2CC(=O)NC3=C2C=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""1FA880EDE4CC0F8A_918D077DE69AF9E3_6039_UN""","""O(CC1=NN=N[NH]1)CC(N2CCCCC2C(OCC)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""40AA473B37AD33CE_4C41D77E0D61D5CB_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C(C=CC=C2)OC3=CC=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""BC709C32E04F276C_A51DCFDC30BD5B12_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC(C)C2=CC(=C(C=C2)C)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""287617F034749758_80F066620858751F_6039_UN""","""O(CC1=NN=N[NH]1)CC3=NN=C(C2=CC=C(OC)C=C2)O3""",21,"""61AAA8EA1A3A9448"""
-"""BCBC1D089E9060B9_C3A46ED5FF3497BB_6039_UN""","""O(CC1=NN=N[NH]1)CC(N(C(C)C2CC2)CC(F)(F)F)=O""",21,"""61AAA8EA1A3A9448"""
-"""5B99B6DE16C6CDFD_4A6E8465E2EBA6C4_6039_UN""","""O(CC1=NN=N[NH]1)CC(N(CCC)C2CC[S](=O)(=O)C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""D4656D4D712B2688_04EF6EAABF4FF129_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NCCCSC2=CC=CC=C2""",21,"""61AAA8EA1A3A9448"""
-"""9BC7FE0FD5D07EDA_70C40A17DD1EDB4E_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=C(C=C(NC(C)=O)C=C2)F)=O""",21,"""61AAA8EA1A3A9448"""
-"""AE70DE75C2112AB1_33CB68091C9D5B82_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC2=CC=N[N]2C3CCCC3""",21,"""61AAA8EA1A3A9448"""
-"""4335D3B49F0F0A72_D516514001FF707F_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC(NC2=C(F)C=CC=C2)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""B68DB50F09EF9B29_B8AEEB845EF8ED60_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NC(=NO2)C3=CC=C(CC)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""CD2877839F919E3A_8E6205353D2F4DBD_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CSC(=N2)COC3=CC=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""76ACBE8554D49CF9_B704204BAA1CF1EB_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C(OC(C)C)C=CC(=C2)[N](=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""37E61803E25A84F5_F7FA559FE2E26D69_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C(C(OCC)=O)C(OC2(C)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""BE25F4BE26162EB5_7A5579148A481853_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C(C(OC)=O)SC3=C2C=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""0DBC868E574320CF_A60CFED7AC24F02A_6039_UN""","""O(CC1=NN=N[NH]1)CCOC2=CC3=C(C=C2)NC(=O)CC3""",21,"""61AAA8EA1A3A9448"""
-"""EEB50B84C4A4A59B_509E6A2BCA64F532_6039_UN""","""O(CC1=NN=N[NH]1)CC2NC(NC(=C2C(OCC)=O)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""FCE420A2840467DE_6A3A4BDCE2D90C91_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CC=NC(=N2)C3=CC=C(F)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""B22B2573DC84058D_D2D8EAA18162ADE2_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC2=NN=C(O2)C3CCCO3""",21,"""61AAA8EA1A3A9448"""
-"""0F3E9C641302A5A1_6C8BDB115D96C991_6039_UN""","""O(CC1=NN=N[NH]1)CC(C3=CC2=C(N(C)C(=O)O2)C=C3)=O""",21,"""61AAA8EA1A3A9448"""
-"""FF4D44575A447A4D_65FB364721B6815F_6039_UN""","""O(CC1=NN=N[NH]1)CCCOC2=CC=C([S](C)(=O)=O)C=C2""",21,"""61AAA8EA1A3A9448"""
-"""B102B71A6F6AA182_BA130F80556BC0B0_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=NC(=CS2)CC(OC)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""1CAB0B88BC21977F_F35DCE4634905464_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C(C(OC)=O)OC3=C2C=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""ABFBB1FBC8E7A9DF_65035C914358D50F_6039_UN""","""O(CC1=NN=N[NH]1)CC(NNC(CC2=NC(=CS2)C)=O)=O""",21,"""61AAA8EA1A3A9448"""
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-"""E3FDDF3039D48616_5EBCB36C8A6688D2_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC2=C(C=CC=C2)SCC#N""",21,"""61AAA8EA1A3A9448"""
-"""45A0C684DB35505F_F50ABA227812BC12_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCC2=C([N](=O)=O)C=CC=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""F628B1751A9DDA65_9FBB08861660E077_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC2=NC(=CS2)C3=CC=CS3""",21,"""61AAA8EA1A3A9448"""
-"""FC1E3548FDA07191_A7E8B57F3E0B4C9B_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC2CCC3(CC2)OCCO3""",21,"""61AAA8EA1A3A9448"""
-"""61A234941B14665C_F5F08998749217BE_6039_UN""","""O(CC1=NN=N[NH]1)CCC(NC2=CC=C([N](=O)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""82810D38A96B5837_64B39A500B811ADF_6039_UN""","""O(CC1=NN=N[NH]1)CCC(NC2=CC=C(C(N)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""AE3C79F67955D238_A9266BADD707AF94_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CSC(=N2)C3=CC=C(CC)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""47C5DBF4CF0DE691_260BE2B0C3E3B224_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC2=CC3=C(C=C2)NC(=O)N3""",21,"""61AAA8EA1A3A9448"""
-"""5B5CFA526E61C7F0_F48DB841C8360738_6039_UN""","""O(CC1=NN=N[NH]1)CC(NN2C(NC(CC)(C)C2=O)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""D46ED6730EC268D6_306C403272C1315A_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCC(CC)C2=CC=CC=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""967DCA205DEDD0B9_BC189AE07FE2B516_6039_UN""","""O(CC1=NN=N[NH]1)CCN3C(=O)C2=C(C=CC=C2)[S]3(=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""068C740731A66E6F_BB5B2F247262DC1D_6039_UN""","""O(CC1=NN=N[NH]1)CCCC2=NC(=NO2)C3=CC=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""112A57F6CBC04D9D_ED1F3C79183A623B_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)C2=NN=C(O2)C3=CC=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""C3C162B49608AE91_CB2DEA7F4814835E_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC(C2=CC=C(OC)C=C2)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""8D5B9C2300900184_B24717C64B5B9A76_6039_UN""","""O(CC1=NN=N[NH]1)CC(NNC(C2=CC=C(C)C=C2)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""BF069F49D1460689_1D9712F2BC2B15B8_6039_UN""","""O(CC1=NN=N[NH]1)CCC(NC2=CC=C(OCC)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""52E0D5A1D4493637_21781DE56CC17D1F_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(F)C=C(C=C2)SC#N)=O""",21,"""61AAA8EA1A3A9448"""
-"""434335A32A45D193_5DC12B56E86A8356_6039_UN""","""O(CC1=NN=N[NH]1)CC(C3=CC2=C(N(C)C(=O)C2)C=C3)=O""",21,"""61AAA8EA1A3A9448"""
-"""105226BE2A3B4A8B_77A1B0AFEC0E46C3_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCC2=CC=C(COC)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""A42FF70A84329AFA_8A8663822A8CB6A7_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC(=N[N]2C(C)(C)C)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""B00E7BEE726F7D1B_C68DD954DEFF52EA_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2(C(OC)=O)CCCCC2)=O""",21,"""61AAA8EA1A3A9448"""
-"""D36156CBD7ECCC61_5C01D899B028D79F_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC2=NC(=CS2)C3=CC=CO3""",21,"""61AAA8EA1A3A9448"""
-"""1B2DE5DA7BAA8FB5_BD73CF72567A9CCE_6039_UN""","""O(CC1=NN=N[NH]1)CC#CC2=CC=C(OC(F)(F)F)C=C2""",21,"""61AAA8EA1A3A9448"""
-"""2BF448B26A601261_DD3B8E6776EAD8B5_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CC(=C(OC)C=C2)SC(F)(F)F""",21,"""61AAA8EA1A3A9448"""
-"""DD39212D380A42CF_3D04D619A541C188_6039_UN""","""O(CC1=NN=N[NH]1)CC3=NC2=C(C=CC(=C2)C(F)(F)F)S3""",21,"""61AAA8EA1A3A9448"""
-"""ABE0D4E95262585F_CABBC59E0E4B732D_6039_UN""","""O(CC1=NN=N[NH]1)CCC(NCC(C2=C(C)N=CS2)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""A652CF291665C660_72784997130EE0A7_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NN=C(C=C2)OC3=CC=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""743CF847EA2A2C18_804A27E27FF5D994_6039_UN""","""O(CC1=NN=N[NH]1)CCCC3=NC2=C(C=CC(=N2)OC)[NH]3""",21,"""61AAA8EA1A3A9448"""
-"""E8127ACDA73DF78B_861DCC668DA51889_6039_UN""","""O(CC1=NN=N[NH]1)CCN2C3=C(OC(C)C2=O)C=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""7B58591014F2CAEC_3AA7E2FD1F198F53_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=C(C(OC)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""BE47780514661EB4_8A4AA2B7850FF3FC_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC3=C2C=CC=CC2=CC=C3""",21,"""61AAA8EA1A3A9448"""
-"""575CCE9F721E4142_C86A2EC54396F56C_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=C(C(CC)C)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""094BE0D908815DF8_93B4248A54CA14D1_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(OC(F)F)C=CC=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""264422C890847686_6573339E4C846585_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=C([S](N)(=O)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""93B21DF7414EFB53_C3580FD3E7ED23AE_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC(=C(C=C2)F)[N](=O)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""EDA4EF8106649EC9_AA921102C8AA3178_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C=CC(=C2)OC)OC)=O""",21,"""61AAA8EA1A3A9448"""
-"""C2E8D250E0030D9C_B6A92EFAD1753705_6039_UN""","""O(CC1=NN=N[NH]1)CC[S](C2=CC=C([N](=O)=O)C=C2)(=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""4004BBC28E2107D5_4048AAB89EC5617F_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C(C)C)C=CC=C2C)=O""",21,"""61AAA8EA1A3A9448"""
-"""60A4E9B22ADE2590_D9FD6BD0B0D51190_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(CC)C=CC=C2CC)=O""",21,"""61AAA8EA1A3A9448"""
-"""C1BD95E32E8BEF97_B6FF06ED9F94789B_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC(=CC(=C2)OC)OC)=O""",21,"""61AAA8EA1A3A9448"""
-"""6A41386AC6EC02CD_32749C788DBF3BBE_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=C(C(C)(C)C)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""DC5970A7676ED339_3C1D7DD68EC29570_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NCC2=CC3=C(C=C2)OCO3""",21,"""61AAA8EA1A3A9448"""
-"""B4A73D45B1D11208_8184AD2FBCFEA3A7_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NC(=CS2)C3=C(F)C=CC=C3F""",21,"""61AAA8EA1A3A9448"""
-"""F93B6B767C4BFB00_ADED2193BBCDD201_6039_UN""","""O(CC1=NN=N[NH]1)CC3=NC2=CC(=C(C=C2[NH]3)OC)OC""",21,"""61AAA8EA1A3A9448"""
-"""3CC759B6AAD565EE_BFFF8D8FD5A361B1_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=C(NC(C)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
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-"""4CCC6AF0EEAED7FD_FE241A1A67978489_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C=CC(=C2)[N](=O)=O)F)=O""",21,"""61AAA8EA1A3A9448"""
-"""310169902E69C9DB_4CC1088434BC342D_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=CC(=C2)[S](N)(=O)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""B3B1188F988EF86D_750298330037FACD_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NN=N[N]2C3=CC=C(OC)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""F90195EB6B233A47_6EEF9961F6B88344_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2CCCN2C(C(F)(F)F)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""A1CFAF2D0F07DEDF_80102F0406F22831_6039_UN""","""O(CC1=NN=N[NH]1)CC(N(CCC(C)C)CCC(C)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""8CA9CB15BFC78A0E_79E5F1CB44A8A97E_6039_UN""","""O(CC1=NN=N[NH]1)CCC[S](C2=C(OC)C=CC=C2)(=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""7F4EAC69B7A7F8D2_B8F08DB726B75139_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=CC=C(C(OCC)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""3A181409712AB6BF_9EEC5D806A2EAFF6_6039_UN""","""O(CC1=NN=N[NH]1)CCN([S](C)(=O)=O)CC2=CC=CC=C2""",21,"""61AAA8EA1A3A9448"""
-"""BB6A31D5F9C6C130_BF69E825BBF8E060_6039_UN""","""O(CC1=NN=N[NH]1)CC3=N[N](C2=C(C=C(F)C=C2)F)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""4E9B836DE49009CC_5FE75279F5497DE5_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)CC34CC2CC(CC(C2)C3)C4""",21,"""61AAA8EA1A3A9448"""
-"""B811D34EE08CCE98_5C3BBDE10EC6745A_6039_UN""","""O(CC1=NN=N[NH]1)CC(N[S](C2=CC=C(C)C=C2)(=O)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""861347BCD0004B0D_B4DC4EDD0139ED7B_6039_UN""","""O(CC1=NN=N[NH]1)CCC(=O)C2=CC3=C(C=C2)OCCO3""",21,"""61AAA8EA1A3A9448"""
-"""63C5780034D9D618_4AD1BDA11E8DC2D7_6039_UN""","""O(CC1=NN=N[NH]1)CC(CC2=CC=C(OC(C)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""956197E7045C78F4_F21A7A745249B0E2_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=CC=C(OCCCC)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""B3CC0CEE46D2F63D_FF1E874B63B467FF_6039_UN""","""O(CC1=NN=N[NH]1)CCC3=C(C)N=C2C=CC=CN2C3=O""",21,"""61AAA8EA1A3A9448"""
-"""6CD413DA12FB6CD5_5F841EC0F2058FF6_6039_UN""","""O(CC1=NN=N[NH]1)CC(N2CCC(C(OCC)=O)CC2)=O""",21,"""61AAA8EA1A3A9448"""
-"""AF929E6A7247F9D4_B6477FF9A0AEB5F4_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NOC(=C2)C3=CC=CC(=C3)OC""",21,"""61AAA8EA1A3A9448"""
-"""2CD7B952AB0AF188_29E4ABEAC92FB956_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C(C=CC(=C2)[N](=O)=O)C(F)(F)F""",21,"""61AAA8EA1A3A9448"""
-"""874D6BC6ACE97396_1E6A1A517C08186E_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC2=CC3=C(C=C2)OCCO3""",21,"""61AAA8EA1A3A9448"""
-"""40DA24980215D131_65BFF41A20B30E9E_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C)C=CC=C2C(=O)O)=O""",21,"""61AAA8EA1A3A9448"""
-"""40027C20A0B05CC1_88A892C088A945CE_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NC(=NO2)C3=CC(=NC=N3)OC""",21,"""61AAA8EA1A3A9448"""
-"""43DEB0B55F362260_9FA14D1E75892B55_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC3=NC2=C(C=C(F)C=C2)S3)=O""",21,"""61AAA8EA1A3A9448"""
-"""4A1477AB81F916A0_26F092448172AB4E_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCCC2=C(OC)C=CC=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""D7F934EA178D1CDF_880D786D390A0823_6039_UN""","""O(CC1=NN=N[NH]1)CCC(NC2=C(OCC)C=CC=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""34FE4363BA108EFA_62A260A0109C9CD1_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CC(=C(C=C2)N3CCCCC3)C""",21,"""61AAA8EA1A3A9448"""
-"""0AE8DAB64F51EC39_B6E41357F1DDC796_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C(C=CC(=C2)OC)OC(F)(F)F""",21,"""61AAA8EA1A3A9448"""
-"""4114AD9A332B1035_DA42D9ACDCC062F3_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CC=C(C=C2)C(=O)N3CCCC3""",21,"""61AAA8EA1A3A9448"""
-"""FF9364A4BCEFE0A0_C8D510BF25AA6F12_6039_UN""","""O(CC1=NN=N[NH]1)CCNC(=O)NC2=CC(=CC=C2)C#N""",21,"""61AAA8EA1A3A9448"""
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-"""6B57E01EE5758FB8_56DF39332B870CE0_6039_UN""","""O(CC1=NN=N[NH]1)CCC(=O)N3CCC2=C(C=CC=C2)C3""",21,"""61AAA8EA1A3A9448"""
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-"""ACDEF0851885217A_615CD9CD36212295_6039_UN""","""O(CC1=NN=N[NH]1)CC3=N[N](C2=C(F)C=CC=C2F)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""75D757C1B3837B59_744D1B9CE14391C2_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC2=C(C=CC=C2)SCC=C""",21,"""61AAA8EA1A3A9448"""
-"""19601901D360277C_372FB99F355048EC_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NC(=NO2)C3=CC(=C(C=C3)F)C""",21,"""61AAA8EA1A3A9448"""
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-"""028A676E6BA28BCF_3ABEF0B50B403312_6039_UN""","""O(CC1=NN=N[NH]1)CCCOC2=CC=CC(=C2)C(F)(F)F""",21,"""61AAA8EA1A3A9448"""
-"""2CB1EB03D2979FC6_EE052D59CBDBD955_6039_UN""","""O(CC1=NN=N[NH]1)CC(N(CC)CC2=CC(=CC=C2)C)=O""",21,"""61AAA8EA1A3A9448"""
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-"""E72345EF63304392_D8FC642C7F130C6E_6039_UN""","""O(CC1=NN=N[NH]1)CC2=N[N](C=C2)CCC3=CC=CC=C3""",21,"""61AAA8EA1A3A9448"""
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-"""7F1905D70A650AA8_31B94FA956781340_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2CCC(C(F)(F)F)CC2)=O""",21,"""61AAA8EA1A3A9448"""
-"""6C84C1CEB7D06B41_988F09EEB88338C6_6039_UN""","""O(CC1=NN=N[NH]1)CCON3C(=O)C2=C(C=CC=C2)C3=O""",21,"""61AAA8EA1A3A9448"""
-"""B973FA7A2F515AA5_B4D9705D64E693D9_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NC2=NN=C(O2)C3=CC=CO3""",21,"""61AAA8EA1A3A9448"""
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-"""969E5963E78A4F00_CF8B2E8ABBBDDAF0_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CC(=CC=C2)CN3CCCCC3""",21,"""61AAA8EA1A3A9448"""
-"""0D7D91BD4CF1A53B_725246D09224C1AA_6039_UN""","""O(CC1=NN=N[NH]1)CC2=CC=C(C=C2)CN3CCCCC3""",21,"""61AAA8EA1A3A9448"""
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-"""9736BF2E1CFAEEF9_628C33D11E039519_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC(=C(C)C=C2)[N](=O)=O)=O""",21,"""61AAA8EA1A3A9448"""
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-"""E16699DD44C85576_685A65C4B78AE52E_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=C(OC(F)F)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
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-"""CB958BD49EED55FF_C5A0C4991858EB1D_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C(C)(C)C)C=CC=C2)=O""",21,"""61AAA8EA1A3A9448"""
-"""9CE43DC949581439_262464481B6EE9EB_6039_UN""","""O(CC1=NN=N[NH]1)CC(N(C(C)C)CC2=CC=CC=C2)=O""",21,"""61AAA8EA1A3A9448"""
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-"""EBE49AE6B52BE7E7_1122D1ACC69A1B7F_6039_UN""","""O(CC1=NN=N[NH]1)CC3=NC2=CC=CC(=C2[S](N3)(=O)=O)F""",21,"""61AAA8EA1A3A9448"""
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-"""CB2AD24FBF527F4B_9D24A52CF1AB756D_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NC=CC(=C2C)OCC(F)(F)F""",21,"""61AAA8EA1A3A9448"""
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-"""703AB0A73B63947D_66D620B6C9C40F97_6039_UN""","""O(CC1=NN=N[NH]1)CC#CC2=CC=CC(=C2)OCCOC""",21,"""61AAA8EA1A3A9448"""
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-"""17468957125202BE_867862B679E006B8_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=CC(=C2)C(OC)=O)=O""",21,"""61AAA8EA1A3A9448"""
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-"""9CB687DDA99EE7A6_0E863E23D12DF429_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC(C2=C(OC)C=CC=C2)C)=O""",21,"""61AAA8EA1A3A9448"""
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-"""14CCB0711F62DFA1_848F9534A7AA947A_6039_UN""","""O(CC1=NN=N[NH]1)CC2=COC(=N2)C3=CC(=C(F)C=C3)F""",21,"""61AAA8EA1A3A9448"""
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-"""5717D4BBAB483E22_377C7A068B292931_6039_UN""","""O(CC1=NN=N[NH]1)CC(N2CCN(C(OCC)=O)CC2)=O""",21,"""61AAA8EA1A3A9448"""
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-"""EC65D753CECB6DF5_49668B30D0BECFBB_6039_UN""","""O(CC1=NN=N[NH]1)CC2=NC(=NO2)C3=NN=C(OC)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""C20E6FAA3B489FCF_9DF672865BE4608F_6039_UN""","""O(CC1=NN=N[NH]1)CCC(NC(NCCC(F)(F)F)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""0CDFA2EE0CA7D6DC_86BA1E37DB4FF2AE_6039_UN""","""O(CC1=NN=N[NH]1)CCCNC(=O)OCC2=CC=CC=C2""",21,"""61AAA8EA1A3A9448"""
-"""6530C602754BDD9E_FA2FDE98CBCEFCF1_6039_UN""","""O(CC1=NN=N[NH]1)CCCC2=CC=CC(=C2)OC(F)(F)F""",21,"""61AAA8EA1A3A9448"""
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-"""865112BDBA528D86_76FCB223551794B1_6039_UN""","""O(CC1=NN=N[NH]1)CC3=CC=C(C2(C(OC)=O)CC2)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""CCDD07A1EE43115B_C236FACF6FC4CD6C_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C3C(=C(C)N=C2)OC(OC3)(C)C""",21,"""61AAA8EA1A3A9448"""
-"""481097C954388E97_C0B596C3D622557A_6039_UN""","""O(CC1=NN=N[NH]1)CC3=N[N]2CCCCC2=C3C(OC)=O""",21,"""61AAA8EA1A3A9448"""
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-"""10822C7CEE0820DE_A6E11C4019FC3022_6039_UN""","""O(CC1=NN=N[NH]1)CC(C(C2=CC=C(OC)C=C2)=O)(F)F""",21,"""61AAA8EA1A3A9448"""
-"""BB842AA4C613C709_35C09181EC67DD3E_6039_UN""","""O(CC1=NN=N[NH]1)CC2=COC(=N2)C3=CC=CC(=C3)OC""",21,"""61AAA8EA1A3A9448"""
-"""C2A4DEEF32D65C9C_CDD010596F8AD0E5_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C=C(OC)C=C2)OC)=O""",21,"""61AAA8EA1A3A9448"""
-"""1C7ED6DA6BA5D2F3_1645481A3D4F22FE_6039_UN""","""O(CC1=NN=N[NH]1)CCC2=CC=C([S](N(C)C)(=O)=O)C=C2""",21,"""61AAA8EA1A3A9448"""
-"""D72884E5C9BB3DB0_66258F4B6CE942FA_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC3=C(C=C2)[NH]C(=N3)C)=O""",21,"""61AAA8EA1A3A9448"""
-"""32C060AA086F256B_B0A5AE82112B9970_6039_UN""","""O(CC1=NN=N[NH]1)CC(C2=CC=C(C(F)(F)F)C=C2)(F)F""",21,"""61AAA8EA1A3A9448"""
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-"""46FA7D31E8A062E2_E6D35477642C5997_6039_UN""","""O(CC1=NN=N[NH]1)CC(NCC(C2=C(F)C=CC=C2)=O)=O""",21,"""61AAA8EA1A3A9448"""
-"""09230AFA3C37879B_73ACE2E8270B3AC6_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C[N]3C(=N2)C=C(C(F)(F)F)C=C3""",21,"""61AAA8EA1A3A9448"""
-"""A7BF21907F698D3F_FC496CC3D8D11544_6039_UN""","""O(CC1=NN=N[NH]1)CC(=O)NNC(=O)CC2=CC=CC=C2""",21,"""61AAA8EA1A3A9448"""
-"""F1210072C0BF71BF_031579959F69CC25_6039_UN""","""O(CC1=NN=N[NH]1)CC3=CC2=C(C=C(C(OCC)=O)S2)S3""",21,"""61AAA8EA1A3A9448"""
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-"""E5CFE7C22A3194CF_42DB9E6DA78ACFF1_6039_UN""","""O(C1CC(NC(=O)C(F)(F)F)C2=C1C=CC=C2)CCC#C""",21,"""6D2B73A4852BF310"""
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-"""A0826701992270D1_8B2BC1319F86192F_6039_UN""","""O(C1CC(NC(=O)C(F)(F)F)C2=C1C=CC=C2)C[C@@H]3CO3""",21,"""6D2B73A4852BF310"""
-"""4872204F907E0E45_C0EC87DC0D247130_6039_UN""","""O(C1CC(NC(=O)C(F)(F)F)C2=C1C=CC=C2)CC(F)F""",21,"""6D2B73A4852BF310"""
-"""76C5DBC606BD130E_A91512AD85520174_6039_DP""","""O(C1CC(NC(=O)C(F)(F)F)C2=C1C=CC=C2)CCCN""",21,"""6D2B73A4852BF310"""
-"""146D009894D6024D_DF7B468D390DF859_6039_UN""","""O(C1CC(NC(=O)C(F)(F)F)C2=C1C=CC=C2)CC(C)F""",21,"""6D2B73A4852BF310"""
-"""7B160884294BD2C6_843AE7E85798A95F_6039_UN""","""O(C1CC(NC(=O)C(F)(F)F)C2=C1C=CC=C2)CCCF""",21,"""6D2B73A4852BF310"""
-"""4586C1DF371D74FF_0DB31A1AA8ED6CFB_6039_UN""","""O(C1CC(NC(=O)C(F)(F)F)C2=C1C=CC=C2)CCSC""",21,"""6D2B73A4852BF310"""
-"""3623E1106108CB5C_9E1ED04EFCD2088F_6039_UN""","""O(C1CC(NC(=O)C(F)(F)F)C2=C1C=CC=C2)CC3CS3""",21,"""6D2B73A4852BF310"""
-"""1FEC36D26357BE5F_7C0EAF625DDF0743_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(NOC)=O""",21,"""B1F9679D8E316FC0"""
-"""C7BC3F7BCFB8DE07_C38B26DAAFF29C25_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC(OC)=O""",21,"""B1F9679D8E316FC0"""
-"""23FBBB14AC133D50_468C7DF2E149BA94_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(OC)OC""",21,"""B1F9679D8E316FC0"""
-"""91A45C86519326B0_0C7E11A26F173F3B_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(C(O)=O)=O""",21,"""B1F9679D8E316FC0"""
-"""5387BAAAF34A83BE_4934692B7D62144E_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCOC(C)C""",21,"""B1F9679D8E316FC0"""
-"""50829C350F16BF14_CF0330CD309B0457_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3OCCO3""",21,"""B1F9679D8E316FC0"""
-"""FD4BA03BFAF3A644_679411668AA209A0_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3CCCO3""",21,"""B1F9679D8E316FC0"""
-"""61C1F4108D82C95A_576A9B4095B2D244_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC(NC)=O""",21,"""B1F9679D8E316FC0"""
-"""25E55BDD940DF03A_0A8D9F04F00E5A14_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCN=C=O""",21,"""B1F9679D8E316FC0"""
-"""2609CFDBBBBF2EE3_FEF7F44724B06270_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NC=NO3""",21,"""B1F9679D8E316FC0"""
-"""46343D78094970E2_D3813B91177CB5F2_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(=O)C3CC3""",21,"""B1F9679D8E316FC0"""
-"""46AE85F029F49907_E00CA376DC4CFF02_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(CCC)=O""",21,"""B1F9679D8E316FC0"""
-"""64D838AE344C3245_6878E5D9418B5296_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(C(C)C)=O""",21,"""B1F9679D8E316FC0"""
-"""A1AE5B05B9350BEF_72D52D3ACD3F48F1_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCCOC""",21,"""B1F9679D8E316FC0"""
-"""D563455C772F1810_A92B7D249E12CCBE_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCN(C)C""",21,"""B1F9679D8E316FC0"""
-"""D0E5740DBCDAA0EE_629AAB89C15C0701_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCOCC""",21,"""B1F9679D8E316FC0"""
-"""3854B715D35F9A12_4926AE22B2415217_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCC(C)=O""",21,"""B1F9679D8E316FC0"""
-"""0BDEB1965CB9E7DB_8B91CA6BFF501BC2_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NOC=N3""",21,"""B1F9679D8E316FC0"""
-"""796E279B76D2A7DE_D197DD1BEC91A4CB_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC(C)(C)C""",21,"""B1F9679D8E316FC0"""
-"""0FA187EB83CE1FFE_64BAF33C268C1B1F_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CSC=N3""",21,"""B1F9679D8E316FC0"""
-"""DA4181B6654955E4_FEB4305455A59D52_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NN=N[NH]3""",21,"""B1F9679D8E316FC0"""
-"""6D8425D18488DCE2_F923CE2291096954_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COC[CH]=[C]3C[CH2]C3""",21,"""B1F9679D8E316FC0"""
-"""13246A284F6B0264_F5069208D79E742C_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(N(C)C)=O""",21,"""B1F9679D8E316FC0"""
-"""67819A2EB9ADACBF_FB1D3A8047AA7F91_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC#CCOC""",21,"""B1F9679D8E316FC0"""
-"""E7775A045AB8DF0C_4FD822E857C41D10_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC(Cl)(Cl)Cl""",21,"""B1F9679D8E316FC0"""
-"""5ED2E2D1BAB72F55_D0A7C2A7C4C6DC58_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCC(O)=O""",21,"""B1F9679D8E316FC0"""
-"""0ECACE6881C6C973_7FB35003FE220810_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=C[NH]C=N3""",21,"""B1F9679D8E316FC0"""
-"""88B55EC2FEDDE0A3_D8705C63CD98BD64_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC=CCC""",21,"""B1F9679D8E316FC0"""
-"""193F7C26C8A79A9C_B081BBD230D26A57_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCC(C)C""",21,"""B1F9679D8E316FC0"""
-"""87BE9F604676B8E2_500C0613D70E6779_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCOCCN""",21,"""B1F9679D8E316FC0"""
-"""D41C6EA8B2B1C01E_F8D2DC4EDC476EBA_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC(NO)=O""",21,"""B1F9679D8E316FC0"""
-"""5A1F028FCB99EE70_72E6636560AEFE7D_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=C[NH]N=C3""",21,"""B1F9679D8E316FC0"""
-"""2FAEADF384BAB609_693B0D5CD9E6321E_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC[S](C)(=O)=O""",21,"""B1F9679D8E316FC0"""
-"""33C0491862CACA7C_BA443316A3CA5FF8_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(COC)=O""",21,"""B1F9679D8E316FC0"""
-"""1AD52A265BE8FA06_28934134AC2B1672_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC3CNC3""",21,"""B1F9679D8E316FC0"""
-"""EBF1F7439D538CED_25698074636D6D94_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCCCF""",21,"""B1F9679D8E316FC0"""
-"""1EC847428BF74509_7B4E6571CEF2736C_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCSC(C)C""",21,"""B1F9679D8E316FC0"""
-"""1607CE25B982C686_36F68FD9124917D9_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=C[NH]N=N3""",21,"""B1F9679D8E316FC0"""
-"""C416F029DEE87709_BD778D582FA8254D_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(OCC)=N""",21,"""B1F9679D8E316FC0"""
-"""D202A4EC923C64AE_672BC55B1B9A1F0E_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CC=N[NH]3""",21,"""B1F9679D8E316FC0"""
-"""1DD0011FB01CD51B_29FBA123752374DC_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(C(C)=O)=O""",21,"""B1F9679D8E316FC0"""
-"""7C3D71E2060B4A14_31DBB9FA1914A736_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CN=NS3""",21,"""B1F9679D8E316FC0"""
-"""054F553CCDDA9D32_07F1BED87E4B6277_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC[S](F)(=O)=O""",21,"""B1F9679D8E316FC0"""
-"""E7E13974ACD3AE89_8F8A4EBDBC99A9CE_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COC[C@H]3CCCO3""",21,"""B1F9679D8E316FC0"""
-"""891BA519755C9269_5CDB8A2BF1BF0476_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC[Si](C)(C)C""",21,"""B1F9679D8E316FC0"""
-"""DB43FD20CE7EA1AC_E1CABAE939F558A3_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(NCC)=O""",21,"""B1F9679D8E316FC0"""
-"""E07E523ED1F5A257_4640FCCE4D73EDBD_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCOCC=C""",21,"""B1F9679D8E316FC0"""
-"""F26245888205CCD3_C21086AECC6A6514_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CSC=C3""",21,"""B1F9679D8E316FC0"""
-"""D100A9F48A192E91_D7D69EA7B5B65FF6_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=COC=C3""",21,"""B1F9679D8E316FC0"""
-"""94E525ED51893923_ABBF6CD32E1A8607_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC#CC(O)=O""",21,"""B1F9679D8E316FC0"""
-"""C080F56A5A7EC496_40E2F717B14737B7_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NC=C[NH]3""",21,"""B1F9679D8E316FC0"""
-"""F63DD1458515D6E0_F28059B9401560AF_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CSN=N3""",21,"""B1F9679D8E316FC0"""
-"""CCA5BEDCCF74C502_82A7324FCEE13340_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NON=C3""",21,"""B1F9679D8E316FC0"""
-"""A6BA48874FF0ADA0_D28D5450F48A07FB_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NOC=C3""",21,"""B1F9679D8E316FC0"""
-"""CAA89031292954C0_FD47746F35C40E4E_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCCC=C""",21,"""B1F9679D8E316FC0"""
-"""508283677554FE1E_2C4B22802DC2B6D7_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NSN=C3""",21,"""B1F9679D8E316FC0"""
-"""E12EE6D5B0C4A770_53B711221E58FB97_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CC=NO3""",21,"""B1F9679D8E316FC0"""
-"""7AD6753B1898B2C3_40EA737D3137391C_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CON=C3""",21,"""B1F9679D8E316FC0"""
-"""F36034C027E87A77_16674208855E79DC_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3COCO3""",21,"""B1F9679D8E316FC0"""
-"""BA19B280BA23B7F7_80D10B8CDB381FA5_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCSC(C)=O""",21,"""B1F9679D8E316FC0"""
-"""62AF00E3B6ACD0D7_7A41800B965BFB9A_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(CC)OC""",21,"""B1F9679D8E316FC0"""
-"""B2AC1A0CCCC75546_2C447E14E30247A4_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NN=CO3""",21,"""B1F9679D8E316FC0"""
-"""3D903A4CBD67EDEA_801ED1CD5E62A68B_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC(F)(F)Cl""",21,"""B1F9679D8E316FC0"""
-"""977163ED0CA10FAF_A7B0E4F00E102663_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC[S](O)(=O)=O""",21,"""B1F9679D8E316FC0"""
-"""809F89CF3A8FFB8D_555B2F2DC783E6E6_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCOC3CC3""",21,"""B1F9679D8E316FC0"""
-"""7A644487A01A7396_9CB9C82FEBE65025_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CN=CS3""",21,"""B1F9679D8E316FC0"""
-"""2999DF20CD8D9A02_62CF2C51F7EDDBC1_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CC=NS3""",21,"""B1F9679D8E316FC0"""
-"""0FC8C8D90E33D514_A578DDA2E7B9CF36_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3CC(=O)O3""",21,"""B1F9679D8E316FC0"""
-"""2B0B0888A1110F04_98C184947AFE188D_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCOC(C)=O""",21,"""B1F9679D8E316FC0"""
-"""F52BCC554DDEE798_8E8506E6928E06E6_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCOCC#C""",21,"""B1F9679D8E316FC0"""
-"""3CC1844AA6A21E6C_32AE77F92C1C7EF9_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(CC)(F)F""",21,"""B1F9679D8E316FC0"""
-"""28DAA004402115B7_592F69D295116E5E_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COC[C@H]3CCCN3""",21,"""B1F9679D8E316FC0"""
-"""23FA1326260714EA_8A2CE692DD70B237_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3OC3(C)C""",21,"""B1F9679D8E316FC0"""
-"""EA27B077AD8E594E_4E5DB304D856BB2E_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(C=CO)=O""",21,"""B1F9679D8E316FC0"""
-"""581419B2EDEE1698_6C5643B3A859471A_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CSN=C3""",21,"""B1F9679D8E316FC0"""
-"""828B05B3D62433B7_8B86560146874880_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NCCO3""",21,"""B1F9679D8E316FC0"""
-"""6FBA3FD5E83C0F3F_173EC864E4DEF9E2_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NN=CS3""",21,"""B1F9679D8E316FC0"""
-"""228544AA9E66E985_668B1923B72C5DB2_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCC3CC3""",21,"""B1F9679D8E316FC0"""
-"""32AC9B92D7D42B8F_38FA3EB86889D23C_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(C(F)F)=O""",21,"""B1F9679D8E316FC0"""
-"""0E4B9B1DF9D2AB72_17F7644C522A8C34_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NOCC3""",21,"""B1F9679D8E316FC0"""
-"""113D0EFD9BD0D263_26A407571C524346_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(OCC)=O""",21,"""B1F9679D8E316FC0"""
-"""CD7B77894D1A9B23_75DC10B47B290B46_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC[S](N)(=O)=O""",21,"""B1F9679D8E316FC0"""
-"""BE203788695E43BF_53D816445A7E38FF_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCCC#N""",21,"""B1F9679D8E316FC0"""
-"""7F9EED202BFC8966_AC89D4B1B3C3A57A_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC=CC=C""",21,"""B1F9679D8E316FC0"""
-"""CD42CD4332B348B0_7BD517B5CA3821E1_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCNC(C)=O""",21,"""B1F9679D8E316FC0"""
-"""855CBB28575E23ED_368729D0CB8BEC50_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC[S](=O)(=O)Cl""",21,"""B1F9679D8E316FC0"""
-"""F4F1558E6DAB1261_7877763D4562F13D_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCCCC""",21,"""B1F9679D8E316FC0"""
-"""F3D43847E56E4B7C_6933EB571408DD2D_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC(CC)C""",21,"""B1F9679D8E316FC0"""
-"""E6B23D49218544E9_5E52047DB6CECBED_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCC(C)=C""",21,"""B1F9679D8E316FC0"""
-"""1728B1F619840538_E179711576CFB324_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(=C)CC#N""",21,"""B1F9679D8E316FC0"""
-"""E1AB785CE639197F_9055E2063CF5FE21_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCC(F)F""",21,"""B1F9679D8E316FC0"""
-"""45834C60C10F765C_3546B5C24237734D_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC=C(C)C""",21,"""B1F9679D8E316FC0"""
-"""1ACAAF17A8EA1327_8BCFD0E10B3DB895_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC=C(C)C#N""",21,"""B1F9679D8E316FC0"""
-"""0950EEF00C392A5F_12669E1A34E2BDE9_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(NCO)=O""",21,"""B1F9679D8E316FC0"""
-"""D4A8A1618C11C640_5F632C61EB6E332D_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCOC(F)F""",21,"""B1F9679D8E316FC0"""
-"""75C2274FEFF27DAA_5F01CB79831ECE9F_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC3(C)CC3""",21,"""B1F9679D8E316FC0"""
-"""46494DCEBEBEDEA7_3DCBAF638D9F5919_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC#CC3CC3""",21,"""B1F9679D8E316FC0"""
-"""232DDE9A14B0ACB2_FCD26AD259577F2B_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC3COC3""",21,"""B1F9679D8E316FC0"""
-"""FB8B2736E9728839_70C8BB6BCB8AEE53_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCC(N)=O""",21,"""B1F9679D8E316FC0"""
-"""DD5F46E966639BEC_54E5C9C81FD28222_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC(C)(F)F""",21,"""B1F9679D8E316FC0"""
-"""3CBC567E6B6F9375_D3BAD25CA870ACD1_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC3(C)N=N3""",21,"""B1F9679D8E316FC0"""
-"""3D80F3F737022D5D_E3AFB53908AEF717_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3CCCN3""",21,"""B1F9679D8E316FC0"""
-"""6B1BE8C6F87CAF8C_F0ED1C812D1E4F37_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC([C@@H](C)N)=O""",21,"""B1F9679D8E316FC0"""
-"""E8CE380B5731A9CA_D90A55C5846B8F20_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCN3CCC3""",21,"""B1F9679D8E316FC0"""
-"""A16FB39BADC2584B_1642A9F31ACB10D8_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=N[NH]C=C3""",21,"""B1F9679D8E316FC0"""
-"""F632DDF2CC3214E7_C9CF06A29FA264B5_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC(C)(C)F""",21,"""B1F9679D8E316FC0"""
-"""20F9020E9CFFC449_0B1BAE6AF4783416_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(C(C)C)N""",21,"""B1F9679D8E316FC0"""
-"""A3F6C637BF7492A1_87868571E911E7EC_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCN=[N]#N""",21,"""B1F9679D8E316FC0"""
-"""4F250C6EA84BAB49_B3A280E1B30CC6DF_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC[N+](C)(C)C""",21,"""B1F9679D8E316FC0"""
-"""55B44A3B345B1508_D512D1142747B7F8_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCCCO""",21,"""B1F9679D8E316FC0"""
-"""96F07528A071DF38_A765ED849073CDF0_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCOCCC""",21,"""B1F9679D8E316FC0"""
-"""E5ACC6C2207D3A84_CD241F364803B80D_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NC=CS3""",21,"""B1F9679D8E316FC0"""
-"""C0C82458C7FFAE47_AC9AB53537149945_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=NSC=C3""",21,"""B1F9679D8E316FC0"""
-"""C114DEC8FF1651AE_1003167C70ADCE51_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCCC#C""",21,"""B1F9679D8E316FC0"""
-"""7D33CE969B21067D_973CA8A11B84D690_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(C)N(C)C""",21,"""B1F9679D8E316FC0"""
-"""F52A189834F1DD19_556B11BA29400D6F_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCC3CO3""",21,"""B1F9679D8E316FC0"""
-"""9C3A2B90B8DFA77C_C91279803B525D3E_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCC3CCC3""",21,"""B1F9679D8E316FC0"""
-"""D67EF31CAD62DDFE_BAC5D7C02DF29BDD_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCNC3CC3""",21,"""B1F9679D8E316FC0"""
-"""518FBEDC2887917F_AE8DC2CDA1F9882C_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCN(CC)C""",21,"""B1F9679D8E316FC0"""
-"""8DA3413499EBBAA9_1BC05238C46A4029_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3OC3CC""",21,"""B1F9679D8E316FC0"""
-"""4DCF49C7FFBFC0DA_E7F8C7A560AB0FDE_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCC=CC""",21,"""B1F9679D8E316FC0"""
-"""629279A3E8A6AB93_3AA397770DA8E8A4_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=N[NH]C=N3""",21,"""B1F9679D8E316FC0"""
-"""AE5B377EDE846108_9622F8CFC57F0F23_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC3=CN=CO3""",21,"""B1F9679D8E316FC0"""
-"""6851D7029BDFC3FC_07DD3BEC546ED9D9_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC(=O)C(Cl)Cl""",21,"""B1F9679D8E316FC0"""
-"""B945A481EC4AF48B_45A072E1C18F4162_6039_DP""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC([C@H](C)N)=O""",21,"""B1F9679D8E316FC0"""
-"""855CBB28575E23ED_CA88B10D1FCD3339_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCC[S](Cl)(=O)=O""",21,"""B1F9679D8E316FC0"""
-"""9F83B81795C06E06_A2A0EDA39CE2B49C_6039_UN""","""COC(=O)C1=CC2=C(C=C1)[NH]C(=N2)COCCCSCC""",21,"""B1F9679D8E316FC0"""
-"""C66D810FD685E22E_E66A8C23A09F1214_6039_DP""","""N1CC2CC1CC2OCC(=O)NCCCN3CCCC3=O""",21,"""1B2F00471B47237C"""
-"""5DF1A99EA88175FD_2906D9525C4571A5_6039_DP""","""N1CC2CC1CC2OCC(=O)NCCOC3=CC=CC=C3""",21,"""1B2F00471B47237C"""
-"""8911BC9BC0DAFC93_28F0370E291AB9B0_6039_DP""","""N1CC2CC1CC2OCCCC(OC3=CC=C(F)C=C3)=O""",21,"""1B2F00471B47237C"""
-"""F834BCF3A63F9DB6_807086A8B4371F35_6039_DP""","""N1CC2CC1CC2OCC3=NOC(=N3)C4=CC=C(C)C=C4""",21,"""1B2F00471B47237C"""
-"""71092ED64AFE1984_BFBA3458042829DE_6039_DP""","""N1CC2CC1CC2OCCC(NC3=C(SC)C=CC=C3)=O""",21,"""1B2F00471B47237C"""
-"""9DAF5939B50BC434_D5BDC8444FD6D4F6_6039_DP""","""N1CC2CC1CC2OCC3=C(C(OCC)=O)CNC(N3)=O""",21,"""1B2F00471B47237C"""
-"""8FDE836287F0AD25_4E82A0A8172CD00A_6039_DP""","""N1CC2CC1CC2OCC(=O)NC4=C3N=[S]=NC3=CC=C4""",21,"""1B2F00471B47237C"""
-"""FFECAB7052293EE6_A03494B06A404FB3_6039_DP""","""N1CC2CC1CC2OCCOC3=CC=C(OCCC)C=C3""",21,"""1B2F00471B47237C"""
-"""1FE2F53D5A8F992A_309D1BEFC3ACAAB3_6039_DP""","""N1CC2CC1CC2OCC(=O)NC4=NC3=C(C=CC=C3)S4""",21,"""1B2F00471B47237C"""
-"""BB7C72D9C5F50DE3_DF440C2E235EE99C_6039_DP""","""N1CC2CC1CC2OCC(N(CC)CC3=CC=CC=C3)=O""",21,"""1B2F00471B47237C"""
-"""BCD7B2F19B30B2BC_54E2787B66023C5E_6039_DP""","""N1CC2CC1CC2OCC(=O)C4=C3C=CC=CC3=CC=C4""",21,"""1B2F00471B47237C"""
-"""8F3D0A9D5C3CBA5C_E34A142CFE642338_6039_DP""","""N1CC2CC1CC2OCC(=O)NCCCC3=CC=CC=C3""",21,"""1B2F00471B47237C"""
-"""2C87D08E2E149BCE_DAF5668D29D8D60F_6039_DP""","""N1CC2CC1CC2OCC(C3=CC=CC(=C3)C(F)(F)F)=O""",21,"""1B2F00471B47237C"""
-"""672B634AEC691DB2_7D0511646CC20FD8_6039_DP""","""N1CC2CC1CC2OCC4=NN=C(C3=CC=C(C)C=C3)O4""",21,"""1B2F00471B47237C"""
-"""DA2D988A5CB38AD2_3480EB08135DFA63_6039_DP""","""N1CC2CC1CC2OCC(C3=CC=C(C(C)(C)C)C=C3)=O""",21,"""1B2F00471B47237C"""
-"""C6F4DD30841A3039_7621C7720CA6B77D_6039_DP""","""N1CC2CC1CC2OCC(NCC3=CC=CC(=C3)OC)=O""",21,"""1B2F00471B47237C"""
-"""1210EF4FEBA4A879_6CB44C24E446427D_6039_DP""","""N1CC2CC1CC2OCC3=C(OCC)C=CC(=C3)C(=O)C""",21,"""1B2F00471B47237C"""
-"""40715CA958743229_0712C63B1D4AC509_6039_DP""","""N1CC2CC1CC2OCC4=NC3=C(C(=C(C)S3)C)C(N4)=O""",21,"""1B2F00471B47237C"""
-"""029E776FCB2CDD9A_933DEA74ECE50060_6039_DP""","""N1CC2CC1CC2OCC(=O)NC(=O)NC3CCCCC3""",21,"""1B2F00471B47237C"""
-"""E3C0F54E0B33408C_911A6E084966C8D8_6039_DP""","""N1CC2CC1CC2OCC(C3=CC(=C(OC)C=C3)OC)=O""",21,"""1B2F00471B47237C"""
-"""DB225457BC56EA07_4D52A4D5324ABDF2_6039_DP""","""N1CC2CC1CC2OCC(NC3=NN=C(CC(C)C)S3)=O""",21,"""1B2F00471B47237C"""
-"""34D711D4E5ACF9F2_536A1BF48CB572BF_6039_DP""","""N1CC2CC1CC2OCC(C3=CC=C(CNC(C)=O)O3)=O""",21,"""1B2F00471B47237C"""
-"""BBCF0746EEADFDF5_83498ED089E54C72_6039_DP""","""N1CC2CC1CC2OCC(C3=C(C)[N](C(=C3)C)CC=C)=O""",21,"""1B2F00471B47237C"""
-"""5A1FBDB08EADB5D9_D7F3D1CE717ED9B0_6039_DP""","""N1CC2CC1CC2OCC(C3=C(C)[NH]C4=C3C=CC=C4)=O""",21,"""1B2F00471B47237C"""
-"""796F614D69B3C55F_1C7FFC5283CE51D9_6039_DP""","""N1CC2CC1CC2OCC(C3=C(C=C(OC)C=C3)OC)=O""",21,"""1B2F00471B47237C"""
-"""78D7EC0BFAC99E64_E89D31B2E4612B15_6039_DP""","""N1CC2CC1CC2OCC(=O)NNC(=O)C3=CC=CC=C3""",21,"""1B2F00471B47237C"""
-"""968D8658EBA86C5B_489C98B902421984_6039_DP""","""N1CC2CC1CC2OCC(C3=CC=C(CCCC)C=C3)=O""",21,"""1B2F00471B47237C"""
-"""BFBFD8388E66497B_4A8A3A385B08CB60_6039_DP""","""N1CC2CC1CC2OCC(N(CC)CC(=O)NC(C)C)=O""",21,"""1B2F00471B47237C"""
-"""38947F958C8CA936_4437588F5562F7B6_6039_DP""","""N1CC2CC1CC2OCCC(NC3=CC=C(OC)C=C3)=O""",21,"""1B2F00471B47237C"""
-"""0D88CB6CEDDF88BF_0B74086330CA9D1C_6039_DP""","""N1CC2CC1CC2OCCOC3=CC=C(C(C)(C)C)C=C3""",21,"""1B2F00471B47237C"""
-"""6356DD7130AE99A7_A03F91ACB58C3E18_6039_DP""","""N1CC2CC1CC2OCC(NCCC3=C(C)C=CC=C3)=O""",21,"""1B2F00471B47237C"""
-"""8FC5048D1D52B8F3_6DF043862EF0E6FA_6039_DP""","""N1CC2CC1CC2OCC(NC3=CC=CC(=C3)C(O)=O)=O""",21,"""1B2F00471B47237C"""
-"""8143902A2E732F76_6FC1CB1738F1B4DC_6039_DP""","""N1CC2CC1CC2OCC(=O)NC(=O)NCC3=CC=CS3""",21,"""1B2F00471B47237C"""
-"""D247939CF1BFD2CE_2CF611B2270F3115_6039_DP""","""N1CC2CC1CC2OCC(NC(C)C3=CC=C(C=C3)F)=O""",21,"""1B2F00471B47237C"""
-"""7FE48FBD255651A8_E1D129A3A3A5F015_6039_DP""","""N1CC2CC1CC2OCC(NC3CCN(C(C)=O)CC3)=O""",21,"""1B2F00471B47237C"""
-"""9EF5014ED5724679_CEDD972A190F20D3_6039_DP""","""N1CC2CC1CC2OCC(C3=C(C(F)(F)F)C=CC=C3)=O""",21,"""1B2F00471B47237C"""
-"""90D39BC091120949_ED8D100B632CD25D_6039_DP""","""N1CC2CC1CC2OCC(C3=CC=CC(=C3)OC(F)F)=O""",21,"""1B2F00471B47237C"""
-"""C9A776ECA5B5A2A9_86A80891CE195098_6039_DP""","""N1CC2CC1CC2OCCOC3=CC(=C(C(C)C)C=C3)C""",21,"""1B2F00471B47237C"""
-"""DD523BB00B6A6B85_3739B9D487BBA09B_6039_DP""","""N1CC2CC1CC2OCC(=O)NC3=CC=C(C=C3)CC#N""",21,"""1B2F00471B47237C"""
-"""16418855E9D28D75_17A778E944A6013C_6039_DP""","""N1CC2CC1CC2OCC(C3=C(C=CC(=C3)CC)CC)=O""",21,"""1B2F00471B47237C"""
-"""211AD037957FECA3_10C0F1BAB1BC086C_6039_DP""","""N1CC2CC1CC2OCC(N(C)C3(CCCCC3)C#N)=O""",21,"""1B2F00471B47237C"""
-"""8D20691BB6B36A88_119AFFFD334449C9_6039_DP""","""N1CC2CC1CC2OCC3=C(C)C=C(C=C3C)C(C)(C)C""",21,"""1B2F00471B47237C"""
-"""E634BFAB952DD35A_01A99A96C7A792E6_6039_DP""","""N1CC2CC1CC2OCC(C3=C(C(=C(C)C=C3C)C)C)=O""",21,"""1B2F00471B47237C"""
-"""73BA1269505B652A_56DEEA7CF95D3E6E_6039_DP""","""N1CC2CC1CC2OCC3=NC(=NO3)C4=CC=C(C)C=C4""",21,"""1B2F00471B47237C"""
-"""8C9EE604091F1F92_11A1184F4E820992_6039_DP""","""N1CC2CC1CC2OCC3=CC=CC(=C3)[S](N(C)C)(=O)=O""",21,"""1B2F00471B47237C"""
-"""4D5F154F4A13496C_181AEC2922F8E7E4_6039_DP""","""N1CC2CC1CC2OCC(C3=C(C)[N](C(=C3)C)C4CC4)=O""",21,"""1B2F00471B47237C"""
-"""904F8BBDBE744DAC_108DC4AB0E8CF5C5_6039_DP""","""N1CC2CC1CC2OCC3=NN=N[N]3CC4=CC=CC=C4""",21,"""1B2F00471B47237C"""
-"""759EAF01D5CF6AFD_AE2F93E602B88BEA_6039_DP""","""N1CC2CC1CC2OCC(N(C)CC3=CC(=CC=C3)F)=O""",21,"""1B2F00471B47237C"""
-"""0CE9114564C7DAB0_906F78FE85809CDA_6039_DP""","""N1CC2CC1CC2OCC3=C(C)OC(=N3)C4=CC=CC=C4""",21,"""1B2F00471B47237C"""
-"""52134E5DA5739C6C_6B78D75338B97B57_6039_DP""","""N1CC2CC1CC2OCC3=NC4=C([N]3C(F)F)C=CC=C4""",21,"""1B2F00471B47237C"""
-"""D03C020FDEC1A658_6C2FFD3007CFB54E_6039_DP""","""N1CC2CC1CC2OCC3=COC(=N3)C4=CC=C(C)C=C4""",21,"""1B2F00471B47237C"""
-"""8C49F37B5A917F4C_7633D3902AA89FC6_6039_DP""","""N1CC2CC1CC2OCC(C3=CC=C(CC(OC)=O)S3)=O""",21,"""1B2F00471B47237C"""
-"""810FDF245056354F_BDBD85D1D69BDC23_6039_DP""","""N1CC2CC1CC2OCC3=COC(=N3)C4=CC=C(F)C=C4""",21,"""1B2F00471B47237C"""
-"""437037FD1033EC2A_819AF82C74663147_6039_DP""","""N1CC2CC1CC2OCC3=NC=C[N]3CC4=CC=CC=C4""",21,"""1B2F00471B47237C"""
-"""BAB45C7AD16D1FA9_239CDE1657395554_6039_DP""","""N1CC2CC1CC2OCC(=O)NCCSCC3=CC=CS3""",21,"""1B2F00471B47237C"""
-"""DDD58BC90CF0ED83_1E2E7E67F696ABF6_6039_DP""","""N1CC2CC1CC2OCC(NC3=C(C(=C(C)O3)C)C#N)=O""",21,"""1B2F00471B47237C"""
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-"""650363440CDFE776_FE2F2128C21A6A8B_6039_DP""","""N1CC2CC1CC2OCC3=COC(=N3)C4=CC=CC(=C4)F""",21,"""1B2F00471B47237C"""
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-"""0AC62BD180C17628_2A868210971FCC48_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3=C[NH]N=C3""",21,"""E99986E879805DF5"""
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-"""92C8D8CD926EAF80_7D09610194DC5FA1_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCCCCF""",21,"""E99986E879805DF5"""
-"""0EEE38F6C77FAB27_232E840439434159_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCSC(C)C""",21,"""E99986E879805DF5"""
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-"""53A9BF3BBD966689_E5176C2DD8191778_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(OCC)=N""",21,"""E99986E879805DF5"""
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-"""FA0B8ADD1812E89B_719B4056829246E9_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(C(C)=O)=O""",21,"""E99986E879805DF5"""
-"""0B9F56DD65BE90B3_69BB588FEEA59503_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3=CN=NS3""",21,"""E99986E879805DF5"""
-"""D3ED827E54AA7293_5F915FAD89FA5042_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC[S](F)(=O)=O""",21,"""E99986E879805DF5"""
-"""4D96CD0CA00A635A_D7EAAFC84B289BFB_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COC[C@H]3CCCO3""",21,"""E99986E879805DF5"""
-"""548FE244103BDA93_04BB6B5E060E3643_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC[Si](C)(C)C""",21,"""E99986E879805DF5"""
-"""6F3961320E996DA8_B9AA5B9CCE446A96_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(NCC)=O""",21,"""E99986E879805DF5"""
-"""0C471B0256F5D201_1E201DBBBAC2DF88_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCOCC=C""",21,"""E99986E879805DF5"""
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-"""312972C466B9C5E3_DD847235E93143C7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2N(C)CCCC2""",21,"""1617F2BC2F88E021"""
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-"""BCB6BC029847EB67_F9697801FBFC9D5E_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN(CCC)CCC""",21,"""1617F2BC2F88E021"""
-"""BBC6C47CF7301AA1_0AB8A4F816019414_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(NCC(CC)=O)=O""",21,"""1617F2BC2F88E021"""
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-"""C2D5BEEBCD8788D4_2D95C9F755A47477_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(N=C(C)C=C2)C""",21,"""1617F2BC2F88E021"""
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-"""6D098C80A2A59958_FD0EC1CFC82001F9_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC#C[Si](C)(C)C""",21,"""1617F2BC2F88E021"""
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-"""789F86D621C90842_19030D9680CF93F1_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=NO2)C3CC3""",21,"""1617F2BC2F88E021"""
-"""AB50A760C81E8777_706A9F1085B3BC44_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2CC(C)(C)C(N2)=O""",21,"""1617F2BC2F88E021"""
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-"""662DA50CB2510AFC_8719C970277F4EA2_6039_UN""","""NC(=O)C2=NC1=C(C=CC(=C1)OCCCC(OCC)=O)O2""",21,"""39DD793185E4A8C4"""
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-"""D107D08D89AE3B0F_7CA25BE5F2FD08D8_6039_DP""","""N1CCOCC1COCC3=N[N]2CCCC2=C3C(OC)=O""",21,"""766137389C269B85"""
-"""28469DB551CFC84B_05C148F9BE2419E8_6039_DP""","""N1CCOCC1COCCC2(C(OCC)=O)CCCC2=O""",21,"""766137389C269B85"""
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-"""1ADD5DD20F27C17B_2FE39C893179F93F_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC(=NO2)CC)C3""",21,"""59FF07884161D3CA"""
-"""550DF82E54B203DE_79CB9D38AA5ABCC2_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(ON=C2C)C)C3""",21,"""59FF07884161D3CA"""
-"""1314FC2C3AAA68E2_0555AED61B9236F2_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(CC(F)(F)F)=O)C2""",21,"""59FF07884161D3CA"""
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-"""732384D65C2353AF_8C94ED3FA61730D1_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2OCCNC2=O)C3""",21,"""59FF07884161D3CA"""
-"""0CE92F9653BB45BC_7B0AD621F8967188_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCC2=CSC(=N2)CO)C3""",21,"""59FF07884161D3CA"""
-"""EB57C4AE837476EC_86A4F7B424E5CE41_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCCOC2CCC2)C3""",21,"""59FF07884161D3CA"""
-"""626F0CF5C7F09D6B_9FC7460B78CB6ADA_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC[N]2C=NC=C2)C3""",21,"""59FF07884161D3CA"""
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-"""BF7FF3DB614A5D71_011F2CD476FFEDA4_6039_UN""","""CC(OCC(NCC(OC)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
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-"""81548FBBC59E2515_29F94098335E7673_6039_UN""","""CC(OCC1=CC=C(SC)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""98C5349EFFAE5FFE_6DB3A4D4A7031AFF_6039_UN""","""CC(OCC(NC(NCC)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""3CC4752B8D3AA94E_6D5D284F2294D6CD_6039_UN""","""CC(OCC(NC(C(C)C)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""5C31B45ECF0C5AE4_F9ACBCD127ABE688_6039_UN""","""CC(OCC=NNC(C(C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""DDC8DC208704430D_1C0EAAC2C48A1630_6039_UN""","""CC(OCC1=CC(=CC=C1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""47F61AC121ED7784_73CB670D3C90F67C_6039_UN""","""CC(OCC(NC(C)C1CC1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8DD79AB1ED9E0B89_021F052ECF9C56A7_6039_UN""","""CC(OCC(=O)N1CCOC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3D7DB36FFD8C91FA_C3FD1EF49AAD84DF_6039_UN""","""CC(OCC1=CC(=CC(=C1)C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4FB01689F2FFBB0C_1401A0037CD32B35_6039_UN""","""CC(OCC(=O)NC1=NN=CS1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""64C8263D5B1476FF_5B2891FEA6665839_6039_UN""","""CC(OCC1=C(C=CC=C1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2CCD76C28649BCB2_43AB5865054FB619_6039_UN""","""CC(OCC1=CSC(=N1)CCC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""FD41580A5BDC8887_4217E99F5124A9FA_6039_UN""","""CC(OCC1=NC(=NO1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""2DAE11E6F6BD0310_2446CCBFD303E01E_6039_UN""","""CC(OCC1=NN=N[N]1C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""28655E2C04E0769A_7B995644C81C653B_6039_UN""","""CC(OCC1=NC(=NO1)C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""761D9DEB5D0A0866_F2FBAF0E51D1E7DA_6039_UN""","""CC(OCC(=O)NC1=NOC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D54E76BA01DB8516_70D43E30FCA783B3_6039_UN""","""CC(OCC1=NOC(=N1)CCC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""AD6DC6F23BDB33E5_1499115637D297F8_6039_UN""","""CC(OCC1=NC(=NO1)CCC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7486F6F8184967BF_98822DE8340667C1_6039_UN""","""CC(OCC(C1=CC=C(C)S1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""35F214B44413E07A_11CA3095AAEBBEDF_6039_UN""","""CC(OCCN1C(SC=C1C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7E5E852EE39824B9_203AC560F5349ED9_6039_UN""","""CC(OCCN1C(=O)CNC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8C7170A848DC4056_D1B27ACDA38304E7_6039_UN""","""CC(OCCN1C(=O)CCC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1549FA68A7C0B1DB_C398B7CCAD01640B_6039_UN""","""CC(OCCOC1CCCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""26F0E3642C584DBF_5973E0187D4705AC_6039_UN""","""CC(OCC1=C(C=C(F)C=C1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""9E045B51B2D15E52_31464994C9A2BE25_6039_UN""","""CC(OCC1=NN=N[N]1CCC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2AB63B91D983C7DB_B04A548EE08166DB_6039_UN""","""CC(OCC(N(CC)C1CC1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""46C53619906097EE_435B2A865496DEA3_6039_UN""","""CC(OCC1=CSC(=C1)[N](=O)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""09DDF3AAC1CE2A9E_E0CE1C237C05AD46_6039_UN""","""CC(OCCCC1=C[N](C)N=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""CE16015AD9F3D264_81908109C7593B04_6039_UN""","""CC(OCCCC(NC(N)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""385BE4038A745618_0801D717BB917746_6039_UN""","""CC(OCCCN1CCCC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""CE226C3C3271DAEE_00983D8EA7AAB046_6039_UN""","""CC(OCC1=NN=C(OCC)S1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""FB387B318E145BE7_98324621E8584DE3_6039_UN""","""CC(OCC1=NOC(=N1)C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""35E78B67575C46E1_2A317CF7FAE583F0_6039_UN""","""CC(OCC1=CSC2=NCCN12)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""75384C74F66FB0C9_A3EDFA76B67545B5_6039_UN""","""CC(OCCCN1CCOC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""F7CC21C93A51904F_C69195E1ED8BB836_6039_UN""","""CC(OCCCOCC(F)(F)F)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""BE2B850C68412DE7_833F2A8ADF58B5D8_6039_UN""","""CC(OCC(NCCN(C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""C204051BF83C215F_1F8C413891FA052D_6039_UN""","""CC(OCC1=C[N]2C(=N1)SC=C2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""5EE690ED61975B16_AB9F7ABEFD77A681_6039_UN""","""CC(OCCCN1CCOCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A2D8C29F8967890E_C103A7BEDA6F9FF1_6039_UN""","""CC(OCC1OCCN(CC)C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""65313BBB6C2BF542_241409FCBF3CA5B3_6039_UN""","""CC(OCC1=NN=N[N]1C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""6121D861366676B9_C33B0175F46BB927_6039_UN""","""CC(OCCCCC(N(C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""BF14C8E19EAB8F15_5687DF4D25DCE898_6039_UN""","""CC(OCC(=O)NCC1CCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""EE6EAD00968F9699_800A0F7D4A70AF6D_6039_UN""","""CC(OCC(C1=C[N](C)N=C1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B71BCAC7F14647BD_08DB3109DEE6B6FC_6039_UN""","""CC(OCCC[S](N(C)C)(=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""32CA50794FA9F0A9_24AB622090D1B5D8_6039_UN""","""CC(OCC1=N[N](C(C)C)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""FD4289A07E16B1DC_5EAFFB2839FB7860_6039_UN""","""CC(OCC1=C(C)C=CC=C1C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""0E6D384DE066E6F1_DC3711C6E77171C5_6039_UN""","""CC(OCC1=CC=CC(=N1)OC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8BF2CDEED49313EC_885DA4900990EE63_6039_UN""","""CC(OCC1=CC=C(CC)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""87215752C043C100_578A34507A81139D_6039_UN""","""CC(OCCC1=CC=C(C)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3890BF9392AD71EA_941C637C0C64EAC8_6039_UN""","""CC(OCC1=CN=C(OC)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""84B2FF65FC62C27F_49FD223D65A38C85_6039_UN""","""CC(OCC1ON=C(C(C)C)C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""61C10FEB8A1F789B_B32DED4D8D1194A5_6039_UN""","""CC(OCCC1COC(C)(C)O1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8ACEB08EF34EF5B4_F6C732A38AEED1EB_6039_UN""","""CC(OCC(NC(C)C(=O)O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""5727B0E0D14B1241_EBA6AB9CF5B753C9_6039_UN""","""CC(OCC(NCCOCC)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""C674959EECE48F9D_C72650E7EC447182_6039_UN""","""CC(OCC1=C(C=CC(=C1)F)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E0041D7A74F25B7B_89A03E565609D5D4_6039_UN""","""CC(OCC1=C(OC)N=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3E8625B6C66D9DB5_8A290203BB3EC4E3_6039_UN""","""CC(OCCOCC1CCCO1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""EB300FEE59471CCB_DD6E17C5DB29ED5D_6039_UN""","""CC(OCCCC1=C(C)N=CS1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""FB80EB2D29392E3E_FB404122DED68F6F_6039_UN""","""CC(OCCN1CCC(C)CC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7CD2D10AE87CE41D_805345FFF3234EFE_6039_UN""","""CC(OCCC[S](C(C)C)(=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""F594ED2655BC037A_88DC8C0E0D829A4F_6039_UN""","""CC(OCC1=NN=C([N]1CC)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D9B7B102E9945F7A_E5142831B44A6AC6_6039_UN""","""CC(OCC(=O)C1CCOCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8D442BF1A759F71C_2D85C9B8D5546580_6039_UN""","""CC(OCCCN1CCCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A2BE6A4DB4DA9750_9A1515054C473A63_6039_UN""","""CC(OCCCC1=NN=C(C)O1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""43A9D9E03AFB817F_2E3F482B4BFA112B_6039_UN""","""CC(OCCCCN(CC)CC)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""3AFA16A10C2F5D4C_789617BC097C6829_6039_UN""","""CC(OCCN1CCC[S]1(=O)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""883D484FC3EAA857_C29EC89B10818F49_6039_UN""","""CC(OCC(N(C)CC1CC1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""385C3F1E3D4C0045_CBC62107B1CFA6F9_6039_UN""","""CC(OCC(C1=CC=C[N]1C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""85722A6913459903_B12FCC1E558769C8_6039_UN""","""CC(OCCC(NC(NC)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""B0A83952D8B9D8E1_AA2A7A08428F624D_6039_UN""","""CC(OCC1=NC=C(C(C)C)O1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""193F74883EB69BE4_AA5AA58B3E58D96B_6039_UN""","""CC(OCC1=C(ON=C1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""9CF2158C21EB1214_74F849ACCB3551C4_6039_DP""","""CC(OCC(N1CCNCC1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""28E950A1EB575631_230E012CAF88F3F7_6039_DP""","""CC(OC[C@H]1NC(O[C@@H]1C)(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7C86F1FDF6E094BC_983A88B6ADDCD53C_6039_UN""","""CC(OCC(NCCCCC)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""B6B62303EEAD1195_25395D5029918E75_6039_UN""","""CC(OCC(C1=C[N](C)C=C1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""9116C0E2C718C5E5_4E5CD3FF1BAC51B8_6039_UN""","""CC(OCC1=CSC(=N1)COC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A6B2016FBBE283C7_07823644388D8979_6039_UN""","""CC(OCCC1=C(ON=C1C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""559187EA664D0CA8_D0415104AD1E2635_6039_UN""","""CC(OCC1=NN=C(O1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""AE56E38F505A0BF2_3AE47C3A316759EC_6039_UN""","""CC(OCCCN[S](CC)(=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""A3E0F027D4F87EFD_02581C00F43CAB20_6039_UN""","""CC(OCC1=CC(=C(F)C=C1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7304911BD3E0B88C_EBF36D8DE088B9C9_6039_UN""","""CC(OCCC[N]1C=CN=C1C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""98E69FA254838916_44266FE24A756AC2_6039_UN""","""CC(OCC1=C(OC)C=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""17724EB4A9DFE005_B5B4CFDA804C7EF2_6039_UN""","""CC(OCCOCC(OCC)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""C7A73D99079323C7_DBE4365A1B02B5E0_6039_UN""","""CC(OCC[N]1N=C(C)N=C1C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D5733B31CF1E70B5_686A2F486DAA1FCB_6039_UN""","""CC(OCC1=C(ON=C1CC)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""9CAB279BE1790481_AF9DAA2A29C9F83E_6039_UN""","""CC(OCC1=C(OC=N1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""C56A0B4B30280A49_B983EC32E9218FCF_6039_UN""","""CC(OCCN1CCN(C)CC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""BF577B9F3511F965_7392B50E09ADD52A_6039_UN""","""CC(OCC1=C(C(C)C)OC=N1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""747AAA54E610C414_5D112B67E7C98741_6039_UN""","""CC(OCCN1C(C=CC=C1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""887D56CAD3D4D1DE_E95BEB323EAB6C9E_6039_UN""","""CC(OCC1=NC(=NO1)COC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2C2628DF78BCDD8C_6F118EB7886F906D_6039_UN""","""CC(OCC1=CC=C(CF)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B077AAD0BB56BB97_2B634CD4565634E2_6039_UN""","""CC(OCC(=O)NC1CCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1479FDA91EF45E1E_9DE26A536BC2B6B4_6039_UN""","""CC(OCC(=O)NC1=NC=CS1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8D30CA375A57CDC7_5BDECFB67E4EA128_6039_UN""","""CC(OCC1=NN=C(CCC)S1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""BA59DD9DD64E9CD2_F6AE216EBCD0E397_6039_UN""","""CC(OCC1=CSC(=N1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""0110F094E73A5F53_086E1BE9BDA371A9_6039_UN""","""CC(OCC(=O)C1CCCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""F088F05DCB7576DC_B7EBB416F9BE6FB9_6039_UN""","""CC(OCC1=NOC(=N1)COC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""12F199BF5122D6AE_F32B115ACC16278C_6039_UN""","""CC(OCC1=CC=C(C=C1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E8887BD934FC5840_19C74FF80A8EEA33_6039_UN""","""CC(OCC1=C(SC)C=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""AC42DF521CC876D3_C0AB64AB6774C02B_6039_UN""","""CC(OCC(NCC(F)(F)F)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""368EC0F86902D919_5507139F60D253BC_6039_UN""","""CC(OCC1=NN=C(C(F)F)S1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""C1FA4044A56702D7_0D1611423EFCC4E4_6039_UN""","""CC(OCC1=C(F)C=CC=C1F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""AC7892B212D777B0_F4E2C8A7E3CB3D17_6039_UN""","""CC(OCC1=NC(=CS1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""380497B27C7936C3_B5974760FFE95CD5_6039_UN""","""CC(OCC(C#C[Si](C)(C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""98DDC7D4D9B32CCA_59E395608FF2450D_6039_UN""","""CC(OCCC1N(C)CCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D6179D38081F41F3_B45567F1F5724A94_6039_UN""","""CC(OCC(=O)C1CCCOC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2D7416ED26A0B603_7D0E9F549D3F9B94_6039_UN""","""CC(OCCN(CCC)CCC)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""10024FFF92FF31B7_8EDF43AD70C292DE_6039_UN""","""CC(OCC(NCC(CC)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""C6E89B49A92EB2E8_FBF6008D62BA54C0_6039_UN""","""CC(OCC(C1=CC(=NO1)C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""70D7F103505FB1B5_00DD540C4EFFC4CD_6039_UN""","""CC(OCCOC1=CC=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""5C6B44D04FEF2A93_26A4E99C651306EF_6039_UN""","""CC(OCC1=NC(=NO1)N(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4A759D184FD1CF50_AD4BA0F18E77F2BA_6039_UN""","""CC(OCC1=C(C)C=C(C=C1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""62BCE4C7F25F2AC7_A9F22EA2336772BD_6039_UN""","""CC(OCC1=C(N=C(C)C=C1)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D66F1FFF7A722381_766A1C600393AAD7_6039_UN""","""CC(OCCOC1=CN=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B37F8E6720D25DC1_F987E7291AF77571_6039_UN""","""CC(OCC1=C(CC)C=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""CC969E57BE8CC8DA_7F0CD98B86A10BA1_6039_UN""","""CC(OCCN1CCOC(C)C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A28A65B5290759B6_62FFCDDB9AE1EBDA_6039_UN""","""CC(OCC(C1=C(C)ON=C1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""98134974D220CC33_7DFB379756445D90_6039_UN""","""CC(OCC1=C(C)C=CC(=C1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""645D075FACE236C0_E9F3B8C2E24FCF28_6039_UN""","""CC(OCC(=O)C1=NC=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D7CB34E01536E38C_0F085A4343D169ED_6039_UN""","""CC(OCCC1=CC=N[N]1CC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""28A33F6078CDAE51_21B6B6DAB98469CD_6039_UN""","""CC(OCC1=C(C)C(OC1=O)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""692D45692311CB0B_6AAC4E405C00D6D0_6039_UN""","""CC(OCCC1=NN=C(OC)S1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""CE96040DDD9EE708_694C20FBFBD7D170_6039_UN""","""CC(OCC1=CC=CC(=C1)CC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""6120F415A0CDD3DA_A988FAADF8449CDB_6039_UN""","""CC(OCC#CC1=CC=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""BEA39865E29EB608_7A67242B59C932FD_6039_UN""","""CC(OCCN1C(C)COCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D79D384B751965C9_988EBDDE0D013D1B_6039_UN""","""CC(OCC1CC(F)(F)C(O1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3CBD56FFB7B546C9_2F8CC265D578286D_6039_UN""","""CC(OCCN1CCOCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""22F6704C7FD89C7A_59D0A321F62C7F15_6039_UN""","""CC(OCC1=NN=C(N(C)C)O1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8B132B81F7BC5DFF_CC120FD4FE20148A_6039_UN""","""CC(OCC1=NC=N[N]1C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E698B8C53EE77EC2_AE30583545C6715A_6039_UN""","""CC(OCC1=CC(=C(C)C=C1)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2E9F28CA67E8B8EC_B86343351DB7C66D_6039_UN""","""CC(OCC1=NN=C(OC)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""5B38CD3DB19D61DE_41E8AEA69B10FB22_6039_UN""","""CC(OCC1=CN=C(OC)N=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7978A2B81B220514_72F8072BB8B30387_6039_UN""","""CC(OCCSC1CCCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""79DA58EF5E9BFC07_4BBA1A46A250C67D_6039_UN""","""CC(OCCC(C(OC)=O)(C)C)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""FD4192491F06CFC4_534BDEB7F4AD5651_6039_UN""","""CC(OCC(C1=N[N](C)N=C1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7FFEB75F23491F35_915742E1F0CF5747_6039_UN""","""CC(OCC(CCSC(C)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""819FB6E90078619D_92E5570B187643D5_6039_UN""","""CC(OCC1=COC(=N1)C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""22C905AEC0D25422_D3DAED145246E4E5_6039_UN""","""CC(OCC1=C(OC)C=CN=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""FF4CD32672E1D8A5_B0B367973E2119E6_6039_UN""","""CC(OCC1=CN=CC(=C1)OC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4D45DFD051426C93_15BDBAE7731B5E93_6039_UN""","""CC(OCC1=C[N](C(C)C)N=N1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""039204B0292B06DE_383A870B68004E48_6039_UN""","""CC(OCCOCCNC(C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""321CC9E7E849BFFF_CF980444325353E4_6039_UN""","""CC(OCCN1CCOCC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""98CC574275F088F9_9163406554BFFE95_6039_UN""","""CC(OCC1=CC(=NO1)C(C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""0A50064F37B9798A_E5CC57A0858DD93D_6039_UN""","""CC(OCC(CCC(OC)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""C671AEA37806A8D2_F01CCFD2E03F15FA_6039_DP""","""CC(OCC(C(CC(O)=O)N)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""823943979C1BCF2F_533CF6B2E823FF5E_6039_UN""","""CC(OCC1=C(N=C(CC)O1)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""5BFBB21B8A4E76C6_8F55DF69CB6CC7D6_6039_UN""","""CC(OCC1=CC(=NO1)C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""0AA492C4935E9BE3_9004C0FC0F22049E_6039_UN""","""CC(OCC1=N[N](CCC)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""CCC142D9659F0182_037A518408B07DE1_6039_UN""","""CC(OCC(=O)N1CCOCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""388DCEA337968B52_AA1BB7440D75A2FE_6039_UN""","""CC(OCC1=NC=C[N]1C(F)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""261586BE71B7B900_D3842052A09DB930_6039_UN""","""CC(OCC(=O)N1CCCC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4FD40F07A7E4A6CF_F068B305FA14D9D4_6039_UN""","""CC(OCC1=NC=CC(=C1)OC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8F626ED1EA402115_2DC92F454270BCDF_6039_UN""","""CC(OCCCCN1CCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""CDD40E1F878AA60D_E13886E563A700F7_6039_UN""","""CC(OCC1=NC=CC(=N1)OC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""297AF4BFDCF7913C_C26DFDA3DC6B788B_6039_UN""","""CC(OCC1=C(N=C(C)C=N1)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B6528A8083EA7E55_770318097DDE85FC_6039_UN""","""CC(OCCCC(C(OC)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""1D35056D0D74D42C_262CDD64BAF7261B_6039_UN""","""CC(OCC(=O)C1=NC=CN=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""51DC2238C1B73019_67D3A8E48B74AE54_6039_UN""","""CC(OCC[N]1N=C(C)C=C1C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1C1D534C6F20DAA6_3BACC021EA678EF4_6039_UN""","""CC(OCC1=N[N](CC)N=C1C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B1C911AAA4B0A13A_E417196A5B0C3331_6039_UN""","""CC(OCC(OCC(F)(F)F)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""AC41A340043B320B_AE232B28E9E4DA3F_6039_UN""","""CC(OCC1=C(C=CC(=C1)C)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2A8D522D751367C2_561C8D9158421C37_6039_UN""","""CC(OCC(C1=CN=N[N]1C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8D0E1858F8CDFAAB_5E4A19A97CB6835D_6039_UN""","""CC(OCC1=NC=N[N]1CCC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A955455C3D490718_3206AF18694323CB_6039_UN""","""CC(OCCCC1CCOCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B84CBDEC142AF731_3C1FAB597EF3EDD5_6039_UN""","""CC(OCCCCCC(C)(C)C)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""97AEF592E453EAE5_D599CA791764A71F_6039_UN""","""CC(OCC1=C(C=CC(=C1)C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8DBC01E7DEA588FE_CF2C0E8F8193F9D5_6039_UN""","""CC(OCC1=N[NH]C(=N1)C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""C01F2717002834DE_9171D4D79BDEAD88_6039_UN""","""CC(OCCC1=C(F)C=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""651B8124CB7383BC_BC914A414F17928F_6039_UN""","""CC(OCC1=CC(=NC(=N1)C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""48933D7A6D930679_1D15C05A95B51C90_6039_UN""","""CC(OCC1=NC=CC(=C1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""FDE70CA3DB7E563A_7F1539205161A36D_6039_UN""","""CC(OCC1=CC(=C(C)C=C1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""0D1EB6EBA7E9314C_BCD432D7FF27B16F_6039_UN""","""CC(OCC1=NC(=N[NH]1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""227DADF00461C45B_5C794022FD3A8EC2_6039_UN""","""CC(OCC1=NSC(=N1)N(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E9AD438F2207D799_54D3E67C93A50F4F_6039_UN""","""CC(OCC(=O)C1=CN=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""0D592E85A366306A_4B2891C88DE76223_6039_UN""","""CC(OCCCCC(OCC)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""539A301FF3D2D937_4FDFB9F84368E0BE_6039_UN""","""CC(OCCCC1=NC(=NO1)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""379972FCBE9CDF6C_FBCBD6F819192877_6039_UN""","""CC(OCC1=NOC(=N1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""4D733154940EFB2C_8FF414822A86D68A_6039_UN""","""CC(OCCOC1CCCCO1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""DBE352FD7C01F898_41D5053FCE601927_6039_UN""","""CC(OCCSC1=CC=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B8A028683195CDE7_EEEFF031E8066AE7_6039_UN""","""CC(OCC(=O)CC1CCCO1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3A27209034A41B5C_DC86E9CB1B8842DE_6039_UN""","""CC(OCCOCC1CCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""149B963F6565EE9B_89C2033B758D4472_6039_UN""","""CC(OCC1=C(N=N[N]1CC)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B114916697E8130D_C0DAC9AFD7117655_6039_UN""","""CC(OCC1=CC=CC(=C1F)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2495F4BADD0953A3_544FB4D3460FC588_6039_UN""","""CC(OCC1=NC=C(C=N1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""70468843B82FF7E8_903790FB2D96D102_6039_UN""","""CC(OCCNC(NC(C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""409C7C84C0F74F31_2AB698BCAB3EBFD7_6039_UN""","""CC(OCCCC1=CN=C[N]1C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""C7E55848D13AE595_179BDCC246A583A7_6039_UN""","""CC(OCC1=NC(=NO1)C(F)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2C4B37A6B96316FB_629091D753CC4288_6039_UN""","""CC(OCC(C1=NC=C[N]1C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D8C56D59F3D5D5A7_7CEA67457FCBF465_6039_UN""","""CC(OCC1=CC(=C(N=C1)Cl)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""312EAEB1DE1FD6C4_FAFAD69E5C78E668_6039_UN""","""CC(OCC(C1=NON=C1C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""36C972C7409656C2_A7D704BC7F06224A_6039_UN""","""CC(OCC1=NN=C(S1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""7B22A661D4D038BA_BA816B0D2C12C7F6_6039_UN""","""CC(OCC1=NC=C(C=C1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3A6D76369DC64BDE_EE3D063153F1644F_6039_UN""","""CC(OCC1=C(C=C(C)C=C1)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""44705CD064FC3B31_7C5B79BC2F1B4BC9_6039_UN""","""CC(OCC(C1=C[N](C)N=N1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E450B32FFC3FD6B2_2F971EB59A808948_6039_UN""","""CC(OCC(C1=CC=N[N]1C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""61CBE6F0709B9B9A_E8699B40F6FE85FC_6039_DP""","""CC(OCC2OCC1(CNC1)C2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""0B482E4D7652B9AE_867505D4644D24BF_6039_UN""","""CC(OCCC1CCCCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3B07AA284615F025_EF52A751163CE338_6039_UN""","""CC(OCC2=N[N]1CCCC1=C2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""01FDC2DA4ED35BEC_393C29C23CBCE564_6039_DP""","""CC(OCCCC1CCNCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""DE3B5039500F0C86_F15230BD338F3B5F_6039_UN""","""CC(OCC1=C(C=NC=C1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7343909B54AD8162_FCAB844A2F5D18AF_6039_UN""","""CC(OCC1CN(CC)C(O1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""03ACC0872FA55660_8D114DE188424CB4_6039_UN""","""CC(OCCCC1=CN=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A287D61F164546D3_C28AC9C5B65FC7F8_6039_UN""","""CC(OCC1=CC=CC(=C1)SC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""55C2225AEFB95BF7_68FAFDEEE6D1CE93_6039_UN""","""CC(OCC(=O)C1=CC=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3152D99C4B1C821B_7969269AAEE30733_6039_UN""","""CC(OCCCC#C[Si](C)(C)C)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""EB0F1FAF667DEFAD_54E0F419E96E1834_6039_UN""","""CC(OCC(OC)C1CCOC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""AD81B4B458A35E2B_7626EEA7C6B01B3F_6039_DP""","""CC(OCC2CCC1(CNC1)O2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""595B87EB0BEADF36_3C3E6A2C540B2B0B_6039_UN""","""CC(OCC=N[S](C(C)(C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""12608A923DD0A1A1_21571254998AE7F7_6039_DP""","""CC(OCC1NC(OC1C)(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""90D9E758653FF4D1_E58755C93101F9BF_6039_UN""","""CC(OCC1=NC(=CS1)C(O)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D77CEF6C2385D2A5_9D64EAC3E60C953B_6039_UN""","""CC(OCC1=CC(=NO1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""F8F47E2A77495C1E_F40D7845E370BA8E_6039_UN""","""CC(OCC1CC(C)(C)C(N1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""9553E6EAEE89B808_F03BEFDF7C73AAB1_6039_UN""","""CC(OCC1=NN=C(C(C)C)S1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1EBAADD2A9EEB31F_21304FCC64C02ADE_6039_UN""","""CC(OCCOC1CCOCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""F6C56766D792FFD8_C6F79F405002874A_6039_UN""","""CC(OCC1=NC(=NS1)C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""80B38A4D9DF9EEFC_4720CD6C4F69FFEE_6039_UN""","""CC(OCC2CC1(CCC1)CO2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""EF77376508F5C926_3E9DF13304CEA322_6039_UN""","""CC(OCC2[N]1N=CN=C1CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""5FB2E31267BD0CC2_100C0B21DAE8A229_6039_UN""","""CC(OCC(=O)NC1=NC=C[NH]1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B18947AD8543C50C_134E49F87CD0F389_6039_UN""","""CC(OCC1=COC(=N1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""FE145D14AE8C6B6B_062C705E96A68D05_6039_UN""","""CC(OCC1CCC(C)(C)CO1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E1BB92A4F57E8773_583DF1DF0B96521A_6039_UN""","""CC(OCC(C(OCC)=O)=NO)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""F0C57FCCC134A1AA_FF73176C6CC34582_6039_UN""","""CC(OCC1CCCC(C)(C)O1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""679B29BF2B44AE7E_A4D0C7ACB4EE42D6_6039_UN""","""CC(OCC1=C([N](N=C1C)C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""6D76F18B1773F222_4FDA703F153DE46B_6039_UN""","""CC(OCC1=NC(=NS1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""58768D578B3DE632_EA04E477979018C4_6039_UN""","""CC(OCC2CCC1(CCC1)O2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""12A6AFBCEF72D836_E4EA4943C2414855_6039_UN""","""CC(OCC(CC(OCC)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""B9212A4FB81E2004_8D4542C97E4B8444_6039_UN""","""CC(OCCSC1=CC=NC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""576F7CD37D9A1782_F9C9E6C2CB99D76E_6039_UN""","""CC(OCC(NCC(C)(C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""1FB97865208A9F1B_B8E1CC34AC6C3C4A_6039_UN""","""CC(OCC2CC1CCCC1O2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""68B2E52168F3115F_ACD0D0A5809B47F2_6039_UN""","""CC(OCC1=C(C)C(NC1=O)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""9ABA94221700E11A_D099FF8279BEF1C0_6039_UN""","""CC(OCC1CCC(O1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""AAD48AFCE08CF498_AE0AEE8DCA3433D5_6039_UN""","""CC(OCC1=COC(=N1)C(F)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A1AE39A1E056F0FF_0CFB3C2229DD46AB_6039_UN""","""CC(OCCCCCCCCC)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""626CB76C765C7D0D_3824939D6ECD4F42_6039_UN""","""CC(OCCCC1=CC=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4EF06184C7DB90AB_2AB0BBF4974FD524_6039_UN""","""CC(OCCCCCNC(C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""FFCE1DFF735FEA16_2822F49D9F624C17_6039_UN""","""CC(OCC1=CC(=CN=C1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1EB89417F3BF1013_13A05889239866C5_6039_UN""","""CC(OCC(NC(COC)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""A8D64A0FE774C4D9_98A1825694B01E99_6039_UN""","""CC(OCC(NC(CC)CC)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""B203DF7D3FC9F56D_1B5F80C76CD35698_6039_UN""","""CC(OCC(NCCCOC)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""5485F4D9B317A37E_87DA0A41EE96D367_6039_UN""","""CC(OCC(NC(CCC)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""BA38ABF01B879195_932EA482812A8E10_6039_UN""","""CC(OCC(NC(C(C)C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""905D9BAF347B5863_EB570ADE61F9DCF0_6039_UN""","""CC(OCC1=CC(=NN=C1C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4DBC31B0D88302A1_9B7E702053DF2D19_6039_UN""","""CC(OCC1=CC=CC(=C1)OC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""BA0CBB41CA8DF678_740678DAB2F4B2CF_6039_UN""","""CC(OCC1=CSC(=N1)C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""CF670719FE9D3E6C_A3A7FA8A78978D98_6039_UN""","""CC(OCC1=NC(=C(S1)C)OC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D1DB5AFC269E646E_3BC5A046724F88A7_6039_UN""","""CC(OCC1=NC(=CC(=C1)C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D8E9A4EEF1BD2DD1_8B4F75C111BB86B9_6039_UN""","""CC(OCC1=C[N](CCF)N=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1EB0D7BBB0D072CA_F59073A0467F85A4_6039_UN""","""CC(OCCC1=CC=CC(=C1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1408482285193143_78453034820EA9EE_6039_UN""","""CC(OCCC(COC)COC)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""CB26ED7ADECDC0CA_50C296B27F88795C_6039_UN""","""CC(OCCC1=C(C)C=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1C418909E295E386_DE66D3AE4B40F93B_6039_UN""","""CC(OCCC1=CC=C(F)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E0B72ED3C48DFC8B_590BDFA7B1F5549D_6039_UN""","""CC(OCCCC1CCCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""C3244F4D9740F111_9855FC752D51FC4B_6039_UN""","""CC(OCCC1CC2CCC1C2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""A475E0E36BED482B_E23029F4F3447375_6039_UN""","""CC(OCC2CCC1(COC1)O2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""CFEF797F36CE4CD8_1B74C75EF1BDB07B_6039_UN""","""CC(OCC1=C(F)C=NC=C1F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2D3DB77A389CD627_4885B545AB9F741A_6039_DP""","""CC(OCCC1(C(O)=O)CCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A158FAAB1E637C8C_A47B5C189B68EF1F_6039_UN""","""CC(OCC1=C(CF)C=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""39822F336F140AE3_239400CDF2A5EF4C_6039_UN""","""CC(OCCOC1CCSCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B70C007FBC045482_7B6FCE9C31CB98BF_6039_UN""","""CC(OCC(C(OCC)=O)(F)F)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""3069ECA13F9B532B_263CD535C27E575C_6039_UN""","""CC(OCC1=CON=C1C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""5B8F28414C43810C_DDAF94B052072128_6039_UN""","""CC(OCC1=CON=C1C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""A4E3108A0D44067E_57DF479D414EF1FA_6039_UN""","""CC(OCCC1=CN=CC(=C1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2D4A07320214488B_7282D8CD192CF1FC_6039_UN""","""CC(OCC1OCCC12CCC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""EAC93F535C53CD36_EACF90B4C6C849FE_6039_UN""","""CC(OCC1=C(C=C(C)C=C1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""923C1B0505B4CC9F_A81A1F153BB07D8E_6039_UN""","""CC(OCC(=O)C1CCCCO1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""9364681AD0573773_31EEB6189DA9399C_6039_UN""","""CC(OCC(=O)C1=CC=NC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""362ED13B8DB83DEA_B2A1916FFBDDB564_6039_UN""","""CC(OCC1N(C)[S](CC1)(=O)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""C6B804228EFAFA10_667C186948E73FDC_6039_UN""","""CC(OCCOC1(CCC1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""076E6C3E632E0656_E704A89838C27F51_6039_UN""","""CC(OCC1NC(CC1(C)C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""58ED89C00AB9FBF5_7611FF64CBBFC1D6_6039_UN""","""CC(OCC1OCC2CCOC12)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""74A6C5E362FD3283_89641D44D39178E7_6039_UN""","""CC(OCC1COCC(C)(C)O1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A3A497180AB69753_B7D705515A05D603_6039_DP""","""CC(OCC1OCCC12CNC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""8D0DB847F413EE32_05F146F91F247B94_6039_UN""","""CC(OC[C@@H]2C[C@H]1COC[C@H]1O2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""E42B11B519D3DF64_8B95639836656191_6039_UN""","""CC(OCC#CC1CCCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""BC1BE4CEE1B89B0A_1EBFAB19F68AA6C4_6039_UN""","""CC(OCCSC1CCOCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""27A661ECA76C87FE_D7BEF74ADEE98698_6039_UN""","""CC(OCC1=NC=C[N]1C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""08A37AA734DB36BF_57C2FE5BEF8F4F33_6039_UN""","""CC(OCCC(OCC)OCC)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""7BD46374520BF9D4_CEB3FEC7F54F7EF5_6039_UN""","""CC(OCCC1CCCC(C)C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""F7739F0639E247F1_47A46D4DBC7FB0F9_6039_UN""","""CC(OCC1=NC=C(O1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""E505D49D67AA385F_83610A31D2416A5A_6039_UN""","""CC(OCC1=CC(=NC=C1)OC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""42C0F3587938C942_C04A49BB7075A8B6_6039_UN""","""CC(OCC1=NN=C(CC)[N]1C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4F28FC1578095B6A_17BF6F4144FB851C_6039_UN""","""CC(OCC1=CN=C(N(C)C)S1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7B11332D105380B9_4EA0B9597B5F41CC_6039_UN""","""CC(OCC(=O)NC1=NN=N[NH]1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""968C2E3E5A5B50D1_1D30D5FCE8E2F51C_6039_DP""","""CC(OCCC1CCCNCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""229173A316A827A6_B9D1704AD4F74B0E_6039_UN""","""CC(OCCOC(NC(N)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""F45FE89202E0653F_ECAFD21D5188F545_6039_UN""","""CC(OCC1=NC=C(CC)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""9A4B888EFB61D8A5_811696C6D3591C7B_6039_UN""","""CC(OCC(=O)N1CCCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4021A2CCC55A9195_654AFB4BDFEE65F3_6039_UN""","""CC(OCCC(C)(C)C(F)(F)F)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""571FEB9A19892603_7501F14C43ACF01B_6039_UN""","""CC(OCC1=C(F)C(=NC=N1)Br)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""806C0010D77994A6_28229E40CDC6A39E_6039_UN""","""CC(OCC1=CSC2=CN=C[N]12)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""72E3384D9CBBCCBA_FCA716E303EE2A1B_6039_UN""","""CC(OCC1=NC(=C[NH]1)C(O)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""AC8E365F3806DA1B_409E679BCBB28F30_6039_UN""","""CC(OCC1CC(F)(F)C(N1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4E644E262DEDCEB0_E1669C187A63551B_6039_UN""","""CC(OCC1=NC(=CO1)C(O)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""34DAF4D114C502D0_F1DB59F52EDED3BC_6039_UN""","""CC(OCCCC(NCCC)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""89F223FC926780FB_DFF97503969E90AC_6039_UN""","""CC(OCC1=CC(=NO1)C(F)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""5558AAEA89F52DB5_ABA343E2096354AB_6039_UN""","""CC(OCC1=C[N](N=N1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""C569F66479D4AA39_CC1609C0D1314334_6039_UN""","""CC(OCC(C1=NOC(=C1)C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""C6EBF29FF4A05C74_28C55C7839D40E82_6039_DP""","""CC(OCC1=COC(=N1)[C@H](C)N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""96336E4E355034B0_060A831B38017560_6039_UN""","""CC(OCC1=C(C(F)F)OC=N1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A2864D06B8BA908B_098DC327C3CE6B64_6039_UN""","""CC(OCC(C1=C(C)C=CO1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""49C9641F01FE1CAE_23A8DB34AA7A0868_6039_UN""","""CC(OCC(C1=C(C)C=CS1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D50AA0C968D34B75_BBE9C09177D9FF7F_6039_UN""","""CC(OCC1=NN=C(COC)O1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""FAD74459015356A7_9EE6615A907542D5_6039_UN""","""CC(OCC(C1=CC(=CS1)C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""DE6D656F241EE389_21F54D1917128180_6039_UN""","""CC(OCC(C1=CON=C1C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E55792D06D5F045F_9E14BE31FB03467C_6039_UN""","""CC(OCC1=NOC=C1C(O)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""9A5BB3990E242FBB_E1001F530F74945C_6039_UN""","""CC(OCCO[P]1(=O)CC=CC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""33C3193570B84C1F_7228FC1450A4B298_6039_DP""","""CC(OCC1=COC(=N1)[C@@H](C)N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""EF69B8529608324E_8C834A4794189867_6039_UN""","""CC(OCCC1(CCC#C)N=N1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3B094646E6CDB5B7_CB6730F9F949B8C1_6039_UN""","""CC(OCCC1CCCC(=O)O1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""0B3ECE7AA87B5263_665A5A326D1D34B6_6039_UN""","""CC(OCCN1CCCCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""839305C66E6F6B69_A22B5EFB542B27B8_6039_UN""","""CC(OCC(C1=C(C)N=NS1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3590BAA58DDBCD7A_4992F013A6A2DE3C_6039_UN""","""CC(OCC(C1=C(C)N=CO1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A338C4478CC4D290_5765ED592C707F6D_6039_UN""","""CC(OCC(C1=C(C)OC=C1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""45CE8A761675A36A_98D93D4299ABE33D_6039_UN""","""CC(OCC1=NOC(=C1)C(O)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""F61977771BB20EA3_4A80AC38D7EBEAD9_6039_UN""","""CC(OCC(C1=C(C)N=CS1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8836E9E15EA91A1D_D51C66CBE02C352F_6039_UN""","""CC(OCC(F)C1=CC=CC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2B9141812C302A40_E42D29149FD5A6D2_6039_UN""","""CC(OCC1=CON=C1COC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""37F7168272725C11_AA24627B8125AE2E_6039_UN""","""CC(OCC1=CN=CC(=N1)OC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""EAE319C935611E34_9A8D3DEAB94A1FB9_6039_UN""","""CC(OCC1OC(CC1(C)C)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4375FD1BE0F66798_0A904083110EA6AB_6039_UN""","""CC(OCC(CCCCCC)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""2B4BDF699305EFBD_79F6BDDBCED57D5D_6039_UN""","""CC(OCC1=CC(=CC(=C1)F)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D2077B752FDD0331_EE242F437A04BFCA_6039_UN""","""CC(OCCC1=C[N](CC)N=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3EFD8D514BC496CA_F4E8366518302762_6039_UN""","""CC(OCC2CC1(CC1)C(=O)O2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""EE0FABE2F32F4034_C7BD4677EC80B70F_6039_UN""","""CC(OCCCCC[S](Cl)(=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""6E2B987AC81332CE_0EF237784722E020_6039_UN""","""CC(OCC2CC1COCC1O2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""3AF325286F809CAD_32D5F1E93A8D66C6_6039_UN""","""CC(OCC1=CN=C(C(C)C)S1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""F876081C9883E920_CA385DC532726F6E_6039_UN""","""CC(OCC(CC[S](C)(=O)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""BEDC69FA7018A4FB_21519C2C886CF5D1_6039_UN""","""CC(OCC1=CC(=C(C=C1)F)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B091FDACD3B8BF79_63F8C9B994B3D1A0_6039_UN""","""CC(OCC1N(C)CC(C1)(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""848A515A30E83752_8EB5C49C19259F81_6039_UN""","""CC(OCC(C1CC(F)(F)C1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""CE55ACEFA0EABF62_F3DF080B0BC2D5CB_6039_UN""","""CC(OCC1=CC=C(C=C1)C#C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A0312342F1027D9D_3D3E0EEFC77952C6_6039_UN""","""CC(OCCC(=O)N1CCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""9595759C6454F8D0_5D575A8B9DCBCAE0_6039_UN""","""CC(OCC1=CC(=CC=C1)C#C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""635EAA1E21E61F3D_F06BD5277812ADF7_6039_DP""","""CC(OCC([C@@H](N)C(C)(C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""0672802337B8FDB0_4D918ED48380A52B_6039_DP""","""CC(OCCCN1CCNCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E14F479CFCB7F773_CF812ADCC991016C_6039_UN""","""CC(OCC1=NOC(=C1)COC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""FFA0FC671614F730_7C70B44FC8730F2D_6039_UN""","""CC(OCC1OCCCC1(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""DE47E28417D1F9A9_F391C3F4AED85912_6039_UN""","""CC(OCCC1(CC1)[S](=O)(=O)Cl)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B27FC358E4C7E9D3_CC820348323EA4E0_6039_DP""","""CC(OCCOC1CCNCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""881FBB31650570AE_CACFE6DD8D693DC5_6039_UN""","""CC(OCCC(N(CC)CC)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""88742FB5F50D2957_95264AEB803C690A_6039_UN""","""CC(OCC(NC(CC)(C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""F76E3E3BA687626C_1A2E4BD1A5EA157C_6039_UN""","""CC(OCCC1=C[N](CC)N=N1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""839C58B160AB3608_D27ACD8983F140B0_6039_UN""","""CC(OCCC1=CC=CC(=C1)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""0DB3E41F34A40036_57274A2F1E5EB0AB_6039_UN""","""CC(OCCN(C)CC(F)(F)F)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""1EEFBE8CF17CECC5_914BA65A43CEE677_6039_UN""","""CC(OCCN1CC(C(C)C1)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""EDA3CFD058F60273_83EA07E2D5D1B4DD_6039_UN""","""CC(OCC1=N[NH]C(=C1)C(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""BF6C1A485B1AB982_5FFF300916FCA00A_6039_UN""","""CC(OCCN1C[C@H]([C@@H](C)C1)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""506D57A7100A0ACC_E4A9CC3382FD0A07_6039_UN""","""CC(OCC(C1=C[N](C)C=N1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""96F0C7E2E5FEFDF8_67284F25D2D2D539_6039_UN""","""CC(OCC1=C(OC)C=CC=N1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7F9FD3927B3E887F_AF3563C31DBB8D73_6039_UN""","""CC(OCC1=C(N=CC(=C1)C)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1851D8D86BB14192_93918F5FF271B470_6039_UN""","""CC(OCCN1CC(F)(CC1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""029088BDF6823B83_92C8246C2301F897_6039_UN""","""CC(OCC1=CC(=NC=C1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""C270054A9E022A96_A7D5E98A3663CE0F_6039_UN""","""CC(OCCOC(C)(C)C(=O)O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""617DE1FBA58D45D9_9BB16A3C01250C16_6039_UN""","""CC(OCC2CC1OCCC1O2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""A58A9A85EC191684_0E3B3A276161FF53_6039_UN""","""CC(OCC(C1=CC=C(C)O1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""28DCC23FA9053575_68945ED7D80B1FB3_6039_UN""","""CC(OCCCC1(C(O)=O)CC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""49F086399963B76F_A371D00FFB2D9635_6039_UN""","""CC(OCC1=C(COC)OC=N1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3BB704415C4F6F0D_D5B88F1E44893FE8_6039_UN""","""CC(OCCC1CC(C)(C)OC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""2601129C18C47A55_DF6310C0F0240BF2_6039_UN""","""CC(OCCC1NC(=O)NC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E24C6F0ABABCC511_1794CD55204C1C10_6039_UN""","""CC(OCC1=NO[C@@H]2COC[C@H]12)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""895B4B58395052A8_23D85DA591337873_6039_DP""","""CC(OCC(C1CCCNC1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8D68073B22E9410D_B0AF8783E466FD70_6039_UN""","""CC(OCC1=CC(=NO1)COC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4BD9302B28138CD5_D69E6A799B435099_6039_UN""","""CC(OCC1=NOC(C(O)=O)C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""A347A1DBDAE903BD_E7A4E0F1461D168E_6039_UN""","""CC(OCC1=CC(=NC=N1)OC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""7AB28F43C7A3FE32_D1D9E5135F14A4C0_6039_DP""","""CC(OCC1=C(CCN)OC=N1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""56F0AE7EC7C8534B_B4C716E5D73C8F23_6039_UN""","""CC(OCCC1=CN=C(C)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1E846DFDCDF68806_4268D2AD241AE67B_6039_UN""","""CC(OCC1=C(C)C=C(N=C1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""666370564FCCED4C_9A984F51837D0B9C_6039_DP""","""CC(OCC1CNC(CO1)(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""1FE0E35DAB494C40_0BDD604F509C8175_6039_DP""","""CC(OCC(C1CCNCC1)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""3720E1951DC4C465_BED9586560A0D100_6039_UN""","""CC(OCCOC(C#N)C1CC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""9E0CC9D63EB8328A_0D980E42CE76FF5C_6039_UN""","""CC(OCC1CC(=NO1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""078346545F88ED4F_B0DE770A934F4599_6039_UN""","""CC(OCC1=CC=NC(=N1)OC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""853870198720B1B3_3BA663FA5D544E1D_6039_UN""","""CC(OCC1=C(ON=C1OC)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""F3DF5CB59996C3F0_0E8DFCD5849704FA_6039_UN""","""CC(OCCOCC(OC)OC)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""477902383BFEFC4C_308F55A997DE4F38_6039_UN""","""CC(OCC1=NC(=CC=C1)C#N)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""0AEA01B35462EC86_5EA92056C9644DCC_6039_UN""","""CC(OCC1=NNC(=O)NC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4370E47810241DA4_BDEDBA7D48434447_6039_UN""","""CC(OCC1=N[NH]C2=C1CCC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""B86012C3C0ADF102_CBE4C870801BECD6_6039_UN""","""CC(OCCC1CCN(C)CC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""6E4A2A2B2A82B109_C684603433355B23_6039_UN""","""CC(OCC1=NOC(=C1C)CC)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""6B458496D62B69B8_361AFFD477D0BF30_6039_DP""","""CC(OC[C@H]1CNCC(O1)(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""6054D39C7E4FBBE2_5097B0D5B3C06774_6039_UN""","""CC(OCC1=NOC(=C1)C(F)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""5A089FA175BCEA0B_2AB79F0763A1E72C_6039_UN""","""CC(OCC(F)C1CCOCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""E99B5646B3F7F1D5_3C0FBDD35EE31054_6039_DP""","""CC(OC[C@@H]1CNCC(O1)(C)C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D39AB0AFE0F92124_BF35DB44CD9E055F_6039_UN""","""CC(OCC(C1=C(C)OC=N1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""FF139943DFC32BED_86A4BFF1EBD1AF31_6039_UN""","""CC(OCC1=N[N](CCF)C=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""B0200253B446C27C_D1DE67264E9D5443_6039_UN""","""CC(OCC1=CN=C(O1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""6A3562208D3D897B_BE567FC32F7A420A_6039_UN""","""CC(OCC(N(CC)C(C)C)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""4C9FD1603CC2ACE2_EB7E8B783C891464_6039_UN""","""CC(OCC1=NN=C2[N]1CCC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""DBC51B766E1A25BF_ED22FA1F00AFD591_6039_UN""","""CC(OCCCOC1CCOC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""4590D45401F36C8F_F1B85CA9133A458B_6039_UN""","""CC(OCC1CCC(F)(F)CO1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""97CFC5BE7D493545_930B321D99BC4475_6039_UN""","""CC(OCC(OC)C1CCCC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""BA2D6FA2C5D97290_4480859EA1D42B1A_6039_UN""","""CC(OCCC1CC[S](=O)(=O)C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""80FF5FF50F8B0304_26785268F1068AF5_6039_UN""","""CC(OCC1=NN=C(C(C)C)O1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""441EFB182ADD09D4_D8D3D8190E13718A_6039_UN""","""CC(OCC1=NC=N[N]1CCF)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8744234276A4907C_A06B5C19C23001F1_6039_UN""","""CC(OCCCCC(C)(C)C#N)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""3CC302CF3DA03CA3_4341A09B9BB0174D_6039_UN""","""CC(OCC1=C(CC)ON=C1C)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""77B95F6B23A629AF_721A926A293FC23C_6039_UN""","""CC(OCC(=O)C1COCCO1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""45CBDDDA1CD8787F_676B3AE6CA96382D_6039_UN""","""CC(OCCC1CCCC1(F)F)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8D6A7030B6DC0C1C_635A241B56911C2F_6039_DP""","""CC(OCC(C1CCNCC1)=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""29ABEBBBFB54DB12_A775F9A49B080A09_6039_UN""","""CC(OCC1OC(=O)CC12CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""0F1D73BD54ECFC32_0702F9D4A78F3D20_6039_UN""","""CC(OCC1CN=C(O1)C2CC2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""DBCC2365F9525197_45390543983C48C7_6039_UN""","""CC(OCCCC1=CC=NC=C1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""8A635D0C17D6EFBE_D1D237354E4A2F61_6039_UN""","""CC(OCCN1N=C(C)OC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""59EB88CE3FBB9385_541DD59BFF292D31_6039_UN""","""CC(OCCC1CCC(C)CC1)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
-"""D4CCE927A31C866B_B16219D3A7E78964_6039_UN""","""CC(OCC1=NO[C@@H]2CCC[C@H]12)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""E33CFBE3E9EF62FA_888BCB29D4552116_6039_UN""","""CC(OCCN1C2CCC(C1)C2)C4=NC3=C(C=CC=C3)[NH]4""",21,"""927015E9494BE6EB"""
-"""BF9F0E416DD0A61B_1386593D4EB1432C_6039_UN""","""CC(OCCOCCOCC#C)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
-"""547BFC10A64A60EC_BEF1BB7FD3136F90_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCCCCC""",21,"""68F85F658E66E5F3"""
-"""E5D297155A11C6EE_0742F551021A868D_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=CC=C[NH]3""",21,"""68F85F658E66E5F3"""
-"""CD90C3E15ADEFC0C_00E438F04A19D70F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(NC(OC)=O)=O""",21,"""68F85F658E66E5F3"""
-"""8E15ED917BCEE3BE_AEC217741C90E866_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(NNC(C)=O)=O""",21,"""68F85F658E66E5F3"""
-"""5DADF171E141C411_0021D3A7F08B4FAF_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOCC(F)(F)F""",21,"""68F85F658E66E5F3"""
-"""4AA088D63A748D92_B155CA10D4D12D71_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCOC(C)=O""",21,"""68F85F658E66E5F3"""
-"""7673C5F31537F2CA_925AD4A5B02549FC_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(C(OCC)=O)=C""",21,"""68F85F658E66E5F3"""
-"""194BC7DAC8E763EC_C00506DD68866F0E_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CSC(=N3)CC""",21,"""68F85F658E66E5F3"""
-"""FD3063AFBEE5F7E3_6E74D3AB465EEBF3_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC(=NO3)CC""",21,"""68F85F658E66E5F3"""
-"""B8CC382ACC240C53_2E5C3D4EECCF6A4A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(N(C(C)C)C)=O""",21,"""68F85F658E66E5F3"""
-"""6A325C3BD9E2BB0E_D58D42EF8D758366_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(NC(NC)=O)=O""",21,"""68F85F658E66E5F3"""
-"""EE238725490CF6DA_799D75B4BFFE26C1_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC(NC(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""CDA82824AA28D498_DC4238E9D52ADA4A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN3CCCC3=O""",21,"""68F85F658E66E5F3"""
-"""5BC9E477F8D01EAD_4FEB1163E269E3D5_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOC3CCCC3""",21,"""68F85F658E66E5F3"""
-"""6D44688C3DEBE3A9_C52C08EEB2CE5017_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC(N(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""11F199D8AD507109_4169F6D31E50AA22_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NOC(=N3)CC""",21,"""68F85F658E66E5F3"""
-"""FB8CFC14245A8AAB_8C8E956A4A207D13_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN3CCCCC3""",21,"""68F85F658E66E5F3"""
-"""87BF2A7C7AEAF768_B7FBAFCC40D70DE8_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC[N]3C=CC=N3""",21,"""68F85F658E66E5F3"""
-"""F5B841B8C9836567_8F07BE6C0D996789_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC[N]3C=CN=C3C""",21,"""68F85F658E66E5F3"""
-"""77809D0FF1F289FA_1D009BFC06928DA4_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC(=C(O3)C)C""",21,"""68F85F658E66E5F3"""
-"""1FBDCCC332C55385_8E205BD77D35C0DD_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOCCC(C)C""",21,"""68F85F658E66E5F3"""
-"""5CEAB11DA207EA00_B0295E509ADF1523_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCN3CCCC3""",21,"""68F85F658E66E5F3"""
-"""3B9958FD8749EBAD_4576D77CBA92F04F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC[S](CCC)(=O)=O""",21,"""68F85F658E66E5F3"""
-"""53E43096030D62C6_3F5A0D57B211DC57_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)SC(=C3)C""",21,"""68F85F658E66E5F3"""
-"""FA7522D1C4FE014D_584AA02318E00A1F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3COC(C)(C)O3""",21,"""68F85F658E66E5F3"""
-"""4BFDFE1504C50DEF_D45BE5320D2ADED5_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3OCCN(C)C3""",21,"""68F85F658E66E5F3"""
-"""32E0551B6ACD6C55_1BA6257F885FA174_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=[N](=O)C=CC=N3""",21,"""68F85F658E66E5F3"""
-"""B767A4ABCD3E3152_E5DEE1E02AFDA6FB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=C(C)N=CS3""",21,"""68F85F658E66E5F3"""
-"""418D92964D9F5183_B1BC5CB11A013A84_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN3CCOCC3""",21,"""68F85F658E66E5F3"""
-"""4CD47AC1105FF5D3_BC92578F43C90D7C_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN[S](CC)(=O)=O""",21,"""68F85F658E66E5F3"""
-"""0C5460205661F0D5_A3DC31A72DCBFDFA_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CN=C(C)C=N3""",21,"""68F85F658E66E5F3"""
-"""003CF1ED09A846C1_E473EB766D25F24B_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC(OC(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""D9584BBFCBBD3C9D_1580184F9C5C4B11_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC=C(CC)O3""",21,"""68F85F658E66E5F3"""
-"""09FC3AFD4EDA7A4C_8A6B4A7767B1A067_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3ON=C(CC)C3""",21,"""68F85F658E66E5F3"""
-"""EE9DC2692C3D6436_F13357F769AA8C9A_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3NC(OC3)(C)C""",21,"""68F85F658E66E5F3"""
-"""FB2E78DDDCAB630D_4FB73A36B2B29D88_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC[S](CC)(=O)=O""",21,"""68F85F658E66E5F3"""
-"""0E97E037165B5B53_9DB730E8C7E266F2_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCNC(=O)C3CC3""",21,"""68F85F658E66E5F3"""
-"""BCCEF747C3A691A1_F25FF93FD5649884_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3CCOC3=O""",21,"""68F85F658E66E5F3"""
-"""5DB0603A0EDE6A2C_304492F1371C8BA6_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3CCCCC3""",21,"""68F85F658E66E5F3"""
-"""5307D1A6240FC6FB_513F341CAEC3336B_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC(OC)OC""",21,"""68F85F658E66E5F3"""
-"""5B947196DE796D48_A5B5B2F2791ED248_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)OC(O3)=O""",21,"""68F85F658E66E5F3"""
-"""34409A86D3F96E92_07C4516402D20F78_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(N(C)C3CC3)=O""",21,"""68F85F658E66E5F3"""
-"""9AC1EB69A069B8F1_ACAB3566D7A21433_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCN(CC)CC""",21,"""68F85F658E66E5F3"""
-"""BB31C75648CD2A03_18C519E09B3D252A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=C[N](C)N=C3""",21,"""68F85F658E66E5F3"""
-"""074E3082FDA1DEE1_CE3087CC81A25050_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CN=C(C)C=C3""",21,"""68F85F658E66E5F3"""
-"""12BEA23C539135B8_3F512801712F1BFA_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC[S](C)(=O)=O""",21,"""68F85F658E66E5F3"""
-"""242A244A90427D26_ABFE8D7CAFC94F02_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=CC(=C3)N""",21,"""68F85F658E66E5F3"""
-"""93ACCF55E1A84E48_2EFEA333F8E0C761_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3N(C)CCC3""",21,"""68F85F658E66E5F3"""
-"""8EA67AEA84133F89_9DB743CFAFDBF43C_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN3CC(C)CC3""",21,"""68F85F658E66E5F3"""
-"""D4EB1FE078EFCA78_0B416EB7C165041B_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN3CCSCC3""",21,"""68F85F658E66E5F3"""
-"""AC6534F8E5BF6BAB_57F0F38BBE2B09AC_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOCCN(C)C""",21,"""68F85F658E66E5F3"""
-"""5D67ADAD0B8409F5_FDB39A69C5A1B6B4_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)C=CN=C3""",21,"""68F85F658E66E5F3"""
-"""82F4944B1D5E3D95_C99ED9233B0C33B4_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCSCC(C)C""",21,"""68F85F658E66E5F3"""
-"""F3AAB5975642B92A_FED6E3C390C48DBB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCC(F)(F)F""",21,"""68F85F658E66E5F3"""
-"""B67DD0535F7289C9_01891EAEEDBF7DB5_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=CN=CC=C3""",21,"""68F85F658E66E5F3"""
-"""C220DAA273F98560_9A221BAB47474D87_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(OC)(OC)OC""",21,"""68F85F658E66E5F3"""
-"""2B542BC52A860C8A_B4037881EA7B434F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC(=O)NC3CC3""",21,"""68F85F658E66E5F3"""
-"""CFA2FA5183347967_D5484123CB0B2E9E_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)NCC3CC3""",21,"""68F85F658E66E5F3"""
-"""F886EC0F2A6614BC_AAA55AA34151D105_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC(NC(N)=O)=O""",21,"""68F85F658E66E5F3"""
-"""AC923AD6ED24C1CD_5A23ABFFF650B3D6_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC=C[N]3CC""",21,"""68F85F658E66E5F3"""
-"""EE01B248FBCDF096_63D360BED05E51A1_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC[S](NC)(=O)=O""",21,"""68F85F658E66E5F3"""
-"""C201DD58763AEB06_A2EDF54A86B558A6_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=N[N](C(=C3)C)C""",21,"""68F85F658E66E5F3"""
-"""2E43141B0F8358E8_D4B661918185BD0E_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC(=C(S3)C)C""",21,"""68F85F658E66E5F3"""
-"""DF2CCFAA651A3C55_BF80A23BDA56BE97_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC=C(C)C=N3""",21,"""68F85F658E66E5F3"""
-"""B7C59C14623D15EC_42692BD84EB45BD4_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC[S](C(C)C)(=O)=O""",21,"""68F85F658E66E5F3"""
-"""E607C325840036BE_2C094659BF8A239C_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=CC(=N3)C""",21,"""68F85F658E66E5F3"""
-"""6D3A64C97278A18B_74741E9CB64115B6_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3CCCC(=O)N3""",21,"""68F85F658E66E5F3"""
-"""D9B9F28F556CF563_E4371A676C483A9E_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)C=CC=N3""",21,"""68F85F658E66E5F3"""
-"""972E7B05FE2B81DD_DE451F8D5F5003B2_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(OCC(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""9E50F17143ACF6D4_89E0F020178C3169_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=CSC(=N3)C""",21,"""68F85F658E66E5F3"""
-"""7AD9C651CA69A79F_CE92218AA8C312AF_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)[N](N=C3)C""",21,"""68F85F658E66E5F3"""
-"""11032939B34559B7_919000DB8C80540A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(NCC(F)F)=O""",21,"""68F85F658E66E5F3"""
-"""CAA0D9D587D5D604_212C6BD4E53CF588_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC=CC(=N3)C""",21,"""68F85F658E66E5F3"""
-"""7E570C2800E273C3_F54D85A01E56B8F0_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)N3CCCC3""",21,"""68F85F658E66E5F3"""
-"""F32FC67B5E101F06_7E6191C5D453D3B4_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(NCC(O)=O)=O""",21,"""68F85F658E66E5F3"""
-"""B74E984DFB251F2B_2D9EDC56F4203A24_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(OCCCC)=O""",21,"""68F85F658E66E5F3"""
-"""F37A737343E57EF9_BB2176F359F972F6_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOC(N(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""67D3591F6FD20DDE_08CE9156602F7A20_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3CCOC3""",21,"""68F85F658E66E5F3"""
-"""607F650D1284BFAA_4D29A8CF3E2ABB93_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=CN=C[N]3C""",21,"""68F85F658E66E5F3"""
-"""9A8FA70334224E24_0D0DB8898D7D84A5_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC=C(F)C=C3""",21,"""68F85F658E66E5F3"""
-"""73ECEADEAB28859D_6A7401ED30DF8927_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CN=CC(=C3)F""",21,"""68F85F658E66E5F3"""
-"""6C445EEF0EB7D1F6_E3BBDC122AED06C3_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3CCCNC3""",21,"""68F85F658E66E5F3"""
-"""68742123AD90E265_1DF902A71F0FB846_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CN=CC(=C3)C""",21,"""68F85F658E66E5F3"""
-"""38FEF4572E55C063_616EC84535558C45_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC(N(OC)C)=O""",21,"""68F85F658E66E5F3"""
-"""D1970102F82E8A7B_A1C6F5BC636B010A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=CC=N[N]3C""",21,"""68F85F658E66E5F3"""
-"""FC5E263551793006_27F1447BC3619B7A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=NC=CS3""",21,"""68F85F658E66E5F3"""
-"""34229AAD3BB60AAA_4A4247328E1FC950_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=CSC=N3""",21,"""68F85F658E66E5F3"""
-"""693C8368A7F178B3_2E7C9FF834C1802B_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(F)C=CC=C3""",21,"""68F85F658E66E5F3"""
-"""89A650D2B9A18851_F46B707E5C0C56CE_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC=N[N]3CC""",21,"""68F85F658E66E5F3"""
-"""119A94DAB8BDE594_8E911ABBB34EC73F_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCCCCN""",21,"""68F85F658E66E5F3"""
-"""DFFBDB11844CDC71_62CAF64F92A19961_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3CCCC3""",21,"""68F85F658E66E5F3"""
-"""DE341401C0C65153_327CA2FA0D29C9CB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCSCCOC""",21,"""68F85F658E66E5F3"""
-"""5DBEF6F89B402EF5_C8FC9E93E52F91C4_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3C[S](=O)(=O)C3""",21,"""68F85F658E66E5F3"""
-"""A3EF750012C69FE7_7D39D40232B6C066_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NNC(C=C3)=O""",21,"""68F85F658E66E5F3"""
-"""3B7FA2EF140624C9_49A258575B79AAD6_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=NC(=N3)C""",21,"""68F85F658E66E5F3"""
-"""3B837D23BD86781E_15D3CAD74F14A109_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CN=C(C)N=C3""",21,"""68F85F658E66E5F3"""
-"""978B41B3F4B123A7_71E1850C9B22980D_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=CC=NC=C3""",21,"""68F85F658E66E5F3"""
-"""3C285E1CFDD41E57_56CF15B7FB402513_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=NC=C[N]3C""",21,"""68F85F658E66E5F3"""
-"""711945980DE63FA1_360132423E8AA54C_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(C(OC)(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""4C5E19E30A6F8C20_75AD5DB0C2DB6E26_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(C)O[Si](C)(C)C""",21,"""68F85F658E66E5F3"""
-"""7E3807014502A450_367D969D9472C81A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(CC(C)(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""51184E2342CD758E_8B9897EEA9E15265_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(C(CC)(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""3599F0A997BACDD9_D5FA94FE6699F3B7_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)N=CC=C3""",21,"""68F85F658E66E5F3"""
-"""E624D9678A49AD24_CB5FA946D4B6204C_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN3CCNC3=O""",21,"""68F85F658E66E5F3"""
-"""091FB2BC02A2CE9C_CF5F3FBE5C2CFB17_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(OCC)OCC""",21,"""68F85F658E66E5F3"""
-"""1CA4470C521C6463_015C090DBD068E1D_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3(OC)CCC3""",21,"""68F85F658E66E5F3"""
-"""CBA220E50D34082B_9752FD5D524449CF_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3CCNC3=O""",21,"""68F85F658E66E5F3"""
-"""68DFEFD36A08ED99_D292C103E063746D_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC(=NC=N3)C""",21,"""68F85F658E66E5F3"""
-"""316453DF53065762_579F4D0408A04B3F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(SN=C3C)C""",21,"""68F85F658E66E5F3"""
-"""0EF80325AABC42A4_8D8769395B4E8989_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC=C(F)C=N3""",21,"""68F85F658E66E5F3"""
-"""92683C889C8C7B5C_AE1E82C81778A8A4_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=N[N](CC)C=C3""",21,"""68F85F658E66E5F3"""
-"""BB24137965EEAE97_1EE4C464FE7ECF06_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC(=NO3)CC""",21,"""68F85F658E66E5F3"""
-"""64A8548CFD6A7AA7_48CCC5D5655D8AFB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(ON=C3C)C""",21,"""68F85F658E66E5F3"""
-"""F9E363A83DDFB6AE_3452F63BD49500CB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(CC(F)(F)F)=O""",21,"""68F85F658E66E5F3"""
-"""0668D8EF392DE1F9_BB91D6D32CCDB209_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC(OCC)=N""",21,"""68F85F658E66E5F3"""
-"""8FF311E8D43AD684_6102E32B037D3B60_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=C(C#N)S3""",21,"""68F85F658E66E5F3"""
-"""816B8CBB6953626C_460561995D53BA4E_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CON=C3CC""",21,"""68F85F658E66E5F3"""
-"""0658D9353FF68074_8FBAF00F75C7DF6E_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC(C(OC)=O)C""",21,"""68F85F658E66E5F3"""
-"""E1B6D9EB8CFB46FD_22EB6FA96809CF5C_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCCC(C)C""",21,"""68F85F658E66E5F3"""
-"""ADD891476DBB9FC9_DA6879D8043FFAD8_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3CCOCC3""",21,"""68F85F658E66E5F3"""
-"""B3E3849EE69B4B21_2A5F55A0A0122ED6_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(CCC(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""7D9F1F0A267CB009_F3A7FB7C5924F7E4_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC3=C[NH]N=C3""",21,"""68F85F658E66E5F3"""
-"""E7DD5E9F9C4FEA43_46C262909DE0C07B_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3CCNCC3""",21,"""68F85F658E66E5F3"""
-"""9DD5A6F76B6ED3B1_2DF8BC7B970C2347_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=CC(=N3)F""",21,"""68F85F658E66E5F3"""
-"""4CFBD19034C44485_9710F3C0B88B0C70_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3CN(C)C(O3)=O""",21,"""68F85F658E66E5F3"""
-"""1AF1E9AFB40B8434_A06F60E4BCC72902_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=CCCCC3""",21,"""68F85F658E66E5F3"""
-"""A9DED51DD3BDB447_F927AC7CB5DF3251_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3OC3CCCC""",21,"""68F85F658E66E5F3"""
-"""73776F693ECCA359_D06A412C7FC52694_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(N=C(C)O3)C""",21,"""68F85F658E66E5F3"""
-"""2CC3C46CA719A9A9_4C898626A2985788_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN3CCNCC3""",21,"""68F85F658E66E5F3"""
-"""BA438BC3CBDE3F01_66FCD962C6C5FF9E_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3OCCCO3""",21,"""68F85F658E66E5F3"""
-"""8B16F964272A339E_687A1C27F6EAA202_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC(C)(C)C#N""",21,"""68F85F658E66E5F3"""
-"""B5568EB2CEA81D63_564F51B4584C08C1_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(N=C(C)S3)C""",21,"""68F85F658E66E5F3"""
-"""F4CD4FBBA7B2DAC7_E135CB27897112B5_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC[S](=O)(=O)Cl""",21,"""68F85F658E66E5F3"""
-"""EB06EB25C169248D_34FA762BA71AF4EB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NN=C(CC)O3""",21,"""68F85F658E66E5F3"""
-"""DC1E7FB8C97FF5D8_CE1134DB47C42CF8_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C[N](N=C3C)C""",21,"""68F85F658E66E5F3"""
-"""AB2D157E30C2A4D4_90BA6B6A885325ED_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN(C(OC)=O)C""",21,"""68F85F658E66E5F3"""
-"""23C1B8D1A99CD7FD_C272E799B783437A_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC(=NC=C3)N""",21,"""68F85F658E66E5F3"""
-"""A3C87D98EC2233FD_32CF1B868F4329E2_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3CCCC3=O""",21,"""68F85F658E66E5F3"""
-"""61FC6B2FBEA16F7B_527BF2C20798B223_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CN=N[N]3CC""",21,"""68F85F658E66E5F3"""
-"""5D0227D9E892411A_E76BFE4102513F3E_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(F)C=NC=C3""",21,"""68F85F658E66E5F3"""
-"""6FDC4CE6C6627EBF_9D42BB802DBF1A6D_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC(=NO3)OC""",21,"""68F85F658E66E5F3"""
-"""76E0E376DED25B28_19D9DA45754A31F2_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=N[N](CC)N=C3""",21,"""68F85F658E66E5F3"""
-"""ABE35A6163BF8077_28AA5C889A4BD815_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC(=NS3)OC""",21,"""68F85F658E66E5F3"""
-"""FFB79718215F9333_41F5041FBB57A516_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC=NNC(OC)=O""",21,"""68F85F658E66E5F3"""
-"""E004E2A3CCF29FE7_A0E1F5BDE09D2B3A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(OC)CC(C)C""",21,"""68F85F658E66E5F3"""
-"""529079345A421B34_68A4BE6ECC4E99ED_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOCC3CCC3""",21,"""68F85F658E66E5F3"""
-"""AEE7646429A717EA_8B9FFB21A23019A3_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC(=CS3)C#N""",21,"""68F85F658E66E5F3"""
-"""1235115ABDE6AE60_85C88ED393E3CAAB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=C)C[S](=O)(=O)Cl""",21,"""68F85F658E66E5F3"""
-"""81D1431E657AF4DF_FBF3B3A5F0BA939F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3CN3CC4CC4""",21,"""68F85F658E66E5F3"""
-"""7DBC9971F47324E1_929675B431323B05_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C[N](CC)N=N3""",21,"""68F85F658E66E5F3"""
-"""3E8F61A1E85B6BF0_E7AF901C999B8499_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(N=[S](C)(=O)C)=O""",21,"""68F85F658E66E5F3"""
-"""306FD2B905570B92_0311F85BEC7A0CD2_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN3CCOC3=O""",21,"""68F85F658E66E5F3"""
-"""4BBDDFCA3F8E4950_EB0DFF83C985E813_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC3CCOC3""",21,"""68F85F658E66E5F3"""
-"""C313C39504CDBAA5_48804DD9F14AF967_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3CN3CC(C)C""",21,"""68F85F658E66E5F3"""
-"""9070A684E8B9FD8B_C64AAD2CAC61545C_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC(C)(C)C3CC3""",21,"""68F85F658E66E5F3"""
-"""9192EA2B19C65729_909982BD38CE08B0_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC3=NN=N[NH]3""",21,"""68F85F658E66E5F3"""
-"""CF9EDF60BDB3A1B8_628BCF029FEEAA12_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=NOC(=N3)C""",21,"""68F85F658E66E5F3"""
-"""93FCDF398C3A2E83_9D076358817B3539_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOC3CC3(F)F""",21,"""68F85F658E66E5F3"""
-"""E5FBF285480D0FE3_6B6E09FE9874E1AA_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3CCC[S]3(=O)=O""",21,"""68F85F658E66E5F3"""
-"""C56204C1BBE50F79_6602E287F9B2EA4B_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C[N](CC)N=C3""",21,"""68F85F658E66E5F3"""
-"""4CC3EF6BB7DE4218_1F8F352254652828_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(OC)C3CCC3""",21,"""68F85F658E66E5F3"""
-"""E64E922C2B4C2C36_A151DB583EFB903B_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=NC=CC=C3""",21,"""68F85F658E66E5F3"""
-"""B4A56F5FD9027FEB_0F5020CBF24C30DE_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=CC=NS3""",21,"""68F85F658E66E5F3"""
-"""8FF06EBC82A60E99_EC8E01C8EDFB8533_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=C[N](C)N=N3""",21,"""68F85F658E66E5F3"""
-"""617D95E4BF35961C_DEA9B52620472C47_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=COC=C3""",21,"""68F85F658E66E5F3"""
-"""4932B710EFBD2710_C6F76380E13ED3B8_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(OCC)C3CC3""",21,"""68F85F658E66E5F3"""
-"""BBB53632752E5AD8_B20786E8149480D5_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC(CCC)C""",21,"""68F85F658E66E5F3"""
-"""939E1FDC8F44B1C9_854F70A9AA4F23E1_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)C=NC=C3""",21,"""68F85F658E66E5F3"""
-"""063EAAA433A12267_C9FA0BF176E901D1_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC(=NC=C3)F""",21,"""68F85F658E66E5F3"""
-"""D3A244FE24779A26_53D1D61DBCB01475_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=CC(=C3)F""",21,"""68F85F658E66E5F3"""
-"""16A892ED6B169156_C6563C3E046678DB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NN=C(CC)S3""",21,"""68F85F658E66E5F3"""
-"""B62F2D213A2F4EF9_9EA051DF50DB66BD_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC(=C([NH]3)C)C""",21,"""68F85F658E66E5F3"""
-"""7FA764FF848B9A28_C7F75F3A9907F618_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)N=CC=N3""",21,"""68F85F658E66E5F3"""
-"""4447FCD671826EB9_B5A9BD5A5AC5B532_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC(=NC=C3)C""",21,"""68F85F658E66E5F3"""
-"""12B5D57BE3ABE2C9_1769ED8273213443_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCSC(C)(C)C""",21,"""68F85F658E66E5F3"""
-"""25023E1FE550D10E_B7B642B6FC89C1E3_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3OCC(C)(C)C3""",21,"""68F85F658E66E5F3"""
-"""A30C22AADC7B42C6_731E178641E55E4C_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=NN=N[N]3C""",21,"""68F85F658E66E5F3"""
-"""216E57CCE59904AB_E4DC7832FE3C07AB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOC(C(C)=C)=O""",21,"""68F85F658E66E5F3"""
-"""9BD2283D72A71F7E_9C64D672136D0A14_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCC(OC)=O""",21,"""68F85F658E66E5F3"""
-"""9500368D79E6C9C0_F085DBA728655F3A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(N=C(C)[NH]3)C""",21,"""68F85F658E66E5F3"""
-"""FBD44F6C2D8A5C1E_16CC0D67B20D5103_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CSN=C3OC""",21,"""68F85F658E66E5F3"""
-"""337A38B50178FFF8_27C42D7967ADA23F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=C(C#N)O3""",21,"""68F85F658E66E5F3"""
-"""7CC2C73253136D0B_51254A859EE80659_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(CC(OC)=O)=O""",21,"""68F85F658E66E5F3"""
-"""3685CEDE1C04614B_5019BAEC13DACE4F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC[C@@H]3C[C@H]3C4CC4""",21,"""68F85F658E66E5F3"""
-"""FE0CA97535A46F46_D63CEF242CFD0395_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC(OCC)=O""",21,"""68F85F658E66E5F3"""
-"""5EC913CF698975FC_7B87621FDD37D50F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC3=NC=C[NH]3""",21,"""68F85F658E66E5F3"""
-"""B8FEF05BDA93CD4B_E043300AECA2C4BA_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(N(CC)CC)=O""",21,"""68F85F658E66E5F3"""
-"""9181503C214576D5_32D22FD38DCED5D2_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)C=CC=C3""",21,"""68F85F658E66E5F3"""
-"""A0ACC7FCF2917587_0C800633E40D012B_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(NC(CC)C)=O""",21,"""68F85F658E66E5F3"""
-"""D6B41CD9ED7725DA_5B0BE95DAF9878E2_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(C(OCC)=O)=O""",21,"""68F85F658E66E5F3"""
-"""C7F886225E78C9B1_4383F96FAF156A9D_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCOC(F)(F)F""",21,"""68F85F658E66E5F3"""
-"""B06DF744D54DA702_F4142C93D1F2DF5F_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=CC(=C3)O""",21,"""68F85F658E66E5F3"""
-"""02E2C8D6AFB1A084_C2BF894A3BC0B73F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=C(F)C=C3""",21,"""68F85F658E66E5F3"""
-"""BDCA84868BF696AB_43BDE9D2EFE5FA03_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(F)C=CN=C3""",21,"""68F85F658E66E5F3"""
-"""B88D8A3D4DC6F226_52D7453AE6F6B993_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=C(C)C=C3""",21,"""68F85F658E66E5F3"""
-"""01808B87240997DF_5FBBC76A94726901_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=CC(=C3)C""",21,"""68F85F658E66E5F3"""
-"""9DB41FBC180B8288_DB0C7C878433315C_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NN=C(C)[N]3C""",21,"""68F85F658E66E5F3"""
-"""79DFD2E1E31E02A5_7B1DB103F85C4435_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(NCC(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""D8AD399850B7D75B_B037FA18EA76C999_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(NCCCC)=O""",21,"""68F85F658E66E5F3"""
-"""D0D67136B410F9B5_025B2365EB9883D4_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC3CCCC3""",21,"""68F85F658E66E5F3"""
-"""C7AADC21FC811CA7_A28AAB10BD6FFA61_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCOCCOC""",21,"""68F85F658E66E5F3"""
-"""0EF9392D31FEE8AC_188093A132A104CB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCC(C)(C)C""",21,"""68F85F658E66E5F3"""
-"""E418006FBD19106A_6694774EE2317387_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=NN=C[N]3C""",21,"""68F85F658E66E5F3"""
-"""5A9C1EF5AF1EEB21_FA13672C16E6307F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC(C(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""B8C32FB76622270E_9CD71FEC507488EB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC[S](C(F)(F)F)=O""",21,"""68F85F658E66E5F3"""
-"""D8BB3352AD373257_429D6417121D5E12_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOCCOCC""",21,"""68F85F658E66E5F3"""
-"""2513214B4C032887_E34150A8B2D0D209_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CN=C(CC)O3""",21,"""68F85F658E66E5F3"""
-"""F11EAA14605958BE_ACDF5D61AAF1C1D3_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOC3CCOC3""",21,"""68F85F658E66E5F3"""
-"""5F9C820F02C9023D_C4192182FA7F0794_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=NN=C(C)O3""",21,"""68F85F658E66E5F3"""
-"""86B121DC0E178896_098ED74E986A1EE6_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=CC(=N3)O""",21,"""68F85F658E66E5F3"""
-"""831AB69CE11E3C71_E16F5829202BE5AA_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCCCC#C""",21,"""68F85F658E66E5F3"""
-"""C35F4D1FBEA2AA8F_5E05E559FB6662EE_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=N[N](C=C3C)C""",21,"""68F85F658E66E5F3"""
-"""6D8D7889913ED9A7_BD93B5D2691006E8_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3OCCNC3=O""",21,"""68F85F658E66E5F3"""
-"""5B12313038D5E903_4A0D8ECC379147B1_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CSC(=N3)CO""",21,"""68F85F658E66E5F3"""
-"""C2ADC738E260A446_B7A3AF59EBE2F878_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCOC3CCC3""",21,"""68F85F658E66E5F3"""
-"""0431E38F00FE9521_AEC01EE6B7CC5CE3_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC[N]3C=NC=C3""",21,"""68F85F658E66E5F3"""
-"""8C0FD29AECD4916D_61C8256C6B40AE83_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3OCC(F)(F)C3""",21,"""68F85F658E66E5F3"""
-"""B25F0ECD58BAE0A1_6DEA8C96644E1F60_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=CSC=C3""",21,"""68F85F658E66E5F3"""
-"""B14396765E816786_A1E444F3E75237FA_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=CSN=C3""",21,"""68F85F658E66E5F3"""
-"""15820930DA0ED2D4_585771E11A9CC99B_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3CCCO3""",21,"""68F85F658E66E5F3"""
-"""FAAC3CB573BCA52D_2CB39BF7DA3BDDC1_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC[N]3N=CN=C3""",21,"""68F85F658E66E5F3"""
-"""61F0BFA0BCC8216F_2A0D8C7C6D379259_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NN=C(C)C=C3""",21,"""68F85F658E66E5F3"""
-"""21C969E19FE65F22_94087175A9BE2511_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3OCCC3(C)C""",21,"""68F85F658E66E5F3"""
-"""AD281D5F9C35FB92_ACE1E921020B890D_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CN=C[N]3CC""",21,"""68F85F658E66E5F3"""
-"""29B779FC9422F525_499F94833B04B76A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC(C(F)F)(F)F""",21,"""68F85F658E66E5F3"""
-"""FFA1ECD38391AF4E_B9A949AB3683E4D2_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=CC=C[N]3C""",21,"""68F85F658E66E5F3"""
-"""5AB8319C9482F590_E80423C5930FDCA5_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOCCC(C)=O""",21,"""68F85F658E66E5F3"""
-"""4BFDFE1504C50DEF_7EB065A09D9289B3_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3CN(C)CCO3""",21,"""68F85F658E66E5F3"""
-"""778CA4B7238AF93B_34A34BB9DDD3DF95_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCSC3CCOC3""",21,"""68F85F658E66E5F3"""
-"""2E5C2E9E8865A52C_A600766E6C5793F2_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN(C)[S](=O)(=O)C""",21,"""68F85F658E66E5F3"""
-"""7F16143A4F195319_ED7CAE02EA8891F8_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NN=C(OC)S3""",21,"""68F85F658E66E5F3"""
-"""6D4E7885343AF41B_646B4FF7EF5622FF_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=N[NH]C(=N3)CC""",21,"""68F85F658E66E5F3"""
-"""35B8C755BA9C2875_49845496B4B2C2EB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)NCCC#N""",21,"""68F85F658E66E5F3"""
-"""676094EAFDDF4167_5A71A33D48F9A9EE_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCCC(O)=O""",21,"""68F85F658E66E5F3"""
-"""2DF0734E81EC4DAB_9EF9D0B8B34F2451_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(NC(C)(C)C)=O""",21,"""68F85F658E66E5F3"""
-"""B10DD912270031F7_7C3C9C87599B2D55_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)SC(=N3)C""",21,"""68F85F658E66E5F3"""
-"""CCA306C87DE1D4CA_5D77AF3DA0D45E67_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(C3CCNC3)=O""",21,"""68F85F658E66E5F3"""
-"""1F1772F4D6BE8644_89989C4505418EFB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC=N[N]3CC""",21,"""68F85F658E66E5F3"""
-"""89D1BB4B20A858A5_EE35A0F2D4520B74_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC#C[Si](C)(C)C""",21,"""68F85F658E66E5F3"""
-"""EAD4E428827C9F43_AE01BD629014AA8F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3=NC=CN=C3""",21,"""68F85F658E66E5F3"""
-"""059D2521197B4A3A_15F44B8C9D79E7CF_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC[N]3C=NN=N3""",21,"""68F85F658E66E5F3"""
-"""D6F8E9B71C7686F8_5BE7C9CB850201C3_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC#CC3=CC=CS3""",21,"""68F85F658E66E5F3"""
-"""1C57192B2A12257F_DEC13BEE956A7BC4_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCCC(C)=O""",21,"""68F85F658E66E5F3"""
-"""4AC8BDEC90710F55_A2CFADDA688406EF_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(CN)OC=N3""",21,"""68F85F658E66E5F3"""
-"""EFF09AB2AD0D83C8_49F0E93C886BA5CB_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3CC[S](=O)(=O)N3""",21,"""68F85F658E66E5F3"""
-"""A68840B992231372_ACFF98B9A6586011_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC#CCOC(C)=O""",21,"""68F85F658E66E5F3"""
-"""337BBEEB5E0B9F18_A588B1CF11D91EC2_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=COC=N3""",21,"""68F85F658E66E5F3"""
-"""B6F7FB5E2988E722_813EE78CA1A706B4_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(SC=C3)C#N""",21,"""68F85F658E66E5F3"""
-"""3D53588CFFA90955_9CDACAEFF8918EDA_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(F)C=CC=N3""",21,"""68F85F658E66E5F3"""
-"""FF96C722A42B305C_D1D181558C3E3522_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=CC=CS3""",21,"""68F85F658E66E5F3"""
-"""439307A6B76E7D05_839ED0419414D375_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=CN=CO3""",21,"""68F85F658E66E5F3"""
-"""A668276E68D3BE9B_47A23B6780237598_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=CSN=N3""",21,"""68F85F658E66E5F3"""
-"""37947E33A4699CA9_73F134BDDE9E8310_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(=O)C3=NOC=C3""",21,"""68F85F658E66E5F3"""
-"""FBBF381FAF48C193_209C5767BA1850CE_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NN=C[N]3CC""",21,"""68F85F658E66E5F3"""
-"""0ABAC78B457503A1_E1679EA7FEEC52BF_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(C)C=N[N]3C""",21,"""68F85F658E66E5F3"""
-"""1A849150A56FE0CB_BBD171789431ED99_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCOCCC(O)=O""",21,"""68F85F658E66E5F3"""
-"""619763FF76FFC1E5_68B84CA058C6171F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC#CC3=CC=NS3""",21,"""68F85F658E66E5F3"""
-"""D3056BF6A6A72AD6_6AE62DA86C001C9A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3CCCCCO3""",21,"""68F85F658E66E5F3"""
-"""BEF36DFA1459CB0E_60ECF20833B50264_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3CCC(C)(C)O3""",21,"""68F85F658E66E5F3"""
-"""FEC5CE98EFFD6294_BB5F848F9D8DA1EE_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC[N]3N=CC=C3C""",21,"""68F85F658E66E5F3"""
-"""0E8D60FD07198DB7_BD54805A876D1D02_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NOC(=N3)CN""",21,"""68F85F658E66E5F3"""
-"""CA22C4E0B8E993B2_7731E9EEF019FA1F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC=CC(=C3)C""",21,"""68F85F658E66E5F3"""
-"""31FC3392F21D3A2C_D2892236A3E9526F_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3OCCNC3""",21,"""68F85F658E66E5F3"""
-"""D172D7321D3F976F_F099F5AEB797259A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=C(F)N=CC=C3""",21,"""68F85F658E66E5F3"""
-"""032C7C1B796F5FFB_459BCF25428F6917_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=CC(=N[N]3C)C""",21,"""68F85F658E66E5F3"""
-"""B2CA2AB2EE8D9B6D_F434F47A9AB707A8_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC=C3CCOCC3""",21,"""68F85F658E66E5F3"""
-"""F6A85B16B78D3064_4ABE701C9A2EC14F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3CCCOC3""",21,"""68F85F658E66E5F3"""
-"""5467438CEF68D7D1_50325ACAD1CDB919_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC3COCCO3""",21,"""68F85F658E66E5F3"""
-"""C3E1B71CDEC0E150_2419F8E9A115EE46_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NOC(=C3)CN""",21,"""68F85F658E66E5F3"""
-"""FBADBBBF3F5C3E19_65A631126A59CF98_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC(C)(C)CO3""",21,"""68F85F658E66E5F3"""
-"""B78E54553D23F745_3AABC168DC3827C9_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC#CC3=CN=CS3""",21,"""68F85F658E66E5F3"""
-"""869505F033B8E67A_4908ADAC410B5B73_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3=NC(=CS3)CC""",21,"""68F85F658E66E5F3"""
-"""B16CC5BB842FBC5B_7A53BD4BC7FF8A31_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCC(C(OC)=O)N""",21,"""68F85F658E66E5F3"""
-"""3278636E6EDFE1CB_E4938225B40D965A_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC3=NN=CO3""",21,"""68F85F658E66E5F3"""
-"""9DBCBAD265ECCDB1_7D87BFF83BD6C2C7_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCOCC3CC3""",21,"""68F85F658E66E5F3"""
-"""8719C45604468D49_36B0A19FCEAB7FD5_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC3N(C)CCCC3""",21,"""68F85F658E66E5F3"""
-"""A4DEB2E2D626A0AE_5A1D54DFED2A3D1F_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCN(CCC)CC""",21,"""68F85F658E66E5F3"""
-"""3EB7CE0F9C58542E_913AB67FC341C3B0_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCC[S](N)(=O)=O""",21,"""68F85F658E66E5F3"""
-"""177D8F27D826CF4E_8187C01409D18B12_6039_UN""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CC(CCC(O)=O)=O""",21,"""68F85F658E66E5F3"""
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-"""833C7BCAAEBA440B_C11D1988DA037636_6039_UN""","""CN(C)C1CC(C1)OCCCOC2=CC3=C(C=C2)OCO3""",21,"""E22A3BF850C98CF7"""
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-"""661CACB9CFEB9621_B2292AA722799504_6039_UN""","""CN(C)C1CC(C1)OCC2=CC(=C(C=C2)[S](=O)(=O)C)OC""",21,"""E22A3BF850C98CF7"""
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-"""C4863910377B489D_F760495EBC559A26_6039_UN""","""CN(C)C1CC(C1)OCC2=NN=C([N]2C)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
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-"""C35455FA160BCDBF_8C6A66B302FE6A14_6039_UN""","""CN(C)C1CC(C1)OCCC(NC2=CC=CC(=C2)OC)=O""",21,"""E22A3BF850C98CF7"""
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-"""B5B996C4C7984A40_AACC249D2801C2E9_6039_UN""","""CN(C)C1CC(C1)OCCN3C(=O)NC2(CCCC2)C3=O""",21,"""E22A3BF850C98CF7"""
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-"""C2BAD8CE349EB8DE_DFB07371686B7391_6039_UN""","""CN(C)C1CC(C1)OCC2=CC=C(C(OC(C)C)=O)C=C2""",21,"""E22A3BF850C98CF7"""
-"""C1B4BA9E863228A9_89A80776BD716351_6039_UN""","""CN(C)C1CC(C1)OCC2=CSC(=N2)C(OCC(C)C)C""",21,"""E22A3BF850C98CF7"""
-"""562E6652CCE5EE0E_77B104B8084025B7_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C=C(C(OC)=O)C=C2)OC""",21,"""E22A3BF850C98CF7"""
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-"""9705E77D07FDE9C9_CFF019388B44CD5C_6039_UN""","""CN(C)C1CC(C1)OCCC2=CC=C(OC(F)(F)F)C=C2""",21,"""E22A3BF850C98CF7"""
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-"""D705216FB1253FBB_115D17F561B18E5B_6039_UN""","""CN(C)C1CC(C1)OCC2=CC(=C(C(OC)=O)C=C2)OC""",21,"""E22A3BF850C98CF7"""
-"""ABC4985C9C50F128_0976C6EA56358A2A_6039_UN""","""CN(C)C1CC(C1)OCCN2C(=O)COC3=C2C=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""EB221BE6FA42B4D0_417B946A4BF86F38_6039_UN""","""CN(C)C1CC(C1)OCCC[S](C2=CC=C(C)C=C2)(=O)=O""",21,"""E22A3BF850C98CF7"""
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-"""45521E5F95B886C6_ACBA9BFC01875D00_6039_UN""","""CN(C)C1CC(C1)OCC(C2=CC=CC(=C2)C(OC)=O)=O""",21,"""E22A3BF850C98CF7"""
-"""E446DBEA06FFF48B_2587A2214FBB7A7A_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=CC=C(C(O)=O)C=C2)=O""",21,"""E22A3BF850C98CF7"""
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-"""F32AEAF82D22A3AA_69E8C8A383DE5A20_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=C(CC)C=CC=C2C)=O""",21,"""E22A3BF850C98CF7"""
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-"""799EFE567DF41333_8347BDBE30D4E2FD_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=C(C(N)=O)C=CC=C2)=O""",21,"""E22A3BF850C98CF7"""
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-"""5EDCE1A22F1D12EC_1D1120A93FF84F5B_6039_UN""","""CN(C)C1CC(C1)OCC(NCC2=C(OC)C=CC=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""C4CB0BC57FA2B4CB_4DC290A5950C63DE_6039_UN""","""CN(C)C1CC(C1)OCC(NC(CCC)(C)C(=O)OC)=O""",21,"""E22A3BF850C98CF7"""
-"""2B71C067F5C76690_0A0EFA29F39B3620_6039_UN""","""CN(C)C1CC(C1)OCCOC2=C(C(OC)=O)C=CC=C2""",21,"""E22A3BF850C98CF7"""
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-"""61E807994B03D6B6_E318AA324BF50100_6039_UN""","""CN(C)C1CC(C1)OCC(=O)C2=CC3=C(C=C2)C=CC=C3""",21,"""E22A3BF850C98CF7"""
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-"""51897DECFD68FFDC_9DD55ED6C189C2BD_6039_UN""","""CN(C)C1CC(C1)OCCCC2=NC3=C(C=C2)C=CC=C3""",21,"""E22A3BF850C98CF7"""
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-"""8385BAE041CE028B_0EB5435139EA794F_6039_UN""","""CN(C)C1CC(C1)OCC2=NN=N[N]2C3=CC=C(C)C=C3""",21,"""E22A3BF850C98CF7"""
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-"""47F2FC3D6A742473_649968346E8F6099_6039_UN""","""CN(C)C1CC(C1)OCC2CN(CCO2)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
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-"""0184BA099D724CB5_4779190F195166AE_6039_UN""","""CN(C)C1CC(C1)OCC(N(C)CC2=CC=C(C=C2)F)=O""",21,"""E22A3BF850C98CF7"""
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-"""4170C51174D74C4E_B091BF26BA1FC0E3_6039_UN""","""CN(C)C1CC(C1)OCCOC2=CC=C([S](N)(=O)=O)C=C2""",21,"""E22A3BF850C98CF7"""
-"""7818E0E20C145849_CFD446CBF80E9387_6039_UN""","""CN(C)C1CC(C1)OCCOC2=CC=C([S](Cl)(=O)=O)C=C2""",21,"""E22A3BF850C98CF7"""
-"""944205E0C6D9A292_D06057C1FB99D40B_6039_UN""","""CN(C)C1CC(C1)OCCC2=NC=C(O2)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
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-"""58514BE8C1D2C308_A8A79E558E983F18_6039_UN""","""CN(C)C1CC(C1)OCCC(=O)NCCC2=CC=CC=C2""",21,"""E22A3BF850C98CF7"""
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-"""C581244C2F197DFF_3323771F30ED7E44_6039_UN""","""CN(C)C1CC(C1)OCC(N(CC)C2=C(C=CC=C2)C)=O""",21,"""E22A3BF850C98CF7"""
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-"""272AB51E7481F489_86818E703A84ABCA_6039_UN""","""CN(C)C1CC(C1)OCC(=O)NCCCC2CCCCC2""",21,"""E22A3BF850C98CF7"""
-"""F86347ECCC4B7F65_EF7A88EC756C1081_6039_UN""","""CN(C)C1CC(C1)OCC(NCCCN(C)[S](=O)(=O)C)=O""",21,"""E22A3BF850C98CF7"""
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-"""B759E3225D35E208_C438F753FD164383_6039_UN""","""CN(C)C1CC(C1)OCC2=CC=CC(=C2)C(C(F)(F)F)=O""",21,"""E22A3BF850C98CF7"""
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-"""2705EAD5950B322D_72833A23B6831684_6039_UN""","""CN(C)C1CC(C1)OCCC3SC2=C(C=CC=C2)NC3=O""",21,"""E22A3BF850C98CF7"""
-"""A4D42D343A2D04AC_8EE5B37909E1DB57_6039_UN""","""CN(C)C1CC(C1)OCC3CN(C2CCCCC2)C(=O)O3""",21,"""E22A3BF850C98CF7"""
-"""2202F2BDCE0A5E04_F2D8108B493A6175_6039_UN""","""CN(C)C1CC(C1)OCCC(C(OC)=O)C2=CC=CC=C2""",21,"""E22A3BF850C98CF7"""
-"""DC1DFF115B18B61C_2D64C9B7F49CDF77_6039_UN""","""CN(C)C1CC(C1)OCC2=NN=C(OCC(F)(F)F)C=C2""",21,"""E22A3BF850C98CF7"""
-"""F2DDD2776C5E5181_43F01F0DBA96EC6C_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C=C(C(O)=O)C=C2)[N](=O)=O""",21,"""E22A3BF850C98CF7"""
-"""BC09797B9690D5DF_FE93AC0022F283C2_6039_UN""","""CN(C)C1CC(C1)OCC3=NC2=C(C=CC(=C2)C(O)=O)[NH]3""",21,"""E22A3BF850C98CF7"""
-"""040DC87C46EBCF9F_A20484D4F4D82A02_6039_UN""","""CN(C)C1CC(C1)OCC2=CN=C(N=C2)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""3A458200038D4AB7_43649292720878D7_6039_UN""","""CN(C)C1CC(C1)OCC3=NN=C(C2(OC)CCOC2)O3""",21,"""E22A3BF850C98CF7"""
-"""C539C71D6AAFDB9C_BB2D18C798CB0BAA_6039_UN""","""CN(C)C1CC(C1)OCCC3=CC2=C(OC(F)(F)O2)C=C3""",21,"""E22A3BF850C98CF7"""
-"""FEB30BF2D2C9917C_38C865B69D522611_6039_UN""","""CN(C)C1CC(C1)OCC(C2=C[NH]C3=C2C=C(F)C=C3)=O""",21,"""E22A3BF850C98CF7"""
-"""55A6247C326FCCE0_9A100A8349BE4B74_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C(OC)=O)C=CC=C2OC""",21,"""E22A3BF850C98CF7"""
-"""962E2FAFAC6A2B09_FB1FEEDA117249F1_6039_UN""","""CN(C)C1CC(C1)OCC(C2=C(C=C([N](=O)=O)C=C2)F)=O""",21,"""E22A3BF850C98CF7"""
-"""229154E6AFCFD7C2_C70D859BB2227DEA_6039_UN""","""CN(C)C1CC(C1)OCC3=C2C=CC=CC2=C(OC)N=C3""",21,"""E22A3BF850C98CF7"""
-"""2B317ABD9A69F326_753FDCD921765DB4_6039_UN""","""CN(C)C1CC(C1)OCC2=COC(=N2)C3=C(F)C=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""DB40571345DFF559_C003C3E6CFB4D456_6039_UN""","""CN(C)C1CC(C1)OCC(C2CCCC(C(F)(F)F)C2)=O""",21,"""E22A3BF850C98CF7"""
-"""A22C1D5DD2CF9A97_94ECCCC3CCCC511C_6039_UN""","""CN(C)C1CC(C1)OCC(C2=C(C)[NH]C(=C2)C(OC)=O)=O""",21,"""E22A3BF850C98CF7"""
-"""F118D5F1E9683979_4389FC87D62FC2AE_6039_UN""","""CN(C)C1CC(C1)OCCC2=CC=CC3=C2OC(F)(F)O3""",21,"""E22A3BF850C98CF7"""
-"""311E0F3D8B440384_8898717E448F8EFA_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C(OCC)=O)C(=CC=N2)C""",21,"""E22A3BF850C98CF7"""
-"""6E0C4FCBA452A748_3D26E34D6D06A068_6039_UN""","""CN(C)C1CC(C1)OCCCOC2=CC=C([N](=O)=O)C=C2""",21,"""E22A3BF850C98CF7"""
-"""9DA3507580A2C573_8FE24A115101184D_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C)C=CC3=C2C=CC(=C3)C""",21,"""E22A3BF850C98CF7"""
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-"""79642E1F1587E123_AD1593F03BEDD6D3_6039_UN""","""CN(C)C1CC(C1)OCC2CCCC(O2)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""16C6D2D0A99EF124_2A1DF4330B2DD21E_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C=CC(=C2)C(OC)=O)OC""",21,"""E22A3BF850C98CF7"""
-"""4419AF44897F5AEA_EDC8F48489B30BF2_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=C(OCC)C=CC=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""DD88545C39302A64_AFA027043ACDF903_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=CC=C(C(N)=O)C=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""AD401F1197C3BBDB_2E2F52C0A517AC7E_6039_UN""","""CN(C)C1CC(C1)OCC2=C(CC)C=CC3=C2C=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""E395F78B7DBD97E0_57DCC99D21063C16_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=CC=CC(=C2)[N](=O)=O)=O""",21,"""E22A3BF850C98CF7"""
-"""DB50A262F4C099D7_1279D83D151A83F0_6039_UN""","""CN(C)C1CC(C1)OCC(=O)C2=CC3=C(C=C2)NC(=O)C3""",21,"""E22A3BF850C98CF7"""
-"""3F10256A58C4312F_6F806CE3CD0F3356_6039_UN""","""CN(C)C1CC(C1)OCC(NCCC2=CC=C(F)C=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""4AAC6B6F827E82BC_9AD9C5F266B33FD9_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=CC=C([N](=O)=O)C=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""99254F1CAC858F7B_D07A73BA2A9077EC_6039_UN""","""CN(C)C1CC(C1)OCC(=O)NC2=CC3=C(C=C2)OCO3""",21,"""E22A3BF850C98CF7"""
-"""28ED4CAA2B46024A_83B13F305B3A2ABC_6039_UN""","""CN(C)C1CC(C1)OCC(N2C3=C(CC2C)C=CC=C3)=O""",21,"""E22A3BF850C98CF7"""
-"""6B948A926AEFBD40_B52ABD5AFF5729BD_6039_UN""","""CN(C)C1CC(C1)OCC(=O)N2CCCC3=C2C=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""F44832FEDAF8C165_1F886E6E18551CA0_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=C(C(C)C)C=CC=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""391CD258F41B3FC4_36F02F05425EFE62_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=C(C(=C(F)C=C2)F)F)=O""",21,"""E22A3BF850C98CF7"""
-"""B00D946BD9ECC10A_CF8E5A69705CFF86_6039_UN""","""CN(C)C1CC(C1)OCC2=CC=C(C=C2)N3CCOCC3""",21,"""E22A3BF850C98CF7"""
-"""5F89B6D4584D4A84_38D1DF0316317910_6039_UN""","""CN(C)C1CC(C1)OCC(C3=CC2=C(C=CC(=C2)C)O3)=O""",21,"""E22A3BF850C98CF7"""
-"""CF3C96AE09327475_FE70DB4392D29252_6039_UN""","""CN(C)C1CC(C1)OCCC2=NN=N[N]2C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""F906B62422A3E430_925926A8BD934EAB_6039_UN""","""CN(C)C1CC(C1)OCC(C2=CC=CC(=N2)C(OC)=O)=O""",21,"""E22A3BF850C98CF7"""
-"""23A2C4ABAFE1FEBC_748945115549A592_6039_UN""","""CN(C)C1CC(C1)OCC4CC2(CC3(C2)OCCO3)CO4""",21,"""E22A3BF850C98CF7"""
-"""1452AEE314255313_A8E14633933C4BF0_6039_UN""","""CN(C)C1CC(C1)OCC2=NOC(=N2)C(OCC)OCC""",21,"""E22A3BF850C98CF7"""
-"""4C377663462B23E5_F3D03E203F4D3078_6039_UN""","""CN(C)C1CC(C1)OCC(=O)N2CCO[C@@H]3CCCC[C@H]23""",21,"""E22A3BF850C98CF7"""
-"""74659D2B2FA5D713_E7A6D2D4B0BE7C48_6039_UN""","""CN(C)C1CC(C1)OCC3OC(=O)C2(CCC2)C34CCC4""",21,"""E22A3BF850C98CF7"""
-"""914BB56C240E366D_9604D8BF81AD2AAA_6039_UN""","""CN(C)C1CC(C1)OCCOCCOCC2=CC=CC=C2""",21,"""E22A3BF850C98CF7"""
-"""FF059B4D1C29D7F4_66124521AFEDF23D_6039_UN""","""CN(C)C1CC(C1)OCC2=C(OC(O2)=O)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""B365CA222FE26E88_55C87B9B3D6DE11D_6039_UN""","""CN(C)C1CC(C1)OCCC3NC(=O)C2=C(C=CC=C2)O3""",21,"""E22A3BF850C98CF7"""
-"""2B9771F09549156E_5BECD6F2920A2FFC_6039_UN""","""CN(C)C1CC(C1)OCC(=O)NCC=CC2=CC=CC=C2""",21,"""E22A3BF850C98CF7"""
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-"""1D9F1238463A925E_45FA469A7E580AD3_6039_UN""","""CN(C)C1CC(C1)OCC(NCC2=CC=C(OC)C=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""D62B4A094DA3990A_0DF7B1BF2F3BEDF1_6039_UN""","""CN(C)C1CC(C1)OCC(=O)C2=CC3=C(C=C2)NC(=O)O3""",21,"""E22A3BF850C98CF7"""
-"""9E9E0502526B8A1C_71BE6093EB52FD39_6039_UN""","""CN(C)C1CC(C1)OCC(N(C)CC2=CC=C(C=C2)C)=O""",21,"""E22A3BF850C98CF7"""
-"""FE6300C43681857D_8B37362B1415A1C2_6039_UN""","""CN(C)C1CC(C1)OCCCC2=CC=CC(=C2)C(F)(F)F""",21,"""E22A3BF850C98CF7"""
-"""463CB4E56E19C31B_626CE57E22A21AB1_6039_UN""","""CN(C)C1CC(C1)OCC(C(=C2C=CN(C)C=C2)C#N)=O""",21,"""E22A3BF850C98CF7"""
-"""FF11E5A2E8D359F9_D74777B394179002_6039_UN""","""CN(C)C1CC(C1)OCC(C2=C[N](C)C3=C2C=CC=C3)=O""",21,"""E22A3BF850C98CF7"""
-"""FFE20CA713E8BF27_F243BEC843AB003C_6039_UN""","""CN(C)C1CC(C1)OCCOC2=CC3=C(C=C2)C=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""9FB71893B72BAF53_EE9EAC350145FDC4_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=C(C(OC)=O)SC=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""29FA05BA7D35A4A5_B5A84D217C20B9B6_6039_UN""","""CN(C)C1CC(C1)OCC(NC(C(CC)C)C(=O)OC)=O""",21,"""E22A3BF850C98CF7"""
-"""F89F905D1DBD7F77_1CAD3A6FD133680B_6039_UN""","""CN(C)C1CC(C1)OCC(C2=C(C(=CC(=C2C)C)C)C)=O""",21,"""E22A3BF850C98CF7"""
-"""D8CA5C7ED662F248_9B4453A37670BD5E_6039_UN""","""CN(C)C1CC(C1)OCC2=NOC(=N2)CCCC(OC)=O""",21,"""E22A3BF850C98CF7"""
-"""88E5A58A027CB04B_EE4DA1F3487A9F87_6039_UN""","""CN(C)C1CC(C1)OCC2=NOC(=N2)CC3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
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-"""00C6B9917ADE900F_4B993CC34C6F2EAB_6039_UN""","""CN(C)C1CC(C1)OCC2=CSC(=N2)N(C(C)=O)C3CC3""",21,"""E22A3BF850C98CF7"""
-"""28560F40B798FE5A_8E45B222FF33F969_6039_UN""","""CN(C)C1CC(C1)OCCCC2=NC(=NO2)C3=CC=CS3""",21,"""E22A3BF850C98CF7"""
-"""EEBB1571A70067F3_7BC68A42850114B9_6039_UN""","""CN(C)C1CC(C1)OCC(C2(NC(C(F)(F)F)=O)CC2)=O""",21,"""E22A3BF850C98CF7"""
-"""A56FE3618852EDEA_AD622CD45AE13FAB_6039_UN""","""CN(C)C1CC(C1)OCCC(C(F)(F)F)N2CCOCC2""",21,"""E22A3BF850C98CF7"""
-"""40A3A3916106C5D4_E462F93F9AA4603C_6039_UN""","""CN(C)C1CC(C1)OCCOC2=CC(=C(OC)C=C2)OC""",21,"""E22A3BF850C98CF7"""
-"""8C68886AF9BD9FF2_2D11E1EB03A48DE5_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=CC=CC(=C2)C(N)=O)=O""",21,"""E22A3BF850C98CF7"""
-"""5C8C014EB027420D_95D88A02E9F263E2_6039_UN""","""CN(C)C1CC(C1)OCC(C(C2=C(C)C=CC=C2)=O)(F)F""",21,"""E22A3BF850C98CF7"""
-"""779893ABCD04A7B5_3186EE2900E95CC9_6039_UN""","""CN(C)C1CC(C1)OCC(C2=N[N](C)C3=C2C=CC=C3)=O""",21,"""E22A3BF850C98CF7"""
-"""B60C8246F9BAFBF0_449004F78C9A59DB_6039_UN""","""CN(C)C1CC(C1)OCCCN2C(=O)NC3=C2C=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""F1CD939741C188AC_405FCFBD2DB350F0_6039_UN""","""CN(C)C1CC(C1)OCC(=O)N3CCC2=C(C=CC=C2)C3""",21,"""E22A3BF850C98CF7"""
-"""0C90918B10C04EBE_A3D06DEBB845A5D6_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C=CC=C2)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""0177CAA1EBBCD059_C07AB8C9D7B9EEC7_6039_UN""","""CN(C)C1CC(C1)OCC3=C2C=CC=CC2=C(C=C3)C#N""",21,"""E22A3BF850C98CF7"""
-"""F0331BA1820475C8_C165AC4437D864E9_6039_UN""","""CN(C)C1CC(C1)OCCC2=C(OC(F)(F)F)C=CC=C2""",21,"""E22A3BF850C98CF7"""
-"""345066F1D6FC64E5_4CAA801027181A96_6039_UN""","""CN(C)C1CC(C1)OCCCC2=CC(=C(OC)C=C2)OC""",21,"""E22A3BF850C98CF7"""
-"""C84F1AA84A7A63DE_BC85647AA8637B3B_6039_UN""","""CN(C)C1CC(C1)OCC3=C(OC)N=C2C=CC=CC2=C3""",21,"""E22A3BF850C98CF7"""
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-"""19D1731A304A9195_3A2D28AA8BAAE76E_6039_UN""","""CN(C)C1CC(C1)OCC3=CC(=C2OCOC2=C3)C4CC4""",21,"""E22A3BF850C98CF7"""
-"""EF19DA6030BA63A3_CD1F3BDBBAFD7EC5_6039_UN""","""CN(C)C1CC(C1)OCC2=CC(=CC(=C2)[N](=O)=O)[N](=O)=O""",21,"""E22A3BF850C98CF7"""
-"""25CFCA7CB38C84CE_46134D88E2B9943B_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C=CC(=C2)C(OCC)=O)F""",21,"""E22A3BF850C98CF7"""
-"""212509169280A4C0_E8E957253E121FAA_6039_UN""","""CN(C)C1CC(C1)OCC3=N[N]2CCCC2=C3C(OC)=O""",21,"""E22A3BF850C98CF7"""
-"""6441F39516347B11_918A443972CB0E9A_6039_UN""","""CN(C)C1CC(C1)OCCC2(C(OCC)=O)CCCC2=O""",21,"""E22A3BF850C98CF7"""
-"""247FB71395BC2697_36EE2B8F82C1E663_6039_UN""","""CN(C)C1CC(C1)OCC(N(C)CC2=C(C=CC=C2)F)=O""",21,"""E22A3BF850C98CF7"""
-"""4A3CEBCAB894A0C0_FCCCDDD58FC08B3C_6039_UN""","""CN(C)C1CC(C1)OCC2=NC3=C([N]2CC)C=CC=C3F""",21,"""E22A3BF850C98CF7"""
-"""14A1C571D221D202_B2B8DA87C1E17278_6039_UN""","""CN(C)C1CC(C1)OCCCCCCOCCOCCC""",21,"""E22A3BF850C98CF7"""
-"""6DDD00EF7802C7FC_EDF4ACAF6E9FF564_6039_UN""","""CN(C)C1CC(C1)OCC2=NOC(=C2)CC3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""2B4C93AE9D998F28_F878940ED210A89F_6039_UN""","""CN(C)C1CC(C1)OCC2=COC(=N2)OC3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""D39210967D65DD5D_FAD39E713A278D18_6039_UN""","""CN(C)C1CC(C1)OCC2=CN=C(N=C2)C3=CN=CN=C3""",21,"""E22A3BF850C98CF7"""
-"""01E965DDF061FDFE_51FC334DE91FEE16_6039_UN""","""CN(C)C1CC(C1)OCC2=CC(=C(C=C2)C#N)C(OC)=O""",21,"""E22A3BF850C98CF7"""
-"""ECE7A13B994D0807_E68A812881826325_6039_UN""","""CN(C)C1CC(C1)OCC(=O)N(C2CC2)C3=CCCCC3""",21,"""E22A3BF850C98CF7"""
-"""C74A614E410E8FC7_2F025A70667D6888_6039_UN""","""CN(C)C1CC(C1)OCC3CCC2(CCCCCCC2)O3""",21,"""E22A3BF850C98CF7"""
-"""B209C06F6A209A9D_362AF336A1CEB52C_6039_UN""","""CN(C)C1CC(C1)OCC2=N[N](C=C2)CC3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""AA5D7A7ADA98C245_ED1857CA2CB95147_6039_UN""","""CN(C)C1CC(C1)OCC2=COC(=N2)CC3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""E830241EC063E48A_E4B89CCB6AD13D17_6039_UN""","""CN(C)C1CC(C1)OCC2=CC=CC(=C2)OCC(OC)=O""",21,"""E22A3BF850C98CF7"""
-"""A396793D879A2EE7_0D2C6589D4D23F3B_6039_UN""","""CN(C)C1CC(C1)OCC2=CC=CC(=C2)[S](CCC)(=N)=O""",21,"""E22A3BF850C98CF7"""
-"""1E614C569CC30245_B46212A4CA9C01F8_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C(OCC)=O)C=NC(=N2)C""",21,"""E22A3BF850C98CF7"""
-"""7DB020CB34219F90_CA7456F854D688A7_6039_UN""","""CN(C)C1CC(C1)OCC2=N[NH]C(=C2C)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""3980DB6162096DCA_7CFC60F08C8FA118_6039_UN""","""CN(C)C1CC(C1)OCC(C2=C(C)[N](C(=C2)C)CC#C)=O""",21,"""E22A3BF850C98CF7"""
-"""9045B518FABD1639_98245F4E98AB3D57_6039_UN""","""CN(C)C1CC(C1)OCC2(O)CSC(=N2)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""AA41B335D21825AB_2FDA97638FCD028A_6039_UN""","""CN(C)C1CC(C1)OCC2=CC=C(CCC(OC)=O)C=C2""",21,"""E22A3BF850C98CF7"""
-"""7E9FD71683028B50_7224DE60D6781AF0_6039_UN""","""CN(C)C1CC(C1)OCC(N(C(C)C)C2=CC=CC=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""131DCFD2D662CE3A_6437F633059C1FFB_6039_UN""","""CN(C)C1CC(C1)OCCOCCO[Si](C(C)(C)C)(C)C""",21,"""E22A3BF850C98CF7"""
-"""AC0F4B5422709B8E_31A95C1D8F5A74EE_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C=CC(=C2)OC)[S](=O)(=O)N""",21,"""E22A3BF850C98CF7"""
-"""B6228E7609C614CA_BC3AD0635EB44327_6039_UN""","""CN(C)C1CC(C1)OCC3=N[N](C2=CC=C(C)C=C2)C=C3""",21,"""E22A3BF850C98CF7"""
-"""D7BCA52CFFC236A7_60CB67C8113B18E1_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C=CC(=C2)OC)[S](=O)(=O)F""",21,"""E22A3BF850C98CF7"""
-"""FBF1C0B36091A4C9_D36F5E514F59D4A4_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C)N=C(S2)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""9910DF69CE98C45D_D37C040EA4C26193_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C=CC(=C2)OC)[S](=O)(=O)Cl""",21,"""E22A3BF850C98CF7"""
-"""4D75C90B085449BB_FEF34D2337993A24_6039_UN""","""CN(C)C1CC(C1)OCC2=C(F)C=C(C=C2F)C(F)(F)F""",21,"""E22A3BF850C98CF7"""
-"""275B5B54F2958DF8_B2AA0C33F4C26475_6039_UN""","""CN(C)C1CC(C1)OCC2=CC=CC(=C2[N](=O)=O)C(O)=O""",21,"""E22A3BF850C98CF7"""
-"""FCACC05D8CC02DD5_8E8AEFBAE237F3D6_6039_UN""","""CN(C)C1CC(C1)OCC2=NC3=C([N]2CC)C=CC(=C3)F""",21,"""E22A3BF850C98CF7"""
-"""5D195A9EB16305FF_8A9D7DF6F798C579_6039_UN""","""CN(C)C1CC(C1)OCC2=NOC(=N2)C3=CC=CC(=C3)F""",21,"""E22A3BF850C98CF7"""
-"""3E32CD0112C12C0D_14957B919194973E_6039_UN""","""CN(C)C1CC(C1)OCC2=NOC(=N2)C3=C(F)C=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""9D3D09EFEF5902FC_B5054E134F5BEB21_6039_UN""","""CN(C)C1CC(C1)OCC([C@@H]2CC[C@H](C(F)(F)F)CC2)=O""",21,"""E22A3BF850C98CF7"""
-"""1F651BAC2FDBDB2F_5907E193D0966D44_6039_UN""","""CN(C)C1CC(C1)OCCOC2=CC=C(C(F)(F)F)C=C2""",21,"""E22A3BF850C98CF7"""
-"""445D18F8D3B668CE_B6983297F37A84E2_6039_UN""","""CN(C)C1CC(C1)OCC(C2=CC=C(C(F)(F)F)C=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""8CC695046BA6C72D_D0CC61A20ABF9530_6039_UN""","""CN(C)C1CC(C1)OCC2=NC(=CC(=N2)C(OCC)=O)C""",21,"""E22A3BF850C98CF7"""
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-"""41723FA22ED78AC9_14F21554F35F0B63_6039_UN""","""CN(C)C1CC(C1)OCCCC2=CC3=C(C=C2)C=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""8CBE98FAE1FFF5E3_871E1278ECC9A641_6039_UN""","""CN(C)C1CC(C1)OCC3=NC2=C(C=CC=C2)C(N3C)=O""",21,"""E22A3BF850C98CF7"""
-"""24E91607227CFF2A_446961B3B0921BB6_6039_UN""","""CN(C)C1CC(C1)OCC(NCC2=CC(=C(C)C=C2)F)=O""",21,"""E22A3BF850C98CF7"""
-"""49B6390BC1E38884_8376ADED9F30A620_6039_UN""","""CN(C)C1CC(C1)OCCC(NC(C)C2=CC=CC=C2)=O""",21,"""E22A3BF850C98CF7"""
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-"""5C32D341A5563C02_74A7EF31D82AD8AE_6039_UN""","""CN(C)C1CC(C1)OCC2=NOC(=N2)C3=CN=CC(=C3)C""",21,"""E22A3BF850C98CF7"""
-"""36F8F6920C83A4CE_626F87680DA941FA_6039_UN""","""CN(C)C1CC(C1)OCC(C2=C(OC(F)F)C=CC=C2)=O""",21,"""E22A3BF850C98CF7"""
-"""518A9EA448129EC1_EC40BB1EBF415BA8_6039_UN""","""CN(C)C1CC(C1)OCC2=C(OCC(F)(F)F)C=CC=C2""",21,"""E22A3BF850C98CF7"""
-"""B1F44902AF21A259_D0864C33654982C3_6039_UN""","""CN(C)C1CC(C1)OCC(N2CCC(C(OC)=O)CC2)=O""",21,"""E22A3BF850C98CF7"""
-"""D5C4F2517BCD4CA8_4369A36710431349_6039_UN""","""CN(C)C1CC(C1)OCC2=C(OC(F)F)C=C(C=C2)C#N""",21,"""E22A3BF850C98CF7"""
-"""5EE1B9F46E499A1D_2FE7B5F76F3F5472_6039_UN""","""CN(C)C1CC(C1)OCC2=CN=C[N]2CC3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""4F981D6ED66C2571_4169D33846A15375_6039_UN""","""CN(C)C1CC(C1)OCC2=N[N](C(=C2)C)C3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""4AACF2EA236D0D9D_EA6B22459051E305_6039_UN""","""CN(C)C1CC(C1)OCC2=CSC(=N2)C3=CC=C(C)C=C3""",21,"""E22A3BF850C98CF7"""
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-"""B976EFAF0566F639_B8AD673945FB226A_6039_UN""","""CN(C)C1CC(C1)OCCOC2=CC=C([S](C)(=O)=O)C=C2""",21,"""E22A3BF850C98CF7"""
-"""1639A484FAD731D7_FD13B39B9DA8281A_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C(F)(F)F)C=C(C=C2)C#N""",21,"""E22A3BF850C98CF7"""
-"""6A8080BB2F58A465_4F1A0DCF270893BF_6039_UN""","""CN(C)C1CC(C1)OCC(N=C2C=CNN2CCCC)=O""",21,"""E22A3BF850C98CF7"""
-"""7B542F9790A63AEB_69C14365E07A506C_6039_UN""","""CN(C)C1CC(C1)OCC(NCC2=CC(=CC(=C2)F)F)=O""",21,"""E22A3BF850C98CF7"""
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-"""167905E2BCDC00AE_83955F2E28D3DBDE_6039_UN""","""CN(C)C1CC(C1)OCCOC2=C(C(F)(F)F)C=CC=C2""",21,"""E22A3BF850C98CF7"""
-"""8F5948AAD3B2BFA7_160E97F1F9452DF4_6039_UN""","""CN(C)C1CC(C1)OCC(C2=CC=CC(=C2)[S](C)(=O)=O)=O""",21,"""E22A3BF850C98CF7"""
-"""2F680677DB66C2CD_9A9AEBA410610E88_6039_UN""","""CN(C)C1CC(C1)OCC2=CSC(=N2)CC3=NC=CC=C3""",21,"""E22A3BF850C98CF7"""
-"""37A0878E5B064FFC_2CBD1C98DE369032_6039_UN""","""CN(C)C1CC(C1)OCC2=CC=C([S](C(C)C)(=O)=O)C=C2""",21,"""E22A3BF850C98CF7"""
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-"""15708E474EDCCC8D_A8617E844660EEBB_6039_UN""","""CN(C)C1CC(C1)OCC(N[C@H](C)C2=CC=C(C=C2)F)=O""",21,"""E22A3BF850C98CF7"""
-"""B4D36FEE4A461F52_30BB340285116201_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCCCCC""",21,"""E6B2D018D864E862"""
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-"""5B6B2E28790CEE7D_8EAEB78D1C1BDA9E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(NC(OC)=O)=O""",21,"""E6B2D018D864E862"""
-"""DDA9B76FB3A3B25E_208898094A92E5F7_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(NNC(C)=O)=O""",21,"""E6B2D018D864E862"""
-"""D5A1BF406C8BA03A_8E6B5CDAA689423E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOCC(F)(F)F""",21,"""E6B2D018D864E862"""
-"""43D46CD0FBDCAA90_3F1F456D82D320E0_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCOC(C)=O""",21,"""E6B2D018D864E862"""
-"""D64D72423FB3272E_1C105BD8E627446D_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(C(OCC)=O)=C""",21,"""E6B2D018D864E862"""
-"""3B45935C2FFE8770_4E4F89A03E84629F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CSC(=N3)CC""",21,"""E6B2D018D864E862"""
-"""D94D08C47F6370E3_E03E5CD6105CE662_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC(=NO3)CC""",21,"""E6B2D018D864E862"""
-"""752AA4EB60ADBB57_A016B233BACD67DB_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(N(C(C)C)C)=O""",21,"""E6B2D018D864E862"""
-"""299D1DF2F02D2B2E_5BC7CD92DB778EF7_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(NC(NC)=O)=O""",21,"""E6B2D018D864E862"""
-"""1E06A621B405CCDF_F7D7FAC9E9FC2B50_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC(NC(C)C)=O""",21,"""E6B2D018D864E862"""
-"""F8389BDA730CB797_5208B7948328D7DB_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN3CCCC3=O""",21,"""E6B2D018D864E862"""
-"""476B92F4EC2E7DD3_C1A19E1EB46BEE44_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOC3CCCC3""",21,"""E6B2D018D864E862"""
-"""12C66C7F8F945DA5_4B668793E4CC5D86_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC(N(C)C)=O""",21,"""E6B2D018D864E862"""
-"""69989266F1EE8431_CF2379AE4852A7B3_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NOC(=N3)CC""",21,"""E6B2D018D864E862"""
-"""9AB4C7807A540760_02C41A171C227082_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN3CCCCC3""",21,"""E6B2D018D864E862"""
-"""0BA7964AC559AC6C_39B120B116D50079_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC[N]3C=CC=N3""",21,"""E6B2D018D864E862"""
-"""BE988D0D707F7D5E_014D31115B9B6A18_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC[N]3C=CN=C3C""",21,"""E6B2D018D864E862"""
-"""859FC83B2D1D8673_934A148150908035_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC(=C(O3)C)C""",21,"""E6B2D018D864E862"""
-"""47B848BC52402805_006AD4AA2B37CD4C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOCCC(C)C""",21,"""E6B2D018D864E862"""
-"""2994E3B98CD3589B_3E63D12DCCDD18B2_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCN3CCCC3""",21,"""E6B2D018D864E862"""
-"""6C6A46DD243C2023_CB3C5801EC90FDDE_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC[S](CCC)(=O)=O""",21,"""E6B2D018D864E862"""
-"""83696CB42052E015_B110822AE413D1C6_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)SC(=C3)C""",21,"""E6B2D018D864E862"""
-"""B01B8518ED975A5D_D6002F5E4EE2078E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3COC(C)(C)O3""",21,"""E6B2D018D864E862"""
-"""2EE448E19FB74964_5A116A4F5B28D344_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3OCCN(C)C3""",21,"""E6B2D018D864E862"""
-"""10F07C67B6636D24_95ECAA02DE5DACE5_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=[N](=O)C=CC=N3""",21,"""E6B2D018D864E862"""
-"""361FECECF9A5295D_6B946E9D7CFFAB6A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=C(C)N=CS3""",21,"""E6B2D018D864E862"""
-"""D1565144D2A1C4E2_3FF6D3CC4C033715_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN3CCOCC3""",21,"""E6B2D018D864E862"""
-"""02440B03887C7E9C_32D8D8F215CB00ED_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN[S](CC)(=O)=O""",21,"""E6B2D018D864E862"""
-"""CFBAAF88FF8E0DC4_2D96BEDA7BC9F06B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CN=C(C)C=N3""",21,"""E6B2D018D864E862"""
-"""7DED709C4CABA064_6A39640B3B27FFDA_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC(OC(C)C)=O""",21,"""E6B2D018D864E862"""
-"""62FDC0914ED9F20A_9BCA9732CA5E4680_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC=C(CC)O3""",21,"""E6B2D018D864E862"""
-"""AAE7AF02748C5569_0421C50A31B3ADF6_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3ON=C(CC)C3""",21,"""E6B2D018D864E862"""
-"""EA4EEB34F89BABD5_7F79D88A3FA8810B_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3NC(OC3)(C)C""",21,"""E6B2D018D864E862"""
-"""DC987B43D7E17198_C1FDB54BE4B09019_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC[S](CC)(=O)=O""",21,"""E6B2D018D864E862"""
-"""B197F2E7CBA1534F_13FDBF9591E06B63_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCNC(=O)C3CC3""",21,"""E6B2D018D864E862"""
-"""06DEF1987F727E9F_7C15764283669515_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3CCOC3=O""",21,"""E6B2D018D864E862"""
-"""2887C3EAD42B74AB_BE0E1D8C611E8637_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3CCCCC3""",21,"""E6B2D018D864E862"""
-"""CCDBB84329C5F272_DF75BB61F8C13EFA_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC(OC)OC""",21,"""E6B2D018D864E862"""
-"""3F05ED45AEC4598A_2BFF3D8F2F1CDFD9_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)OC(O3)=O""",21,"""E6B2D018D864E862"""
-"""59F70A153E49FE96_898EDE1954D002E9_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(N(C)C3CC3)=O""",21,"""E6B2D018D864E862"""
-"""FF444483065393F7_22E1BA1B81A019A2_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCN(CC)CC""",21,"""E6B2D018D864E862"""
-"""D57E0E45CF660F82_968F969DCD3F28BB_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=C[N](C)N=C3""",21,"""E6B2D018D864E862"""
-"""DCF92234D66C53C4_407A08B1D7A05DC1_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CN=C(C)C=C3""",21,"""E6B2D018D864E862"""
-"""36D713F8F81D5601_B11BA77C272D166B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC[S](C)(=O)=O""",21,"""E6B2D018D864E862"""
-"""879FF977BF79A6F2_25B40201F9CB4293_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=CC(=C3)N""",21,"""E6B2D018D864E862"""
-"""398481FF3AF71FCC_A0B42C4EAEE2CAF0_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3N(C)CCC3""",21,"""E6B2D018D864E862"""
-"""C65A7850B56502FB_13FDCCB2F9D9F9AD_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN3CC(C)CC3""",21,"""E6B2D018D864E862"""
-"""35C8C3BA84D3E36B_850BE1CA9767098A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN3CCSCC3""",21,"""E6B2D018D864E862"""
-"""91DF9DA6591C6053_D9BA7CF6E829043D_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOCCN(C)C""",21,"""E6B2D018D864E862"""
-"""8A490DA60EAF4BD0_73F9151493A3BB25_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)C=CN=C3""",21,"""E6B2D018D864E862"""
-"""2A4238D2346993BF_47D4565E6D0E3E25_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCSCC(C)C""",21,"""E6B2D018D864E862"""
-"""43E19E19FA4B34BB_709C6CBEC6C6802A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCC(F)(F)F""",21,"""E6B2D018D864E862"""
-"""6BFAEDAACC5C1F77_8FC391D3BBBD7024_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=CN=CC=C3""",21,"""E6B2D018D864E862"""
-"""9FBA776AEF3C5644_146894D611454016_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(OC)(OC)OC""",21,"""E6B2D018D864E862"""
-"""1FD286C0015A5E97_3A49F7FCBC794EDE_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC(=O)NC3CC3""",21,"""E6B2D018D864E862"""
-"""3C3FEF0AB8DF39F5_5B02CE5E9D09230F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)NCC3CC3""",21,"""E6B2D018D864E862"""
-"""6B6550BDBABCB46D_24EFD5DE1753DC94_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC(NC(N)=O)=O""",21,"""E6B2D018D864E862"""
-"""1C87AC359C552F0C_D4692482A052BE47_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC=C[N]3CC""",21,"""E6B2D018D864E862"""
-"""EE6F9A4C6B7BC949_ED99EFC3865C5C30_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC[S](NC)(=O)=O""",21,"""E6B2D018D864E862"""
-"""761514E72FA4C826_2CA77A37D0B75537_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=N[N](C(=C3)C)C""",21,"""E6B2D018D864E862"""
-"""628256B915F60346_5AFCEEECD787B09F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC(=C(S3)C)C""",21,"""E6B2D018D864E862"""
-"""A09EF5C1ABC25ED7_31CA2D468C54B306_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC=C(C)C=N3""",21,"""E6B2D018D864E862"""
-"""D922D0CCB2181272_CC23A4A518B65645_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC[S](C(C)C)(=O)=O""",21,"""E6B2D018D864E862"""
-"""A3FF2371342BA367_A243C924E9882E0D_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=CC(=N3)C""",21,"""E6B2D018D864E862"""
-"""0F31374E1AE82C38_FA3E91E1E0431827_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CCCC(=O)N3""",21,"""E6B2D018D864E862"""
-"""D3915DE88C46413E_6A7D951A3A4A370F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)C=CC=N3""",21,"""E6B2D018D864E862"""
-"""4E99C808D1F4CFA8_500F90F009520E23_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(OCC(C)C)=O""",21,"""E6B2D018D864E862"""
-"""5D2373FFE98751DA_07AA7F5D418E3CF8_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=CSC(=N3)C""",21,"""E6B2D018D864E862"""
-"""5198E536B2613745_40D8AEF7FEC11F3E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)[N](N=C3)C""",21,"""E6B2D018D864E862"""
-"""6F9FCA1E4760A57D_1FDA8FA6DA82599B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(NCC(F)F)=O""",21,"""E6B2D018D864E862"""
-"""CAA9472AB76F7736_AF66E4A9B33EF819_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC=CC(=N3)C""",21,"""E6B2D018D864E862"""
-"""20FA25A96F16D177_7B070ADD4854B561_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)N3CCCC3""",21,"""E6B2D018D864E862"""
-"""3BD355DA02996DA3_F02B1EB88251DE25_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(NCC(O)=O)=O""",21,"""E6B2D018D864E862"""
-"""BD52D3294655667D_A3D4532BA22237B5_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(OCCCC)=O""",21,"""E6B2D018D864E862"""
-"""8F6CB1B6348B96C4_356BF98E0FFB7F67_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOC(N(C)C)=O""",21,"""E6B2D018D864E862"""
-"""D7ED21EBD46A098F_86841E2B362D77B1_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3CCOC3""",21,"""E6B2D018D864E862"""
-"""BBB8BD0D0A88F49D_C36327B26828B602_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=CN=C[N]3C""",21,"""E6B2D018D864E862"""
-"""63CFFE78D765B9FA_834737F4DB7F8934_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC=C(F)C=C3""",21,"""E6B2D018D864E862"""
-"""FEEDF5060EBD23EF_E43E8E9066DD84B6_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CN=CC(=C3)F""",21,"""E6B2D018D864E862"""
-"""BD8807B2BC523232_6DF1536F7CEF0B52_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3CCCNC3""",21,"""E6B2D018D864E862"""
-"""857D7632BC9BD2D4_93B38DDA490DB5D7_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CN=CC(=C3)C""",21,"""E6B2D018D864E862"""
-"""E9686DF123444166_EF244738635781D4_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC(N(OC)C)=O""",21,"""E6B2D018D864E862"""
-"""FFF704F4BB56C41B_2F8C7AC135690C9B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=CC=N[N]3C""",21,"""E6B2D018D864E862"""
-"""108E669BB16F9D90_A9BBCB06956396EB_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=NC=CS3""",21,"""E6B2D018D864E862"""
-"""0666B4656CE3937C_C408C84FD81DC4C1_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=CSC=N3""",21,"""E6B2D018D864E862"""
-"""AEB2900A566914A3_A036108562C38DBA_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(F)C=CC=C3""",21,"""E6B2D018D864E862"""
-"""A582003724D20098_7A21FF030A0E5B5F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC=N[N]3CC""",21,"""E6B2D018D864E862"""
-"""C09AEC4365CD7735_00DB95C6E54CCAAE_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCCCCN""",21,"""E6B2D018D864E862"""
-"""C6E56DFC1362FD09_EC807932C4A394F0_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3CCCC3""",21,"""E6B2D018D864E862"""
-"""DCA638542049EDF5_BC362D875B2BC45A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCSCCOC""",21,"""E6B2D018D864E862"""
-"""A387D02E40A35FAD_46B611EEB32D9C55_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3C[S](=O)(=O)C3""",21,"""E6B2D018D864E862"""
-"""3FA4683445684FB0_F3735B7F64B4CDF7_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NNC(C=C3)=O""",21,"""E6B2D018D864E862"""
-"""79FAC21A6C446716_C7E8D72A0D7BA747_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=NC(=N3)C""",21,"""E6B2D018D864E862"""
-"""41073EBA2BFC9790_9B9945AA1916AC98_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CN=C(C)N=C3""",21,"""E6B2D018D864E862"""
-"""D7539CC2A1C7F08B_FFAB0A71CD20959C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=CC=NC=C3""",21,"""E6B2D018D864E862"""
-"""4789A2700DDAA5B9_D8859ACAAD422882_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=NC=C[N]3C""",21,"""E6B2D018D864E862"""
-"""3EC5DCDB9BE7F5D3_B84BBD3F6888A8DD_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(C(OC)(C)C)=O""",21,"""E6B2D018D864E862"""
-"""6605A888DCDA7025_FBE7D2CD94D963B7_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(C)O[Si](C)(C)C""",21,"""E6B2D018D864E862"""
-"""E6A479F273BD7AA3_B83719E0C270C58B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(CC(C)(C)C)=O""",21,"""E6B2D018D864E862"""
-"""9477E5F5CA51E63B_05D21893FFE35FF4_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(C(CC)(C)C)=O""",21,"""E6B2D018D864E862"""
-"""5A3134FED6A829FF_5BB01B83309BFE26_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)N=CC=C3""",21,"""E6B2D018D864E862"""
-"""D4FF11230E06C610_4515263B82B42DDD_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN3CCNC3=O""",21,"""E6B2D018D864E862"""
-"""BD0041510E33DCE6_4115B0C30A2EF686_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(OCC)OCC""",21,"""E6B2D018D864E862"""
-"""D200D0DB74E82B03_8F168670EB04838C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3(OC)CCC3""",21,"""E6B2D018D864E862"""
-"""46DB874DB67F64A7_191872200446445E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3CCNC3=O""",21,"""E6B2D018D864E862"""
-"""6B159C4FFEBF4F67_5CD84E7EB66179FC_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC(=NC=N3)C""",21,"""E6B2D018D864E862"""
-"""E93104CD524AA9F6_D9D5C2795EA246AE_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(SN=C3C)C""",21,"""E6B2D018D864E862"""
-"""91BB561738FBD57B_03CDE6440D4C8418_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC=C(F)C=N3""",21,"""E6B2D018D864E862"""
-"""27B796FBFBF30ACD_20540DB5417AA535_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=N[N](CC)C=C3""",21,"""E6B2D018D864E862"""
-"""FE55199C49A23E0A_90AE4B19A87CC297_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC(=NO3)CC""",21,"""E6B2D018D864E862"""
-"""A892C2441467173D_C6864AA8335F876A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(ON=C3C)C""",21,"""E6B2D018D864E862"""
-"""02D2399FC4C6246E_BA18794682970D5A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(CC(F)(F)F)=O""",21,"""E6B2D018D864E862"""
-"""CE553847A3A5F2EE_35DB59AE7ACFBF98_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC(OCC)=N""",21,"""E6B2D018D864E862"""
-"""CBB62E002C24111C_EF486C56557F36F1_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=C(C#N)S3""",21,"""E6B2D018D864E862"""
-"""E55166B8E1F67B0C_C84FEEE40B51B7DF_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CON=C3CC""",21,"""E6B2D018D864E862"""
-"""CF60BD75B6CCF564_01F07F7223C5D2FF_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC(C(OC)=O)C""",21,"""E6B2D018D864E862"""
-"""B16E522E221972EF_ACA1E0D43E0BC2CD_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCCC(C)C""",21,"""E6B2D018D864E862"""
-"""2CA9D7F9EFC5991F_5422F6A5523DF749_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3CCOCC3""",21,"""E6B2D018D864E862"""
-"""CF8F344F8254772A_A415DADDF6102347_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(CCC(C)C)=O""",21,"""E6B2D018D864E862"""
-"""D3E294B395A98935_7DED74010F26FA75_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC3=C[NH]N=C3""",21,"""E6B2D018D864E862"""
-"""F252BA8018B6C970_C888EDEDCBE2CDEA_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3CCNCC3""",21,"""E6B2D018D864E862"""
-"""CD297603DC314BCC_A3B23306C10E2ED6_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=CC(=N3)F""",21,"""E6B2D018D864E862"""
-"""1E90601E5E143013_195A7CBDEE8901E1_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CN(C)C(O3)=O""",21,"""E6B2D018D864E862"""
-"""B512692641246513_2E25EF99EAC52493_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=CCCCC3""",21,"""E6B2D018D864E862"""
-"""39FFDB7639F20E04_776D2301E3DD3FC0_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3OC3CCCC""",21,"""E6B2D018D864E862"""
-"""466E639F5CD0B8DF_5E20CE5129C72B05_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(N=C(C)O3)C""",21,"""E6B2D018D864E862"""
-"""A5E6EE5ACA6C895A_C2C3095BF49A5A19_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN3CCNCC3""",21,"""E6B2D018D864E862"""
-"""F9198ED2A6C2A385_E8B6561F90C7F20F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3OCCCO3""",21,"""E6B2D018D864E862"""
-"""4DBA5F9CB1F1C67A_E630935AA0E8AF93_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC(C)(C)C#N""",21,"""E6B2D018D864E862"""
-"""71185AFD5FF98125_D805DEC90E4E0550_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(N=C(C)S3)C""",21,"""E6B2D018D864E862"""
-"""A54BEA7873583617_6F7F445ADF731F24_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC[S](=O)(=O)Cl""",21,"""E6B2D018D864E862"""
-"""00D4EB16F28754D1_BAB0F956F118F97A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NN=C(CC)O3""",21,"""E6B2D018D864E862"""
-"""E55C55319E6C2014_405BBBA611C62169_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C[N](N=C3C)C""",21,"""E6B2D018D864E862"""
-"""D863239C6BD168DA_1EF0E417DE51287C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN(C(OC)=O)C""",21,"""E6B2D018D864E862"""
-"""F33C7CF6136F8E26_4C3868E4E1814EEB_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC(=NC=C3)N""",21,"""E6B2D018D864E862"""
-"""461F1F62DFFA4C27_BC8594FBD9412473_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3CCCC3=O""",21,"""E6B2D018D864E862"""
-"""78AA658BE98D800A_DC317DBF519ABFB2_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CN=N[N]3CC""",21,"""E6B2D018D864E862"""
-"""95FC874B016F173D_6921713C545332AF_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(F)C=NC=C3""",21,"""E6B2D018D864E862"""
-"""CEB274264A4A7214_130834FD7BBD17FC_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC(=NO3)OC""",21,"""E6B2D018D864E862"""
-"""EFE612DFEB34C4BC_9793553823483C63_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=N[N](CC)N=C3""",21,"""E6B2D018D864E862"""
-"""AAE42BCC43B5CEDC_A6E0D3F5CC49D584_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC(=NS3)OC""",21,"""E6B2D018D864E862"""
-"""AA05707261265394_CFBF8B62ED55A887_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC=NNC(OC)=O""",21,"""E6B2D018D864E862"""
-"""2BF9A870576ACF42_2EAB7AC0B69F26AB_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(OC)CC(C)C""",21,"""E6B2D018D864E862"""
-"""42F0393FEC042062_E6EE31139A4C947C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOCC3CCC3""",21,"""E6B2D018D864E862"""
-"""EB077A2E3A4EAB76_05D5745CF4321432_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC(=CS3)C#N""",21,"""E6B2D018D864E862"""
-"""BB93358979E599B0_0B8201AEC5E1C73A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=C)C[S](=O)(=O)Cl""",21,"""E6B2D018D864E862"""
-"""44D6022A53016F97_75B93CD8A6B89E0E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CN3CC4CC4""",21,"""E6B2D018D864E862"""
-"""3B4EED979A8137C4_1CDCFAC967303694_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C[N](CC)N=N3""",21,"""E6B2D018D864E862"""
-"""F1C3AF81A660ACA1_69E51F61CF998908_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(N=[S](C)(=O)C)=O""",21,"""E6B2D018D864E862"""
-"""EE5FF10B937E4CF5_8D5B7726BA780143_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN3CCOC3=O""",21,"""E6B2D018D864E862"""
-"""6BFC401950EE26A7_654770FE9F87E582_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC3CCOC3""",21,"""E6B2D018D864E862"""
-"""3B9F3B14745FB14B_C6CAC2A4A748F4F6_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CN3CC(C)C""",21,"""E6B2D018D864E862"""
-"""FB266A28A7082F1E_48002251FA6359CD_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC(C)(C)C3CC3""",21,"""E6B2D018D864E862"""
-"""2318AED562E86561_1ED30DC06ECC0521_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC3=NN=N[NH]3""",21,"""E6B2D018D864E862"""
-"""497FDF60B74BC44C_ECC1407FC9ECA783_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=NOC(=N3)C""",21,"""E6B2D018D864E862"""
-"""28FC428CC1FD63AA_134DEC25D77938A8_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOC3CC3(F)F""",21,"""E6B2D018D864E862"""
-"""6045D9F79D638725_E5248683CE76EC3B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CCC[S]3(=O)=O""",21,"""E6B2D018D864E862"""
-"""972D5BBA794FFEA4_E8486DFAAFB0E7DA_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C[N](CC)N=C3""",21,"""E6B2D018D864E862"""
-"""11D4F88A81DF36E2_91C5BA5F026725B9_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(OC)C3CCC3""",21,"""E6B2D018D864E862"""
-"""240A16C387D820A4_2F1B542568F99DAA_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=NC=CC=C3""",21,"""E6B2D018D864E862"""
-"""5AB3E712C2FEC98A_811AAFB6A44E3D4F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=CC=NS3""",21,"""E6B2D018D864E862"""
-"""FB58E8EA2BE8F6C8_62C48EB5BBF988A2_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=C[N](C)N=N3""",21,"""E6B2D018D864E862"""
-"""6B826ABDCC329354_50E33A5B764521D6_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=COC=C3""",21,"""E6B2D018D864E862"""
-"""23628BF1D3CA7F75_48BDECFDB73CDE29_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(OCC)C3CC3""",21,"""E6B2D018D864E862"""
-"""B3BCAEED015C3E4A_3C4D099542968D44_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC(CCC)C""",21,"""E6B2D018D864E862"""
-"""94364E4BBB69C757_0B05FFD4FC4D2E70_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)C=NC=C3""",21,"""E6B2D018D864E862"""
-"""70E9367459773EAB_47B0848C20EB0C40_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC(=NC=C3)F""",21,"""E6B2D018D864E862"""
-"""DFE77DB3C2F5B592_DD9B5960EAB219E4_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=CC(=C3)F""",21,"""E6B2D018D864E862"""
-"""2DC0976C53F767C9_481CB3435264754A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NN=C(CC)S3""",21,"""E6B2D018D864E862"""
-"""8EF55B50BD2C9D89_10EADEA206D96B2C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC(=C([NH]3)C)C""",21,"""E6B2D018D864E862"""
-"""C60B3B56450BE449_49BDD047CF05FB89_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)N=CC=N3""",21,"""E6B2D018D864E862"""
-"""51AAD276D4108FE7_3BE332270CC7B8A3_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC(=NC=C3)C""",21,"""E6B2D018D864E862"""
-"""C2C95C8EF51E3CC3_992362FF252339D2_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCSC(C)(C)C""",21,"""E6B2D018D864E862"""
-"""16A0AF0E851FBDD6_39FCCDCBAA8BCC72_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3OCC(C)(C)C3""",21,"""E6B2D018D864E862"""
-"""36B1E67EB0EB1E53_FD5498FB17E753DD_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=NN=N[N]3C""",21,"""E6B2D018D864E862"""
-"""B469B5CB99B1EC94_6A96F74FA83E0A3A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOC(C(C)=C)=O""",21,"""E6B2D018D864E862"""
-"""63A5B6B1DCE355DC_122E590F456F0785_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCC(OC)=O""",21,"""E6B2D018D864E862"""
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-"""F2D788C8DA8447E2_9886821AE40F5C92_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CSN=C3OC""",21,"""E6B2D018D864E862"""
-"""A718DC255DFF96E8_A98EA20431AFAFAE_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=C(C#N)O3""",21,"""E6B2D018D864E862"""
-"""A75B027943358133_DF6FC5F8C8EA0BC8_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(CC(OC)=O)=O""",21,"""E6B2D018D864E862"""
-"""3245297A1C62B9C5_DE53359145D8C3DE_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC[C@@H]3C[C@H]3C4CC4""",21,"""E6B2D018D864E862"""
-"""FDA485C716C8C085_587660597AFF0E04_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC(OCC)=O""",21,"""E6B2D018D864E862"""
-"""235A4408277CC304_F5CDED628B35D89E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC3=NC=C[NH]3""",21,"""E6B2D018D864E862"""
-"""ADC12FFC2DB59C61_6E09BF77BAA0C92B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(N(CC)CC)=O""",21,"""E6B2D018D864E862"""
-"""0A88560654CFFCDF_BC98A0AEDBCCD843_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)C=CC=C3""",21,"""E6B2D018D864E862"""
-"""5116F0643E645439_82CA894EB20F0CBA_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(NC(CC)C)=O""",21,"""E6B2D018D864E862"""
-"""C9C1C5F2FAC01D5B_D5416620F99A7573_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(C(OCC)=O)=O""",21,"""E6B2D018D864E862"""
-"""AD5CB8B4027C945F_CDC97612F917670C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCOC(F)(F)F""",21,"""E6B2D018D864E862"""
-"""32B7A5B661CD60B2_7A5EA3EE87F0D2CE_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=CC(=C3)O""",21,"""E6B2D018D864E862"""
-"""278B912C049FB284_4CF506376DC2BAAE_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=C(F)C=C3""",21,"""E6B2D018D864E862"""
-"""44C7A25BBC42E353_CDF766AFB9E7F792_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(F)C=CN=C3""",21,"""E6B2D018D864E862"""
-"""52A7F0DDAF5EDF71_DC9DCA47B0F4B402_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=C(C)C=C3""",21,"""E6B2D018D864E862"""
-"""50C6BA760B2B57BA_D1F14817C2706490_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=CC(=C3)C""",21,"""E6B2D018D864E862"""
-"""7C90AA5F472B855D_5546F3FAD2313CCD_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NN=C(C)[N]3C""",21,"""E6B2D018D864E862"""
-"""C15439B0ABC7C145_F5573E7EAE5E49A4_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(NCC(C)C)=O""",21,"""E6B2D018D864E862"""
-"""08D137E193D343ED_3E7D7565BC74C408_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(NCCCC)=O""",21,"""E6B2D018D864E862"""
-"""E28EB91E989CF45A_8C11AC18BD9A8E45_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC3CCCC3""",21,"""E6B2D018D864E862"""
-"""075B097071609351_2CC0246DEB6DF7F0_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCOCCOC""",21,"""E6B2D018D864E862"""
-"""4FBC74F1A2E11487_96CA1CDC64A3095A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCC(C)(C)C""",21,"""E6B2D018D864E862"""
-"""50013475F0B8CC75_E8DEF833B4337E16_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=NN=C[N]3C""",21,"""E6B2D018D864E862"""
-"""F4F6846E173BE2EF_7459E85140E43DEE_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC(C(C)C)=O""",21,"""E6B2D018D864E862"""
-"""0EFF4B186F7151C0_129D90910676857A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC[S](C(F)(F)F)=O""",21,"""E6B2D018D864E862"""
-"""06A4CCE5BB455B41_CCD7EB6A441F5383_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOCCOCC""",21,"""E6B2D018D864E862"""
-"""5B53F46868E35453_6D0BDFD5E4D2DF98_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CN=C(CC)O3""",21,"""E6B2D018D864E862"""
-"""0C426D1F6918EAFD_2295D21CFCF3CC42_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOC3CCOC3""",21,"""E6B2D018D864E862"""
-"""56058A22181E213B_4A53AEFFAC7D0A05_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=NN=C(C)O3""",21,"""E6B2D018D864E862"""
-"""F59E74ADF5B20254_87C45833CE681377_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=CC(=N3)O""",21,"""E6B2D018D864E862"""
-"""ACC1722548018F05_6F25D7547629E83B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCCCC#C""",21,"""E6B2D018D864E862"""
-"""08971626EF48309E_D04F6A24AD646F7F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=N[N](C=C3C)C""",21,"""E6B2D018D864E862"""
-"""22EAB95ABE46EDB2_33D93AAF3F120B79_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3OCCNC3=O""",21,"""E6B2D018D864E862"""
-"""5001DCBDF3D6F7E5_C44701B161934A20_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CSC(=N3)CO""",21,"""E6B2D018D864E862"""
-"""CAE4424E6771475E_39E92024BDE0F5E9_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCOC3CCC3""",21,"""E6B2D018D864E862"""
-"""86F08258F6967407_208A919BE1CE5172_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC[N]3C=NC=C3""",21,"""E6B2D018D864E862"""
-"""32F3E9AC6B3661A7_EF82AA113D42A312_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3OCC(F)(F)C3""",21,"""E6B2D018D864E862"""
-"""DEAA20CBFD63606E_E3A003EB324C12F1_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=CSC=C3""",21,"""E6B2D018D864E862"""
-"""5E32F9F63DC0F547_2FAECB8EB1503A6B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=CSN=C3""",21,"""E6B2D018D864E862"""
-"""B18BFB2FC62333AA_D61DFE9C4C9EC40A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3CCCO3""",21,"""E6B2D018D864E862"""
-"""1D76BF38F53C06F1_A2F9148A8C39D050_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC[N]3N=CN=C3""",21,"""E6B2D018D864E862"""
-"""B2C272532A318E9C_A44703013B359FC8_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NN=C(C)C=C3""",21,"""E6B2D018D864E862"""
-"""D2AFFE690D24F2C8_1A42FE08FFBC2880_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3OCCC3(C)C""",21,"""E6B2D018D864E862"""
-"""232740342EA420FE_22AB665C5409849C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CN=C[N]3CC""",21,"""E6B2D018D864E862"""
-"""D1C81F0F6BD346B9_C7D51BFE6D06BAFB_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC(C(F)F)(F)F""",21,"""E6B2D018D864E862"""
-"""BBEE10BE08E8FAA0_37E3C6D66081E943_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=CC=C[N]3C""",21,"""E6B2D018D864E862"""
-"""796501DD55C4BCF9_664EACB8C50DD134_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOCCC(C)=O""",21,"""E6B2D018D864E862"""
-"""2EE448E19FB74964_F0FAEADDCB908422_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CN(C)CCO3""",21,"""E6B2D018D864E862"""
-"""004DD61D45565AE4_BAE9C4C48BD1D204_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCSC3CCOC3""",21,"""E6B2D018D864E862"""
-"""58DADFD2D3937944_284AF9133A559E63_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN(C)[S](=O)(=O)C""",21,"""E6B2D018D864E862"""
-"""1B8C630DF727DBF3_6336217FBC8A9C69_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NN=C(OC)S3""",21,"""E6B2D018D864E862"""
-"""B54265AF90961522_EA21C08AB9542F6E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=N[NH]C(=N3)CC""",21,"""E6B2D018D864E862"""
-"""4FAF4E3652C0DE58_C7CEDBEBE2B0CF7A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)NCCC#N""",21,"""E6B2D018D864E862"""
-"""78A99E0E7524BE2E_D43B2C401EFBA47F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCCC(O)=O""",21,"""E6B2D018D864E862"""
-"""FFE18D678139B5A2_10B35FC5E54D29C0_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(NC(C)(C)C)=O""",21,"""E6B2D018D864E862"""
-"""56380C3B429C56F3_F27613FA0F9920C4_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)SC(=N3)C""",21,"""E6B2D018D864E862"""
-"""7C0F83EA0E3FD913_D33D2040F6D653F6_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(C3CCNC3)=O""",21,"""E6B2D018D864E862"""
-"""717A7669FB8F8404_07D213385343836A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=N[N]3CC""",21,"""E6B2D018D864E862"""
-"""FE3E3DD79B2AC278_607F2F8F825006E5_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC#C[Si](C)(C)C""",21,"""E6B2D018D864E862"""
-"""EAA0EFC1311CB731_204B321FC616A71E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3=NC=CN=C3""",21,"""E6B2D018D864E862"""
-"""63D18C04DA6E348D_9BBEC4F1CB7BEA5E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC[N]3C=NN=N3""",21,"""E6B2D018D864E862"""
-"""9764064AA80E551F_D5AD46B6D3000C52_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC#CC3=CC=CS3""",21,"""E6B2D018D864E862"""
-"""30F90F83686ADAFB_508BB493C3687655_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCCC(C)=O""",21,"""E6B2D018D864E862"""
-"""619EF6F621D15A1E_2C8522A73E860B7E_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(CN)OC=N3""",21,"""E6B2D018D864E862"""
-"""64B9267F440AD92E_C7BA6641DE69A85A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CC[S](=O)(=O)N3""",21,"""E6B2D018D864E862"""
-"""BAD88161B06846B3_22B517C4F05A6D80_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC#CCOC(C)=O""",21,"""E6B2D018D864E862"""
-"""B04D65E7DCF344D6_2BC23EB247DB1353_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=COC=N3""",21,"""E6B2D018D864E862"""
-"""543D91D6367A3C49_0F7468F1F7A50B25_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(SC=C3)C#N""",21,"""E6B2D018D864E862"""
-"""571EC298899A2E96_12904592AE93834B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(F)C=CC=N3""",21,"""E6B2D018D864E862"""
-"""3B15DDFE96487B66_5F9B0E28DA3C38B3_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=CC=CS3""",21,"""E6B2D018D864E862"""
-"""7500C9B8698C4640_0DD45F3CC216DEE4_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=CN=CO3""",21,"""E6B2D018D864E862"""
-"""C19CF504326B63F3_C9E8B41AD6217809_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=CSN=N3""",21,"""E6B2D018D864E862"""
-"""DBF64C63C967BFD2_FDBBBBC0889C8E81_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=NOC=C3""",21,"""E6B2D018D864E862"""
-"""DE3E09541A2829CF_AED6D81AEC1A5D5F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NN=C[N]3CC""",21,"""E6B2D018D864E862"""
-"""317B07897CC95285_6F2D11DAA8EE5F2E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)C=N[N]3C""",21,"""E6B2D018D864E862"""
-"""652D1439F51A7F46_359BFE05C233E008_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOCCC(O)=O""",21,"""E6B2D018D864E862"""
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-"""2F5E21E1642A09A9_E4ACA2D53A02110B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CCCCCO3""",21,"""E6B2D018D864E862"""
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-"""D5A5AFB3D8E90070_331E0F27D16F1093_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NOC(=N3)CN""",21,"""E6B2D018D864E862"""
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-"""CF9D55DA95F54C05_5CC3AD4BF5EB5FFE_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3OCCNC3""",21,"""E6B2D018D864E862"""
-"""F97E4301F7878673_7ED37AD3E195280B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(F)N=CC=C3""",21,"""E6B2D018D864E862"""
-"""1069C58521D29FF1_CBD14058148D6486_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC(=N[N]3C)C""",21,"""E6B2D018D864E862"""
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-"""24AAA5D628DE7388_EBECBE6F3C5BC209_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC(C)(C)CO3""",21,"""E6B2D018D864E862"""
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-"""5ADE2515F4598FEC_F419323691FD87A0_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC(C(OC)=O)N""",21,"""E6B2D018D864E862"""
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-"""E4A2EDE326529396_CDC2662E5696DDE0_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3OCCC3C""",21,"""E6B2D018D864E862"""
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-"""04A702881E5B9172_048F3B06AEE0EC82_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCSCCCCC""",21,"""E6B2D018D864E862"""
-"""A6F74D585A6C5314_247F1E4A507898CC_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3CCC(C)O3""",21,"""E6B2D018D864E862"""
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-"""1603E1E5EAFB43D1_87E92E676221D02C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CCC(C)CO3""",21,"""E6B2D018D864E862"""
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-"""8CC617AC4243D766_19FA6EAE48E35A39_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCC(OC)=N""",21,"""E6B2D018D864E862"""
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-"""F58B4B5E5F398428_DE8F520051E73C9D_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC([C@@H]3CCCN3)=O""",21,"""E6B2D018D864E862"""
-"""BFE0C29BD38872A2_3DFA930A798BC83C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NOC(=C3)CC""",21,"""E6B2D018D864E862"""
-"""FCAD771B8DF108E6_BF48C4908DBCA10D_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC([C@H]3CCCN3)=O""",21,"""E6B2D018D864E862"""
-"""31504E7B0367D6BE_5ACABD00F8DD771D_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCCC3CC3""",21,"""E6B2D018D864E862"""
-"""C91F9F95E331FD7B_F17BF300D90EA036_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3CCCCO3""",21,"""E6B2D018D864E862"""
-"""FB4CA167DD94B1DB_C8A75F3C48D7F88E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC3=CON=C3""",21,"""E6B2D018D864E862"""
-"""52F41F0D44CBA614_2ADBEB5D74A2B790_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CC=C[N](=C3)=O""",21,"""E6B2D018D864E862"""
-"""C36A8C2E7D48A0E1_F1E682CF376E6C9D_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC=C(C)C=C3""",21,"""E6B2D018D864E862"""
-"""6CAB21D9A4F913F2_7A61BD6582514FBC_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCN[S](C)(=O)=O""",21,"""E6B2D018D864E862"""
-"""E22CC77970DD0E05_D68966445C527849_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(C(C)=NO)=NO""",21,"""E6B2D018D864E862"""
-"""511B8FA469A5E8B0_10B2F8BE1FD2AA8D_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NN(C)C(N3)=O""",21,"""E6B2D018D864E862"""
-"""5DAFFEC996E9DC95_FB0389898FA1B657_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC3=CSC=C3""",21,"""E6B2D018D864E862"""
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-"""EE159DFDB098BD83_3D986830A453FFAB_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOCCC3CC3""",21,"""E6B2D018D864E862"""
-"""0787E83D38343C98_2AF354685D48A719_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC#CCOCOC""",21,"""E6B2D018D864E862"""
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-"""8C1D0EA89B83FE51_089DFE0077A5ADFC_6039_UN""","""CC(OCC(C1=C([N](CCCOC)C(=C1)C)C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""98FF38FA279C12D0_3AA0590C9E632CCF_6039_UN""","""CC(OCC(NC1=CC=C(C(N(C)C)=O)C=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""EEFE209ABA7BD601_932D75F228EA916A_6039_UN""","""CC(OCC(NCC(N(C)C)C1=CC=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""C29455CFB7CC963A_FD25408946CC5474_6039_UN""","""CC(OCC(C1=C([NH]C(=C1C(OCC)=O)C)C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""EAF3F3E6127658E7_415D1C4F9BB017DC_6039_UN""","""CC(OCC(N(C1=CC=C(C)C=C1)CCC#N)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""2DD82C06455D5AF0_156D439A484F569A_6039_UN""","""CC(OCC(NC1=C(C(OC)=O)C(=C(S1)C)C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""FF9EDBE34AAEC959_089A39BE6CB4A462_6039_UN""","""CC(OCC2=NN=C(C1=CC=CC(=C1)[N](=O)=O)O2)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""33242131D60874AE_FAD16B4F8E661E92_6039_UN""","""CC(OCC(C1=CC=C(CCCCCC)C=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""3BE4C167B5849272_AB79C72F51024430_6039_UN""","""CC(OCC1=C(C(OCC)=O)OC2=C1C=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""44020638DB71B25A_26A2305A35791211_6039_UN""","""CC(OCC(NC1=CC=CC(=C1)C(NCC)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""A6DAC88E6E73B72C_72A9316184200412_6039_UN""","""CC(OCC3=C1C=CC=CC1=C2C=CC=CC2=N3)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""F280CCC500FF966A_860D59ECFDE3C943_6039_UN""","""CC(OCC(NC(C)C2=CC1=C(C=CC=C1)O2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""09946C195AA61547_889A93D80DEE8FE2_6039_UN""","""CC(OCC1=CSC(=N1)COC2=CC=C(F)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""3C517CC11FA91E88_82C86CC925E4F92B_6039_UN""","""CC(OCC(N(C)C1CCCC2=C1C=CC=C2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""AAD0C3D33E8197F2_1919E76537684DA6_6039_UN""","""CC(OCC(=O)N1CCN(CC1)CC2=CC=CS2)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""580ABD837C199FA9_138DB22CF5090421_6039_UN""","""CC(OCC1=CSC(=N1)C2=CC=C(OCC)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""1F83D51D6A42E079_AF07B200705F352F_6039_UN""","""CC(OCC(C1=C(C)[N](C(=C1)C)C2=NC=N[NH]2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""E87016A8D5AD7F62_F6EFCE81116702E3_6039_UN""","""CC(OCC(NC(NC1CCCC(C)C1C)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""E34E0F835222D746_3A644B8FAB7D47A9_6039_UN""","""CC(OCC(NC(NC1=CC=C(OC)C=C1)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""C4316F44B64BC8C7_DAE94B05DF1773CB_6039_UN""","""CC(OCC(NC(C1=CC=C(C(C)C)C=C1)C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""D03A73E5224449F2_617FCFBAED82756D_6039_UN""","""CC(OCC(C1=C(C)[N](C(=C1)C)C2=NOC=C2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""BBB7347CD180915A_11B2DE15799F632C_6039_UN""","""CC(OCC(NN=C2C1(CCC(C1(C)C)C2)C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""22E7CC024C61C865_71EF5A92C3AECB02_6039_UN""","""CC(OCC2=NC1=C(C(=C(C(C)=O)S1)C)C(N2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""068FCBC6B40C596C_4175ED1927EC2CF8_6039_UN""","""CC(OCC(N(CC(C)C)C1CC[S](=O)(=O)C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""38E00A9A8F888D9C_6447405424F1DDC6_6039_UN""","""CC(OCC(N(CC1=CC=C(OCC)C=C1)C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""4C70A92F14419CDA_2E0DC285AD3A955E_6039_UN""","""CC(OCCC(=O)NC(=O)NCC1=CC=CC=C1)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""83E6FB571F6A5950_A5CD370B5DB985A0_6039_UN""","""CC(OCC(N(CC1=CC(=C(OC)C=C1)F)C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""29BB7D7105E5A3E3_0A785063CD134D98_6039_UN""","""CC(OCC1=C(C(=N[N]1C2=CC=CC=C2)C)C#N)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""F4953F0D0834B02B_24795E10560323CA_6039_UN""","""CC(OCC(=O)NCCCOCC1=CC=CC=C1)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""6075758817D3CA6F_5DA8E9F604F9B9BB_6039_UN""","""CC(OCC(=O)C1=CC=C(C=C1)N2CCCC2=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""8FB6ACF9EB3B2AFA_41C099C603FC510B_6039_UN""","""CC(OCC(=O)N1CCN(CC1)CC2=CSC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""467D872A6BB431CE_F51B2DFBEC361059_6039_UN""","""CC(OCCCON2C(=O)C1=C(C=CC=C1)C2=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""656EEF097DEF77BB_F33D9AEF1F05E413_6039_UN""","""CC(OCC1=CC(=CN=C1)OCC2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""F481BABC5FBC8524_187E591E43AAC55A_6039_UN""","""CC(OCC(NC(C(C)=O)CC1=CC=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""365962874747CA49_FE819E4C4435C075_6039_UN""","""CC(OCC(=O)NNC(=O)CC1CC[S](=O)(=O)C1)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""CB2DCD1D14ABE86C_B2A139A7D7FC1EC4_6039_UN""","""CC(OCCC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""F6B5CAA709784527_465781518748301B_6039_UN""","""CC(OCCC(NC1=C(C)C=CC(=C1)[N](=O)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""CF640F96C8AAD074_8FCAC822A1B4F671_6039_UN""","""CC(OCC(NC(C1=CC=C(C)C=C1)C2CC2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""C68C999128FF9D9F_CC84AEC0F791E051_6039_UN""","""CC(OCC(=O)NC1=C(N=CC=C1)N2CCCC2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""C11A3179A06300B1_44C7EF881A6D2849_6039_UN""","""CC(OCC(=O)NCCC1=C[NH]C2=C1C=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""60834A2E0D3D0FD5_9B7B3ADD531446C2_6039_UN""","""CC(OCC(C2=C[N](C1=CC=C(F)C=C1)N=N2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""4BE969280A6E00FC_43AEB07FE1E4B78A_6039_DP""","""CC(OCC(N[C@H](C(O)=O)CC1=CC=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""89619804700888BF_907AB98CC17DA685_6039_DP""","""CC(OCC(N[C@@H](C(O)=O)CC1=CC=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""0153109770CC0FDA_B5A04F48C425B6A3_6039_UN""","""CC(OCC1=CC(=CC=C1)OCC2=NC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""C436A7559A486290_91A465A4922DC020_6039_UN""","""CC(OCC(=O)NC1=CC=C(C=C1)N2CCCC2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""BD5292B8E5B0550B_1C95C484173DBBC9_6039_UN""","""CC(OCC(NCC1=CC(=C(OC)C=C1)OC)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""BFBCF4BECDDA81B9_73D27AD9E1915B0D_6039_UN""","""CC(OCCCCCCCCCCCCCCC)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""06E945E3E2BFF309_AAB87182EC28D72C_6039_UN""","""CC(OCC(=O)N1CCC(=CC1)C2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""50C3A63927C9BF43_508CB4A0943C1827_6039_UN""","""CC(OCC(NC1=C(C=C([N](=O)=O)C=C1)C#N)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""EEDC420CCF84AD50_8FA3B774C98766CA_6039_UN""","""CC(OCC(NC1=C(OC)C=C(C=C1)[N](=O)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""F97DBB8CA66F0326_56C1CAA7D94DB9D5_6039_UN""","""CC(OCC(NC1=C(C(OCC)=O)C=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""DB8E237AC7F28BA8_1FA4EFF76C347ADA_6039_UN""","""CC(OCC(C1=CC(=C(C(=C1)OC)OC)OC)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""977FDCC76A068ED0_314B9D33A657B321_6039_UN""","""CC(OCC(N(CC(N(C)C)=O)CC(F)(F)F)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""3534176DA8C3DFBA_4D628612DEA8A809_6039_UN""","""CC(OCCOC1=CC=C(C=CC(OC)=O)C=C1)C(=O)O""",21,"""D708779EEBF1CAE9"""
-"""D00C091F5904357E_3467999711A6E827_6039_UN""","""CC(OCC2=C1N=CC=CC1=C(C(OC)=O)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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-"""5AB8F506EC6B2FC6_2BE05D82EF861A0A_6039_UN""","""O(C1=CC2=C(C=C1)[NH]C(=N2)C3=CSC=N3)CC4OC4CC""",21,"""81D96827A5DD35E3"""
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-"""6B9F0B7318C8D955_0D7B8127F94BF865_6039_UN""","""COCC(C)OC1=CC=C(C=C1)COCCC[Si](Cl)(Cl)Cl""",21,"""045B7C961974274A"""
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-"""C969977A5B9312E8_3F76A011625EC549_6039_DP""","""NCCCOCCOCCOCCCCC[N]1C=CN=C1""",21,"""E644F2957196BF1B"""
-"""DC858551FCB8E78B_80D3222224AF4B20_6039_DP""","""NCCCOCCOCCOCCCOC(NC(N)=O)=O""",21,"""E644F2957196BF1B"""
-"""D137EB082EFAC069_6B08606F616922AC_6039_DP""","""NCCCOCCOCCOCCCC[N]1C=CN=C1C""",21,"""E644F2957196BF1B"""
-"""BEBCA70224FBEB06_5A3A650EC15CDA8F_6039_DP""","""NCCCOCCOCCOCC1=NC(=NO1)C(C)(C)C""",21,"""E644F2957196BF1B"""
-"""51039EF1C1CF33BC_3324317B5843B512_6039_DP""","""NCCCOCCOCCOCCC(N(C)CCC#N)=O""",21,"""E644F2957196BF1B"""
-"""1C40C3D16AF18210_280E1C97D3E8717A_6039_DP""","""NCCCOCCOCCOCC(N(CCCC)CC)=O""",21,"""E644F2957196BF1B"""
-"""7AD0FF747844886E_9BE9584D08425298_6039_DP""","""NCCCOCCOCCOCCC(=O)N1CCCCC1""",21,"""E644F2957196BF1B"""
-"""51CB008E52A0786C_9960C934E7777F03_6039_DP""","""NCCCOCCOCCOCC1=C(OC)C=CC(=C1)F""",21,"""E644F2957196BF1B"""
-"""0F407E099CA07560_6109EB1DC58C22EF_6039_DP""","""NCCCOCCOCCOCCC(=O)N1CCOCC1""",21,"""E644F2957196BF1B"""
-"""16890AC3FF6F3B12_94B3842A7FB8D45D_6039_DP""","""NCCCOCCOCCOCC2=CC1=C(C=CC=C1)O2""",21,"""E644F2957196BF1B"""
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-"""CB3E4FD7D027AB06_011E7086BAD1DC8B_6039_UN""","""CCC(CC)(COCCSCC1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
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-"""B14B50E398DCD316_311A9281B077DD47_6039_DP""","""CNC(=O)OC1=CC(=CC=C1)OCC2CNC(CO2)(C)C""",21,"""39F2C8397A413030"""
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-"""719923766190D745_5B17A06F158AD22F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCNC(=O)C2CCCC2""",21,"""39FC264BEC36A627"""
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-"""2252F597EC33BDA2_A50A18CCA0972A77_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC=C(O2)C3=CC=CS3""",21,"""39FC264BEC36A627"""
-"""46221E962B7B12E8_E037DFA2017F232A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)NCC2=CN=CC=C2""",21,"""39FC264BEC36A627"""
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-"""329E35C8E3014531_99FF3A28941CC709_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)CCC(C)C""",21,"""39FC264BEC36A627"""
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-"""854B0C6FC58F7C80_44A13CE586406B26_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCOC2=CC=CC(=C2)OC""",21,"""39FC264BEC36A627"""
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-"""097681B378E8F864_0EA6A2E751140968_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC2CCC(C)CC2)=O""",21,"""39FC264BEC36A627"""
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-"""4DABC6CFB3DF6CC8_9DCDF1A612F54BA1_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CSC(=N2)C3CCCC3""",21,"""39FC264BEC36A627"""
-"""F902FE0F0DF5DF27_1A9041E22D219AD3_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)C3CCCC3""",21,"""39FC264BEC36A627"""
-"""55716C34EC0841DF_8B849EED9979A851_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N(CC(C)C)C(C)C)=O""",21,"""39FC264BEC36A627"""
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-"""52FD42149C3768EE_0729077A9366C524_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)NC(C2CC2)C3CC3""",21,"""39FC264BEC36A627"""
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-"""FFD1DBACCAF41889_F3D23C2E3F13E47A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)NCCC2=CC=CS2""",21,"""39FC264BEC36A627"""
-"""62554E581F77B741_2F0D304E436AB26C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCN2C(NC(C)(C)C2=O)=O""",21,"""39FC264BEC36A627"""
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-"""12CB40E556700F6F_263C9292DC051493_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC(CC)(CC)C(=O)OC""",21,"""39FC264BEC36A627"""
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-"""4B07CDF1D378BCED_597E695275812269_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=C(N(C)C)C=C2)C""",21,"""39FC264BEC36A627"""
-"""00326D6A0BCAC627_E104E80CB717BBC7_6039_DP""","""O(CC1=CC=C(C=C1)CF)CC(NCC2CCCNC2)=O""",21,"""39FC264BEC36A627"""
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-"""96A1761DC25F3232_7738A06F3662C6E3_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)C2=CC(=CC=C2)C#N""",21,"""39FC264BEC36A627"""
-"""C1DC1CD283D14CED_416865E8BB9AE4E6_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=N[N](C=C2)C3CCCC3""",21,"""39FC264BEC36A627"""
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-"""01362986BF2199DD_2D5268AE36664E5E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=NO2)C(OCC)=O""",21,"""39FC264BEC36A627"""
-"""02F9AFAA8519C676_EB74185A23870614_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(C=C2)C=CN=C3""",21,"""39FC264BEC36A627"""
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-"""3A86526CBDF343EC_2671B3991C489404_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)NC2CCCCCC2""",21,"""39FC264BEC36A627"""
-"""FEBF6896DB481BDD_7DD8BCACC61DBF0A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCOC2=CC=C(F)C=C2""",21,"""39FC264BEC36A627"""
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-"""02D767A87AD63DEB_0B09A726C22CC794_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=C2)C(F)(F)F""",21,"""39FC264BEC36A627"""
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-"""9445F65FBA986B87_111CD461D2B34AB3_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)NCC2CCCCC2""",21,"""39FC264BEC36A627"""
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-"""5A5AB43C4A16ABCB_78923241B3EE787A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3COC2(CCOCC2)O3""",21,"""39FC264BEC36A627"""
-"""EF36A9E68F53C4DF_1C35CA683F54DDFB_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2CCCC(C(F)(F)F)O2""",21,"""39FC264BEC36A627"""
-"""F5306F1395879C03_E822D214D4E17900_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NSC(=N2)C(OCC)=O""",21,"""39FC264BEC36A627"""
-"""1799C35266D6896B_8C4AEC65DB928D73_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCCCCCCCCC""",21,"""39FC264BEC36A627"""
-"""4027A85F5D89DF5F_B61F4F55F1D02F92_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NN=C3C(=O)NC=C[N]23""",21,"""39FC264BEC36A627"""
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-"""FBEF2CF1B577B3E3_C9A281F98E4C4D12_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(C=C2)C=NC=C3""",21,"""39FC264BEC36A627"""
-"""F8DA5CDD01718309_74A9DFE98196AC71_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C)C=C(C=C2C)C#N""",21,"""39FC264BEC36A627"""
-"""AAEEC851CCC3F04F_D4F44F8E07AA81D5_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CN=CC(=C2)C(OC)=O""",21,"""39FC264BEC36A627"""
-"""B652D8F6056900B2_ADF57AD54426B681_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=C2)[S](F)(=O)=O""",21,"""39FC264BEC36A627"""
-"""D3C877D79A933890_50AF591263816CB1_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(CC(C)=O)C=CC=C2""",21,"""39FC264BEC36A627"""
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-"""A39E8F9B5BC67C4F_290470E2DC392FCE_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=N2)C(F)(F)F""",21,"""39FC264BEC36A627"""
-"""DC7BE539D30552E5_1FEDC9C2392960C9_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCN2CCC(F)(CC2)F""",21,"""39FC264BEC36A627"""
-"""CBB1BE9DD24A3CB2_171C0DD2EF4DFE8F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C)C=CC(=C2)[N](=O)=O""",21,"""39FC264BEC36A627"""
-"""ACB6A50C440FCC50_E8A246C30B1405DA_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C=CC(=C2)C(O)=O)F""",21,"""39FC264BEC36A627"""
-"""574AEBF3013BADFD_4155B5275421603B_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCNC(=O)C2CCOCC2""",21,"""39FC264BEC36A627"""
-"""7C079E57C3FA911C_EE761A5EF3665E9D_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC=CC(=C2)C(OC)=O""",21,"""39FC264BEC36A627"""
-"""2DEA94EE99790ABD_2854D1008D41B776_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(C=C2)COCC3""",21,"""39FC264BEC36A627"""
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-"""F109D3E4A2784751_64BBEE9736BCB325_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=N[NH]2)C(OCC)=O""",21,"""39FC264BEC36A627"""
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-"""041B7B275900180B_049EADA7278FAC62_6039_DP""","""O(CC1=CC=C(C=C1)CF)CC3CCC2(CCNCC2)O3""",21,"""39FC264BEC36A627"""
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-"""C889F70305CD4BE9_97569458283D735A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC2(C(O)=O)CCOCC2""",21,"""39FC264BEC36A627"""
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-"""C39FA03C0F5BE9A8_FD30CCC09B9F5A1D_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=NC(=N2)C3CC3)C""",21,"""39FC264BEC36A627"""
-"""901F3C7676BBDD9F_0E3DC5531AF925B4_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=NC(=N2)OC)OC""",21,"""39FC264BEC36A627"""
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-"""CB6C78FF8AAC9260_4FA18285709921D7_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC=C(C(C)(F)F)C=C2""",21,"""39FC264BEC36A627"""
-"""3017A1E1025BAA3B_EAF41811FF50C394_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2CN2CC3=C[N](C)N=C3""",21,"""39FC264BEC36A627"""
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-"""AA9289884571665C_000A4AB32F7F9D22_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=N2)OC(F)F""",21,"""39FC264BEC36A627"""
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-"""B5D059FC804ADD70_18B183F82D987DB9_6039_DP""","""N[C@@H]2CC[C@@H](OCC(C1=C([N](CCOC)C(=C1)C)C)=O)C2""",21,"""8E86621C0BB19007"""
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-"""B4B16B1E4A1C0215_D5AD788B58BFE952_6039_DP""","""N[C@@H]2CC[C@@H](OCCC(NC1=CC=CC(=C1)[N](=O)=O)=O)C2""",21,"""8E86621C0BB19007"""
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-"""58560F19EFCE911E_1093BE8248374518_6039_DP""","""N[C@@H]2CC[C@@H](OCC(N1C(CC(CC1(C)C)=O)(C)C)=O)C2""",21,"""8E86621C0BB19007"""
-"""EB8F79A0C65F0B9C_ED20E30972ACB7A9_6039_DP""","""N[C@@H]2CC[C@@H](OCCCC(=O)NC1=CC=C(C=C1)C#N)C2""",21,"""8E86621C0BB19007"""
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-"""4BB46B7858049305_F6716F972A29A3C9_6039_DP""","""N[C@@H]2CC[C@@H](OCC(NC(CCC)C1=CC=CC=C1)=O)C2""",21,"""8E86621C0BB19007"""
-"""FC696871B45C603B_47B074D281879FB2_6039_DP""","""N[C@@H]2CC[C@@H](OCC(=O)NC(=O)NC1CC[S](=O)(=O)C1)C2""",21,"""8E86621C0BB19007"""
-"""8F9FBE274BA731B3_54CA1FF8DAD30044_6039_DP""","""N[C@@H]2CC[C@@H](OCC(N(CC1=CC=C(SC)C=C1)C)=O)C2""",21,"""8E86621C0BB19007"""
-"""AE997C40B0E26A47_CF684DA8C909A030_6039_DP""","""N[C@@H]3CC[C@@H](OCCCN2C(=O)C1=C(C=CC=C1)C2=O)C3""",21,"""8E86621C0BB19007"""
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-"""C074F3A9B38415E9_960434AB61693C1B_6039_DP""","""N[C@@H]3CC[C@@H](OCC(=O)NC2=C1C=CC=NC1=CC=C2)C3""",21,"""8E86621C0BB19007"""
-"""B3AE37363A16343E_A540CBF57BCD65A8_6039_DP""","""N[C@@H]2CC[C@@H](OCC(NCC1(N(C)C)CCCCC1)=O)C2""",21,"""8E86621C0BB19007"""
-"""20A74AA8D94A3639_2A9D0CEACD900EEE_6039_DP""","""N[C@@H]2CC[C@@H](OCC(C1=C(C(=C(C)[NH]1)C(OC)=O)C)=O)C2""",21,"""8E86621C0BB19007"""
-"""1C5F111291105022_A5DA01DB610D905C_6039_DP""","""N[C@@H]2CC[C@@H](OCC(NCCSC1=CC=C(C)C=C1)=O)C2""",21,"""8E86621C0BB19007"""
-"""C54D7C638BF16EED_9883136386A3ECA3_6039_DP""","""N[C@@H]3CC[C@@H](OCCCCC[N]1C2=C(N=C1)C=CC=C2)C3""",21,"""8E86621C0BB19007"""
-"""B37E982FD1098B4A_53F8A4DFCC860416_6039_DP""","""N[C@@H]3CC[C@@H](OCC2=NC1=C(N(C(N(C)C1=O)=O)C)[NH]2)C3""",21,"""8E86621C0BB19007"""
-"""D0FA23865ACAB79D_2FDB3730240E223D_6039_DP""","""N[C@@H]2CC[C@@H](OCC(NCCOC1=CC=CC(=C1)C)=O)C2""",21,"""8E86621C0BB19007"""
-"""FFD82E72486E98E2_BF845B60B557D86F_6039_DP""","""N[C@@H]2CC[C@@H](OCC(NC(C1=CC=C(CC)C=C1)C)=O)C2""",21,"""8E86621C0BB19007"""
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-"""1358825C407931EA_A26989CDB55B8430_6039_DP""","""O(C1=CC(=CC=C1)OC2CC2)CC(N3CCNCC3C)=O""",21,"""EBB0E49182C40249"""
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-"""9143126FE45C205E_D1595D6F1C2209B1_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC4=CC3=C(C=CC=N3)S4""",21,"""EBB0E49182C40249"""
-"""7AA34A7C055E7C12_58CA8AEDD2910CD5_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC(=NC(=C3)C)OC""",21,"""EBB0E49182C40249"""
-"""E3DBCD9E7C5A7BE9_1C92067E4639AC9E_6039_DP""","""O(C1=CC(=CC=C1)OC2CC2)CC3CNCC4(O3)CCC4""",21,"""EBB0E49182C40249"""
-"""781AFED6294E52F1_168D3C092DE87623_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC(=NC(=N3)OC)C""",21,"""EBB0E49182C40249"""
-"""D1C48A0624E177EC_33F99E6B2EFB1CCB_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCN3CCCO[P]3(N)=O""",21,"""EBB0E49182C40249"""
-"""D2DEF4F140DE03BB_F49E92B3C34691F0_6039_DP""","""O(C1=CC(=CC=C1)OC2CC2)CC3=N[NH]C4=C3CNCC4""",21,"""EBB0E49182C40249"""
-"""B1180C44A11FDC05_33F651629BBC82B2_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=C4C(=N[NH]3)CCCC4""",21,"""EBB0E49182C40249"""
-"""3E3222355EE651DE_8944CEA7342BF7B2_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCC3=C([N](N=C3C)C)C""",21,"""EBB0E49182C40249"""
-"""C7FF8B5D3C5CF3B7_3C7D8D8466FE38EB_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=C(C(OC)=O)SN=C3""",21,"""EBB0E49182C40249"""
-"""75DC61E59C051376_3A373748F1565EE9_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=C(C(F)F)C=NC=C3""",21,"""EBB0E49182C40249"""
-"""2A691551475184BE_B6F9F061FA7548FB_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=C(C(F)(F)F)SC=C3""",21,"""EBB0E49182C40249"""
-"""B06D5407AB8E3169_2F2FB86CC23C7E51_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC(C3(C(F)(F)F)CC3)=O""",21,"""EBB0E49182C40249"""
-"""9DF175BCC278B3CC_1FE546301D2999F7_6039_DP""","""O(C1=CC(=CC=C1)OC2CC2)CC3CNC4(CO3)CCC4""",21,"""EBB0E49182C40249"""
-"""359A0AF4C664364B_5B96E468F417FC4F_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=C(C(C)(C)C)OC=N3""",21,"""EBB0E49182C40249"""
-"""4B560135AA51CFDA_5B99C76A6C05F1B7_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCOCCOCCOC""",21,"""EBB0E49182C40249"""
-"""2B4CDB2B52DD323E_9351720C04B66F74_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=NN=C(C(F)(F)Cl)S3""",21,"""EBB0E49182C40249"""
-"""7797B6C5C390389A_B14039439955C5C7_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCC(C(OCC)=O)(F)F""",21,"""EBB0E49182C40249"""
-"""2B4DC4BBA6410716_DD94011434D8DADB_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=C(SN=C3OC)OC""",21,"""EBB0E49182C40249"""
-"""DDAB40F4AB067A3C_D2F65E446570E5CF_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=NOC(=C3)CC4CC4""",21,"""EBB0E49182C40249"""
-"""21B158A01D0353E5_9331B1DF65BCD70C_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC4=C(C=C3)OCO4""",21,"""EBB0E49182C40249"""
-"""A166699619C06506_F8B8D592B29972F6_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=NC(=C[NH]3)C(F)(F)F""",21,"""EBB0E49182C40249"""
-"""BB6D9081575BDDD3_81B95E5E4BAC2F59_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=NO[C@@H]4CCCC[C@H]34""",21,"""EBB0E49182C40249"""
-"""5EFFDA2B7C94A804_0CB0DD2307A46743_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC=NC(=N3)COC""",21,"""EBB0E49182C40249"""
-"""E3A15AE634A342E2_98A5C160B6AA95AC_6039_DP""","""O(C1=CC(=CC=C1)OC2CC2)CCC4CC3CCC(N3)C4""",21,"""EBB0E49182C40249"""
-"""8814ADC20E62C7A4_38BBD7442D32F11D_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC=CC(=C3)C(N)=O""",21,"""EBB0E49182C40249"""
-"""0A59A6A1A25FCD95_FDD370D3DD89C966_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC=C(C(OC)=O)S3""",21,"""EBB0E49182C40249"""
-"""D0402A69376C7DC2_E503A7C54BA7F676_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC(NCCCC(O)=O)=O""",21,"""EBB0E49182C40249"""
-"""FD2B03453F7E0342_8D4373B805DDBC10_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC(=O)NCC3=CC=CS3""",21,"""EBB0E49182C40249"""
-"""84372350D91DF823_C70FAB0FDADF3BD8_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC=CC4=NON=C34""",21,"""EBB0E49182C40249"""
-"""6F62282C1937A766_D7E7AA51BB1A89F8_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC4=C[N]3C=CC=NC3=N4""",21,"""EBB0E49182C40249"""
-"""CB0CA64A960CA691_4875D49177BCED7D_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCOC3CCCCC3C""",21,"""EBB0E49182C40249"""
-"""85DF471018DA7281_9ACB746485D843D7_6039_DP""","""O(C1=CC(=CC=C1)OC2CC2)CC4=CC3=C(C=C[NH]3)C=C4""",21,"""EBB0E49182C40249"""
-"""1D50B7513011DB10_1DB15A82E7230D00_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=C(C(=NO3)C)[N](=O)=O""",21,"""EBB0E49182C40249"""
-"""D2FB4144B64C395A_FBB93118D28F8C5B_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCOC3=CC=C(C)C=C3""",21,"""EBB0E49182C40249"""
-"""3A4436EB604383FE_F03B80B71B749140_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCOCC(C(F)F)(F)F""",21,"""EBB0E49182C40249"""
-"""1D78158E5FFB68F6_16DFF7AC64387A28_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC(NC(NCCC)=O)=O""",21,"""EBB0E49182C40249"""
-"""89C2FE8A913D72F1_B0CC91E6AEC8E6FE_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=NN=C([N]3C)C4CC4""",21,"""EBB0E49182C40249"""
-"""ADF3175C5F0435D2_E7A6DC265BA9D271_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=NN=C(S3)C4CCC4""",21,"""EBB0E49182C40249"""
-"""86A931C8B440DF74_2C9375561E22D853_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC=CC(=C3)C(F)F""",21,"""EBB0E49182C40249"""
-"""541944F65E2834C3_95D93FACF0A7FA06_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC(=C(C=C3)C)OC""",21,"""EBB0E49182C40249"""
-"""E52153A67E3C8708_8DEE0FCC189E0E59_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=C(C=CC=C3)C4CC4""",21,"""EBB0E49182C40249"""
-"""0B407999EFC20B58_973556B4DFF9C344_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC4CC3(CCC3)C(=O)O4""",21,"""EBB0E49182C40249"""
-"""FC979AE5637F2528_AFBB1079EDA761AF_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC(NCC(C(C)C)=O)=O""",21,"""EBB0E49182C40249"""
-"""42904115F424FBEA_2AA048FAE86C46C5_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC4=NC3=C(C=CC=N3)O4""",21,"""EBB0E49182C40249"""
-"""C2ACEA3B26AB3467_9786772AE7E66F1E_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCC3=CC=C(C=C3)C#N""",21,"""EBB0E49182C40249"""
-"""7EA2EC03B09E42DB_C58B5EE510E61AA7_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC(=C(C=C3)C#N)C""",21,"""EBB0E49182C40249"""
-"""79CA1A5832CAB1B9_ACC2D85DDCA032B8_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCCN3C(=O)CNC3=O""",21,"""EBB0E49182C40249"""
-"""6EB46CA0E3579435_DC1DACCE7FF47B41_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC=C(C=C3)C4CC4""",21,"""EBB0E49182C40249"""
-"""AC67E474F69D490F_F64A56FAAB615543_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=NC=N[N]3CC(F)F""",21,"""EBB0E49182C40249"""
-"""61F167E9986F1D03_BE26B77370938AB7_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC(=C(OC)N=C3)C""",21,"""EBB0E49182C40249"""
-"""38CE767F5E856A55_10D809F44C7B11D1_6039_DP""","""O(C1=CC(=CC=C1)OC2CC2)CC4=NN=C(C3CNC3)S4""",21,"""EBB0E49182C40249"""
-"""4DB0606859B982B3_CF006F14AA54DD07_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC(C3=C(C)[N](N=C3)C)=O""",21,"""EBB0E49182C40249"""
-"""84B4F47698F7F57A_D301BE11658E7347_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CC=C(C(F)(F)F)S3""",21,"""EBB0E49182C40249"""
-"""9897FF404A2B7B50_F35C4D4BC4E946A6_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)C[C@H]3CC[C@@H](C(OC)=O)O3""",21,"""EBB0E49182C40249"""
-"""DA9EFFC52D73C65A_8C65A37C14BC168E_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=CON=C3C(F)(F)F""",21,"""EBB0E49182C40249"""
-"""45A21E7E9D94D22F_2547BEEB5996544F_6039_UN""","""O(CC(F)(F)Br)CC1=NN=C(O1)C3=CC2=C(CCCC2)S3""",21,"""1B86BFDD7E20E421"""
-"""F23F184D4724FDD3_E97CC2705FA7353A_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC=C(NC(CCC)=O)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""5638CA7D0EB9522A_C4133643E2748334_6039_UN""","""O(CC(F)(F)Br)CC(C1=C([N](CCCOC)C(=C1)C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""6C3B907575C45EE1_F62E914F0BB20207_6039_UN""","""O(CC(F)(F)Br)CC(NC1=CC=C(C(N(C)C)=O)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""42896F07BC98B610_5FA3BDB1BD3BBFA2_6039_UN""","""O(CC(F)(F)Br)CC(NCC(N(C)C)C1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""5931C09E9B67C436_31AB88CAD31D7ABC_6039_UN""","""O(CC(F)(F)Br)CC(C1=C([NH]C(=C1C(OCC)=O)C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""8F193CC8037640F7_8DD3D40C0E613914_6039_UN""","""O(CC(F)(F)Br)CC(N(C1=CC=C(C)C=C1)CCC#N)=O""",21,"""1B86BFDD7E20E421"""
-"""3854E1C89DC064BE_0D843E5CAC60C297_6039_UN""","""O(CC(F)(F)Br)CC2=NN=C(C1=CC=C([N](=O)=O)C=C1)O2""",21,"""1B86BFDD7E20E421"""
-"""377BD99607682C9A_D9E38BD9DD9E7852_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C(OC)=O)C(=C(S1)C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""5EE82230DC7B22CC_C414F1FDF9658AAA_6039_UN""","""O(CC(F)(F)Br)CC2=NN=C(C1=CC=CC(=C1)[N](=O)=O)O2""",21,"""1B86BFDD7E20E421"""
-"""4CAE8C90D24CD29A_365FA30C1BB7305A_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC=C(CCCCCC)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""8DEC01E4493852D3_67F70F6CC4D36AF8_6039_UN""","""O(CC(F)(F)Br)CC1=C(C(OCC)=O)OC2=C1C=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""8FFEA26108B59233_EBFD7432AE73DAB0_6039_UN""","""O(CC(F)(F)Br)CC2=NC1=C(C=CC(=C1)C(O)=O)C(=O)N2""",21,"""1B86BFDD7E20E421"""
-"""1B1008147734B4F7_EA2CF819A0A83CD9_6039_UN""","""O(CC(F)(F)Br)CC(NC1=CC=CC(=C1)C(NCC)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""DE6848F1D5E826E1_89A70EA05FE84556_6039_UN""","""O(CC(F)(F)Br)CCOC1=CC=C([S](N(C)C)(=O)=O)C=C1""",21,"""1B86BFDD7E20E421"""
-"""E6372F12AC77FD8E_BE27F92211F12ADA_6039_UN""","""O(CC(F)(F)Br)CC3=C1C=CC=CC1=C2C=CC=CC2=N3""",21,"""1B86BFDD7E20E421"""
-"""59C42DCD49F8B789_4A8391AF6832E78B_6039_UN""","""O(CC(F)(F)Br)CC(NC(C)C2=CC1=C(C=CC=C1)O2)=O""",21,"""1B86BFDD7E20E421"""
-"""66BBF9503B8AD09E_44145B9B983FA12A_6039_UN""","""O(CC(F)(F)Br)CC1=CSC(=N1)COC2=CC=C(F)C=C2""",21,"""1B86BFDD7E20E421"""
-"""2E6C1B980EB9897F_4E46A48AB035D7E3_6039_UN""","""O(CC(F)(F)Br)CC(N(C)C1CCCC2=C1C=CC=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""3B17A3ECC69DE59B_D5972F26A2B9636E_6039_UN""","""O(CC(F)(F)Br)CC(=O)N1CCN(CC1)CC2=CC=CS2""",21,"""1B86BFDD7E20E421"""
-"""735BD92017388653_DF037A6F60D82AE9_6039_UN""","""O(CC(F)(F)Br)CC1=CSC(=N1)C2=CC=C(OCC)C=C2""",21,"""1B86BFDD7E20E421"""
-"""AE92910B426F529B_63897A43E58E1BE7_6039_UN""","""O(CC(F)(F)Br)CC(C1=C(C)[N](C(=C1)C)C2=NC=N[NH]2)=O""",21,"""1B86BFDD7E20E421"""
-"""797F2DF0F6572D53_3A6106C284B62C2B_6039_UN""","""O(CC(F)(F)Br)CC(NC(NC1CCCC(C)C1C)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""D1F3AC379F38F611_F6EA83CC3EAC6961_6039_UN""","""O(CC(F)(F)Br)CC(NC(NC1=CC=C(OC)C=C1)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""69C880BF778D49C9_166783464AC65D03_6039_UN""","""O(CC(F)(F)Br)CC(NC(C1=CC=C(C(C)C)C=C1)C)=O""",21,"""1B86BFDD7E20E421"""
-"""D2E2C5177DBFFD73_ADF107F978535BA5_6039_UN""","""O(CC(F)(F)Br)CC(C1=C(C)[N](C(=C1)C)C2=NOC=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""1F1A364E3030CD41_DD3C1656EC4E4DE4_6039_UN""","""O(CC(F)(F)Br)CC(NN=C2C1(CCC(C1(C)C)C2)C)=O""",21,"""1B86BFDD7E20E421"""
-"""F8DDF71D111DBC3A_BD6192D1567FE5CA_6039_UN""","""O(CC(F)(F)Br)CC2=NC1=C(C(=C(C(C)=O)S1)C)C(N2)=O""",21,"""1B86BFDD7E20E421"""
-"""97EB880C143A9CE1_8DFB255AB23D0230_6039_UN""","""O(CC(F)(F)Br)CC(N(CC(C)C)C1CC[S](=O)(=O)C1)=O""",21,"""1B86BFDD7E20E421"""
-"""0AA02AF44A92DAEC_A8C98817B120F30E_6039_UN""","""O(CC(F)(F)Br)CC(N(CC1=CC=C(OCC)C=C1)C)=O""",21,"""1B86BFDD7E20E421"""
-"""8A05FD2047B1827A_E2830AC638EBBB96_6039_UN""","""O(CC(F)(F)Br)CCC(=O)NC(=O)NCC1=CC=CC=C1""",21,"""1B86BFDD7E20E421"""
-"""7DD3A492F246B5AC_6943FF48C868AB68_6039_UN""","""O(CC(F)(F)Br)CC(N(CC1=CC(=C(OC)C=C1)F)C)=O""",21,"""1B86BFDD7E20E421"""
-"""81D6BCF0778605A2_C6F6982058C26350_6039_UN""","""O(CC(F)(F)Br)CC1=C(C(=N[N]1C2=CC=CC=C2)C)C#N""",21,"""1B86BFDD7E20E421"""
-"""873D6F7487704C67_E8F79653C3D20D02_6039_UN""","""O(CC(F)(F)Br)CC(=O)NCCCOCC1=CC=CC=C1""",21,"""1B86BFDD7E20E421"""
-"""DD2CFC8ADE088889_912621B591289773_6039_UN""","""O(CC(F)(F)Br)CC(=O)C1=CC=C(C=C1)N2CCCC2=O""",21,"""1B86BFDD7E20E421"""
-"""F7AD9C6041FCB386_E4253907A21FBF12_6039_UN""","""O(CC(F)(F)Br)CC(N1CCN(C(C(C)C)C#N)CC1)=O""",21,"""1B86BFDD7E20E421"""
-"""1A9CAD941EE06664_91EB5D7A31C6E3E7_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC(=C(C=C1)OC(F)F)OC)=O""",21,"""1B86BFDD7E20E421"""
-"""DD34FC57A2DA75ED_7C7E5624D8F733A4_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC=C(CCN[S](C)(=O)=O)S1)=O""",21,"""1B86BFDD7E20E421"""
-"""87937ED6A68812BE_B0238A0AC080BC44_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC1=CC2=C(C=C1)OCCCO2""",21,"""1B86BFDD7E20E421"""
-"""FE288AE8D85882D1_4EA8BE576F95FD7C_6039_UN""","""O(CC(F)(F)Br)CC1=C(C(OC)=O)SC2=C1C(=CC=C2)F""",21,"""1B86BFDD7E20E421"""
-"""C88DC79F267CCAFF_17AC23BC3B1CFF5E_6039_UN""","""O(CC(F)(F)Br)CC(=O)NCC1(CCC1)C2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""C010DB5A43B74FDE_B0D8069072B13270_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C=CC(=C1C)C)[N](=O)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""2EFEABA877F92A97_3D473BC09168FA65_6039_UN""","""O(CC(F)(F)Br)CC(N(C1=CC=C(F)C=C1)CCC#N)=O""",21,"""1B86BFDD7E20E421"""
-"""5259FF1392312888_66C1371CBD944129_6039_UN""","""O(CC(F)(F)Br)CCC(=O)NC1=C(C2=C(S1)CCC2)C#N""",21,"""1B86BFDD7E20E421"""
-"""3DBC30B3E0017B51_379950C4C1A88163_6039_UN""","""O(CC(F)(F)Br)CCC(=O)NC1=CC=N[N]1C2CCCC2""",21,"""1B86BFDD7E20E421"""
-"""A852A927DFC6B32A_15771075759FEC9A_6039_UN""","""O(CC(F)(F)Br)CCC(NC1=CC=CC(=C1C)[N](=O)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""3000B23C2A72C8B6_356492A7C4FC446E_6039_UN""","""O(CC(F)(F)Br)CC(N(CCOC)C1CC[S](=O)(=O)C1)=O""",21,"""1B86BFDD7E20E421"""
-"""CF19FDD8D8FCA41D_88D09C4F611A3453_6039_UN""","""O(CC(F)(F)Br)CC(C1=C(C(=C(C)[NH]1)C(OCC)=O)C)=O""",21,"""1B86BFDD7E20E421"""
-"""98490485CEBE4C2E_019E9F4FA70D1CB0_6039_UN""","""O(CC(F)(F)Br)CC2=NC1=C(C=CC(=C1)[S](CC)(=O)=O)O2""",21,"""1B86BFDD7E20E421"""
-"""6E06336349A60D7E_0374835AE32ED2C8_6039_UN""","""O(CC(F)(F)Br)CC(=O)NCCC2=NC1=C(C=CC=C1)S2""",21,"""1B86BFDD7E20E421"""
-"""EF5A6B0DE93AC3AA_123CDB7B46C55CD7_6039_UN""","""O(CC(F)(F)Br)CC(N(CC)C2=NC1=C(C=CC=C1)S2)=O""",21,"""1B86BFDD7E20E421"""
-"""0245A1D621A4EA13_844CB2FB57E5D11D_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC=C(C(C)NC(=O)C)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""7A3DC16A990C4DEE_C38E339A82E3986B_6039_UN""","""O(CC(F)(F)Br)CC1=NC(=NO1)COC2=CC=C(F)C=C2""",21,"""1B86BFDD7E20E421"""
-"""EFB978235123C704_37C3C5E66B6E7042_6039_UN""","""O(CC(F)(F)Br)CC(N1CCN(CC(N(C)C)=O)CC1)=O""",21,"""1B86BFDD7E20E421"""
-"""FA833CB4427C5C88_C72E45EBBAC4B7FE_6039_UN""","""O(CC(F)(F)Br)CC(=O)C1=CC(=CC=C1)N2CCCC2=O""",21,"""1B86BFDD7E20E421"""
-"""6D37473ECFF12219_694E7CD2528F3DC5_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=CC=C(C(OC)=O)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""BADDDB99264E357B_2A2A83BB301B8762_6039_UN""","""O(CC(F)(F)Br)CCC(=O)NC1CCCC2=C1C=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""D6B1CEB875FD445C_ECBDBA31DBF2A96D_6039_UN""","""O(CC(F)(F)Br)CC1=NC(=NO1)C2=CC=C([N](=O)=O)C=C2""",21,"""1B86BFDD7E20E421"""
-"""7162CA6392AF49F2_0F85C65FEF31D807_6039_UN""","""O(CC(F)(F)Br)CCC(NC1=C(C)C=C(C=C1)[N](=O)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""68E7775D866CC8F6_4B4A2B92DDB53950_6039_UN""","""O(CC(F)(F)Br)CCC(NC1=C(C=CC(=C1)[N](=O)=O)F)=O""",21,"""1B86BFDD7E20E421"""
-"""F2173F65E427369F_8489AC097D53BFB4_6039_UN""","""O(CC(F)(F)Br)CC1=NC(=NO1)C2=C(OCC)C=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""A6C33107C1C36F5E_EFA8693E5A61CF54_6039_UN""","""O(CC(F)(F)Br)CC(NC1=CC(=C(C)C=C1)[S](=O)(=O)N)=O""",21,"""1B86BFDD7E20E421"""
-"""ACFB7059678B6D3A_068D5757B73B014B_6039_UN""","""O(CC(F)(F)Br)CC(NC1CCC(C(CC)(C)C)CC1)=O""",21,"""1B86BFDD7E20E421"""
-"""B3AA4A09D005A489_C65D0D0DCBC0DC2E_6039_UN""","""O(CC(F)(F)Br)CC(NC(NC1=CC(=C(C)C=C1)C)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""2CC6F27B23CB333E_03D89FC9292B76DE_6039_UN""","""O(CC(F)(F)Br)CC(C1=C([N](CCC(C)C)C(=C1)C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""A25C93A8ABC0580D_ADC634114BD3D99B_6039_UN""","""O(CC(F)(F)Br)CC(NC2=CC1=C(OC(F)(F)O1)C=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""0CF9A9ADD8B48587_66535184EB5220DD_6039_UN""","""O(CC(F)(F)Br)CC(C1=C(C)[N](C(=C1)C)CC(F)(F)F)=O""",21,"""1B86BFDD7E20E421"""
-"""5959B9BAB19ECF27_84DB14077B020842_6039_UN""","""O(CC(F)(F)Br)CC2=CN=C(C1=CC=C(C(C)C)C=C1)S2""",21,"""1B86BFDD7E20E421"""
-"""53C33C4D88C0CE52_587CCD840C12B8AA_6039_UN""","""O(CC(F)(F)Br)CC(C1=C(C=C(C(C)C)C=C1)C(C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""4C28E30851A753A2_E0A04F56F41312F9_6039_UN""","""O(CC(F)(F)Br)CC(NC(NC1=CC=CC(=C1C)C)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""F6E8609B4BF9D4A8_30F30E8BD704CF99_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC=C(NC(C(C)C)=O)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""B69A3600E3220660_1B0BE60AA30E4471_6039_UN""","""O(CC(F)(F)Br)CC(NNC(C1=CC=C(OC)C=C1)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""4845A1497C48CDE7_B9ACE82645BFB5F0_6039_UN""","""O(CC(F)(F)Br)CC(N(CC)CC1=CC=C(C=C1)OC)=O""",21,"""1B86BFDD7E20E421"""
-"""62C681E1A08A6E15_08C56BD8044C7FF9_6039_UN""","""O(CC(F)(F)Br)CC(=O)NCCCN1CCCCCC1=O""",21,"""1B86BFDD7E20E421"""
-"""92ABDC5B883A29DE_25C10D2C2CB10215_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=CC=C(COCC)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""CCEB9DD1E5C25494_6D86DAA42F619281_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=CC=CC(=C1)OCCC)=O""",21,"""1B86BFDD7E20E421"""
-"""99F304FA78121391_66AA88E5F88B0316_6039_UN""","""O(CC(F)(F)Br)CC(N(C(C)C1=CC(=C(C=C1)F)F)C)=O""",21,"""1B86BFDD7E20E421"""
-"""0E8CCBA7A81F4562_93D7D502F9597078_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=C(COCC)C=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""853153D2AD52F380_98B11B6D5FEA5A80_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=CC=C([S](C)(=O)=O)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""CC50B0B36B2704F4_EC7CECB129A59FED_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=CC=C(OCCC)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""6934E111C1AC7B59_E4527BD41769F934_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=CC=CC(=C1)OC(C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""BE1127E9C5C966C5_00D62F01B00EDA8B_6039_UN""","""O(CC(F)(F)Br)CC(NC(C)CC1=C(C=CC=C1F)F)=O""",21,"""1B86BFDD7E20E421"""
-"""B5FC7025D63BCC43_D097CDD33FBA6E59_6039_UN""","""O(CC(F)(F)Br)CC(NCCCOC1=C(F)C=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""A70A88025B41A13C_CFE3B4D1D0B15ED4_6039_UN""","""O(CC(F)(F)Br)CC(N(C)CCCOC1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""FFDDD12A9F5C9CD9_78B92A82ED904456_6039_UN""","""O(CC(F)(F)Br)CC(N(CC)C(C)C1=CC=C(C=C1)F)=O""",21,"""1B86BFDD7E20E421"""
-"""A8392CBE984FBEE4_0514E23A95D0F972_6039_UN""","""O(CC(F)(F)Br)CC(N(C)CC1=C(C=CC(=C1)C#N)F)=O""",21,"""1B86BFDD7E20E421"""
-"""7BD83AEFC012EE30_CC433DBC6BF41CBB_6039_UN""","""O(CC(F)(F)Br)CC(NCCOC1=CC=CC(=C1)OC)=O""",21,"""1B86BFDD7E20E421"""
-"""C7BCF0962BF02391_BEA0097BA8A1B401_6039_UN""","""O(CC(F)(F)Br)CC(N(CC1=CC=C(C)C=C1)C2CC2)=O""",21,"""1B86BFDD7E20E421"""
-"""C63D3F3EC90C706A_11E9F56E862AD027_6039_UN""","""O(CC(F)(F)Br)CC(NC(C(NC)=O)C1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""4835AD33A7805E8A_AEFC944213302205_6039_UN""","""O(CC(F)(F)Br)CC(C2=C(F)C=C1NC(CCC1=C2)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""022F2F07A33C8EC4_6BB12A3B187B7044_6039_UN""","""O(CC(F)(F)Br)CC(NCCCN1CC(OC(C)C1)C)=O""",21,"""1B86BFDD7E20E421"""
-"""62871831F8CE21C9_07499D1F19E92EF6_6039_UN""","""O(CC(F)(F)Br)CC1=CSC(=N1)C2=CC=C(C(N)=O)C=C2""",21,"""1B86BFDD7E20E421"""
-"""3B02E73B5C16A9D3_69439F53121B27F9_6039_UN""","""O(CC(F)(F)Br)CC1=CC=C(C=C1)OCC2=CC=NC=C2""",21,"""1B86BFDD7E20E421"""
-"""819471FFAA9C591E_0E7BEA929BEBC6EB_6039_UN""","""O(CC(F)(F)Br)CC1=CC=C(C=C1)OCC2=NC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""99DC47A48C89E31A_2C380CCB377783E4_6039_UN""","""O(CC(F)(F)Br)CC(=O)N1CCN(CC1)C2=NC=CN=C2""",21,"""1B86BFDD7E20E421"""
-"""F276E55D9474D804_732ED683A4FDCF06_6039_UN""","""O(CC(F)(F)Br)CCCCOC1=C(C(F)(F)F)C=CC=C1""",21,"""1B86BFDD7E20E421"""
-"""01BBBDEB8BF8121C_96F86CDDFAFAEB3E_6039_UN""","""O(CC(F)(F)Br)CC1=CC2=C(C=C1)OC(=C2)C(OCC)=O""",21,"""1B86BFDD7E20E421"""
-"""23F4201DD5CD35E4_64C331423D0CDC51_6039_UN""","""O(CC(F)(F)Br)CC(C2=CC1=C(OC(C)C(N1)=O)C=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""8BCA30A786029215_52B1CF1EE2B2CA4A_6039_UN""","""O(CC(F)(F)Br)CC1=CC=C(C=C1)OCC2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""42BA0749D487A451_D2B2F5629256D907_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC1=NC(=CS1)CN2CCCC2""",21,"""1B86BFDD7E20E421"""
-"""A86F5B71B6B45AAF_08C2E8711C4CF154_6039_UN""","""O(CC(F)(F)Br)CC1=C(OC(C)C)C=CC2=C1C=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""AF0EBA9127AB2DB4_BDEDC6049BDB0D78_6039_UN""","""O(CC(F)(F)Br)CC(OC1=C(C(=C(F)C(=C1F)F)F)F)=O""",21,"""1B86BFDD7E20E421"""
-"""EC5D5FD37DF4B0A7_ED43CF14B01D7E38_6039_UN""","""O(CC(F)(F)Br)CC(=O)NNC(=O)C1=CC(=CC=C1)C#N""",21,"""1B86BFDD7E20E421"""
-"""9D36C8280DC0C8FF_9E341789F10507D3_6039_UN""","""O(CC(F)(F)Br)CC(=O)NNC(=O)C1=CC=C(C=C1)C#N""",21,"""1B86BFDD7E20E421"""
-"""C54509695FDFC586_A0178A01341362E1_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC(=O)NC1=CC(=CC=C1)C#C""",21,"""1B86BFDD7E20E421"""
-"""BAA753F237B55172_5BA3D0879CA07816_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC1=CC2=C(C=C1)OCC(=O)N2""",21,"""1B86BFDD7E20E421"""
-"""0184E0CC002E7BBA_33DC446217DAA1D9_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C)C=CC(=C1)[S](=O)(=O)N)=O""",21,"""1B86BFDD7E20E421"""
-"""F4EA05A5DA7ADC84_9C6F09B5E3085703_6039_UN""","""O(CC(F)(F)Br)CC1=NC(=NO1)C2=CC(=C(C(=C2)F)F)F""",21,"""1B86BFDD7E20E421"""
-"""B388C5E696BD875B_C438712EAE5B1D40_6039_UN""","""O(CC(F)(F)Br)CC(=O)CN2C(=O)C1=C(C=CC=C1)C2=O""",21,"""1B86BFDD7E20E421"""
-"""5BC61BA936A9C932_06FD2004E07E08E6_6039_UN""","""O(CC(F)(F)Br)CC1=CC(=C(C=C1)OC2=CC=CC=C2)F""",21,"""1B86BFDD7E20E421"""
-"""973A5C376B41B57C_369B031F84FCBAB2_6039_UN""","""O(CC(F)(F)Br)CC(NNC(CC1=C(C)C=CC=C1)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""8AF931A0069E5A54_B938C7AAA3738FC6_6039_UN""","""O(CC(F)(F)Br)CCC(NC1=CC=CC(=C1)C(F)(F)F)=O""",21,"""1B86BFDD7E20E421"""
-"""F1CCC24A516E27BD_E74936B3E79EBB91_6039_UN""","""O(CC(F)(F)Br)CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""4F85FCE511F4D9C6_29D4A661D980B0D9_6039_UN""","""O(CC(F)(F)Br)CC(C2=CC1=C(NC(C1(C)C)=O)C=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""6F124219BEB3BFD2_834E351B5C7CAD67_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C(N)=O)C2=C(S1)CCC2)=O""",21,"""1B86BFDD7E20E421"""
-"""DAE000C197435155_3DFE40C884C4D689_6039_UN""","""O(CC(F)(F)Br)CC(NC(NC1=C(C=C(C)C=C1)C)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""270B4269B4F095E1_A1E795CF3E518383_6039_UN""","""O(CC(F)(F)Br)CC(=O)C1=CC=C(C=C1)C2CCCCC2""",21,"""1B86BFDD7E20E421"""
-"""1D29BF9CCE3DA2A1_B83DAF8A3D9A51DE_6039_UN""","""O(CC(F)(F)Br)CC(N1CCC(C)SC2=C1C=CC=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""D2310B9F5AA38BA0_1F44FAD82F8F6223_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC(=C(SC)C=C1)NC(=O)C)=O""",21,"""1B86BFDD7E20E421"""
-"""827AB5A88A1749B7_B9142860C0F1A0CD_6039_UN""","""O(CC(F)(F)Br)CC(N(CC1=C(F)C=CC=C1)C2CC2)=O""",21,"""1B86BFDD7E20E421"""
-"""8BF9E80C272675C2_756D684C46A8D830_6039_UN""","""O(CC(F)(F)Br)CC(N(C(CC)C)C1CC[S](=O)(=O)C1)=O""",21,"""1B86BFDD7E20E421"""
-"""0060F4B6D2BC4821_FBE5608553B9BBEA_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC=C(N(C)[S](=O)(=O)C)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""E843B6CA3C1ECC98_FB0C5732F1CF4E54_6039_UN""","""O(CC(F)(F)Br)CC(C)=C(C#N)C2=NC1=C(C=CC=C1)S2""",21,"""1B86BFDD7E20E421"""
-"""3C975F0525F1ED52_60B1BFEEC186BCE4_6039_UN""","""O(CC(F)(F)Br)CC(C1=C[N](C)C(=C1)C(=O)C(Cl)(Cl)Cl)=O""",21,"""1B86BFDD7E20E421"""
-"""C27667EA53FC111B_A094B0EAEDCA86FE_6039_UN""","""O(CC(F)(F)Br)CC(NC1=CC(=C(C(OCC)=O)S1)C)=O""",21,"""1B86BFDD7E20E421"""
-"""B5646E7C9C5450D6_93EC73619611224C_6039_UN""","""O(CC(F)(F)Br)CC3=NC1=C(C2=C(S1)CCCC2)C(=O)N3""",21,"""1B86BFDD7E20E421"""
-"""6D14DE25225DAB18_A3FC7FCFE018217B_6039_UN""","""O(CC(F)(F)Br)CC1=C(C(OCC)=O)C2=C(O1)C=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""D30B9298EB6EBAAA_B02DE209BB0BD9FC_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C(OCC)=O)C=N[N]1C)=O""",21,"""1B86BFDD7E20E421"""
-"""3FAE2CB090AD94D1_8D4E5185962D7FC3_6039_UN""","""O(CC(F)(F)Br)CC(=O)N1CCN(CC1)CC2=CSC=C2""",21,"""1B86BFDD7E20E421"""
-"""0806235BC3C44A60_03595D18F8BFD4CB_6039_UN""","""O(CC(F)(F)Br)CC(=O)N1CCN(CC1)CC2=CC=CO2""",21,"""1B86BFDD7E20E421"""
-"""E53B476AA749131B_9AFF7DE679BAF15B_6039_UN""","""O(CC(F)(F)Br)CC(C2=CC1=C(N(C)C(=O)CC1)C=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""7623E956BE025D77_FA9D13F0CDB104A4_6039_UN""","""O(CC(F)(F)Br)CC(NC2=NN=C(C1=C(C)C=CS1)O2)=O""",21,"""1B86BFDD7E20E421"""
-"""D1899FAE2888C82B_69F34E3AA0B2ACA7_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C)C=C(C=C1C)SC#N)=O""",21,"""1B86BFDD7E20E421"""
-"""6EAE9A5D4C1908B9_F782217BF840C966_6039_UN""","""O(CC(F)(F)Br)CC(N1CCC2=C1C=C([N](=O)=O)C=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""723A97E6C5254E23_00F18A7D8B78EC09_6039_UN""","""O(CC(F)(F)Br)CC1=NC(=NO1)C2=CC=C(C(C)C)C=C2""",21,"""1B86BFDD7E20E421"""
-"""B65FD01F63E42F26_74BECE92EA2B671A_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=CC=C(CN(C)C)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""B05AABEAF591957C_F1A3E0E0755601E9_6039_UN""","""O(CC(F)(F)Br)CCCC(NC1=C(C=C(C)C=C1C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""21F7EEBC2E4D82E5_519EEDBF9040565B_6039_UN""","""O(CC(F)(F)Br)CC(NCCOC1=C(C)C=CC=C1C)=O""",21,"""1B86BFDD7E20E421"""
-"""5B3180B0EEA5AF96_28885AA6CDFEED04_6039_UN""","""O(CC(F)(F)Br)CC(NCCCOC1=CC=CC(=C1)C)=O""",21,"""1B86BFDD7E20E421"""
-"""89CE548845D5A219_868F403FD76DC84D_6039_UN""","""O(CC(F)(F)Br)CC(N2C1=C(C=C(OC)C=C1)CCC2)=O""",21,"""1B86BFDD7E20E421"""
-"""6903E6DA49ADDB2E_7CBD393FE46B1964_6039_UN""","""O(CC(F)(F)Br)CC(N2C1=C(C=C([N](=O)=O)C=C1)CC2)=O""",21,"""1B86BFDD7E20E421"""
-"""5AF8D93C36261677_07CEBA0A672131CE_6039_UN""","""O(CC(F)(F)Br)CC(NC(C(C)C)C1=CC=C(C=C1)F)=O""",21,"""1B86BFDD7E20E421"""
-"""3B7ED2E25123EE8B_F447B7EB37024C42_6039_UN""","""O(CC(F)(F)Br)CC(=O)N1CCN(CC1)C2=NC=CC=N2""",21,"""1B86BFDD7E20E421"""
-"""21D15E46D07713E1_34551D10824BA364_6039_UN""","""O(CC(F)(F)Br)CC(NC(C1=CC=CC(=C1)[N](=O)=O)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""FCF334ABD66DE2C8_6CB5CB8A13136927_6039_UN""","""O(CC(F)(F)Br)CC1=COC(=N1)C2=CC=C(OCC)C=C2""",21,"""1B86BFDD7E20E421"""
-"""13BDCFBEB9164C1B_ABEE4C28F53F78EC_6039_UN""","""O(CC(F)(F)Br)CC(NNC(C1=CC(=C(CC)S1)C)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""4093BC868DDBC260_E0128CBFB27C8003_6039_UN""","""O(CC(F)(F)Br)CC(NCC1OCCN(CC(C)C)C1)=O""",21,"""1B86BFDD7E20E421"""
-"""470BCCE1A0744EDA_FE9BE89E287F3E0A_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=CC=C([S](N)(=O)=O)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""2E885EF039091F33_169D33775ED74560_6039_UN""","""O(CC(F)(F)Br)CC(NCCCN(C)C1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""3DC49C9C9BE4C081_CF5B91ED76648342_6039_UN""","""O(CC(F)(F)Br)CC(NC2=NC1=C(OC)C=CC=C1S2)=O""",21,"""1B86BFDD7E20E421"""
-"""4D2BD58EFCCB2211_4D0ACEB8D64EDFBE_6039_UN""","""O(CC(F)(F)Br)CC(N(CC1=CC=C(N(C)C)C=C1)C)=O""",21,"""1B86BFDD7E20E421"""
-"""9AF3327A87FC825D_1BA85B459EF13E8B_6039_UN""","""O(CC(F)(F)Br)CC(C2=C[N](C1=CC=CC(=C1)C)N=N2)=O""",21,"""1B86BFDD7E20E421"""
-"""49DA84F757F0BB6E_D7365836D1311C58_6039_UN""","""O(CC(F)(F)Br)CC1=NC(=NO1)C2=CC(=C(C=C2)C)OC""",21,"""1B86BFDD7E20E421"""
-"""D1D8BB20D792FBF9_7BAD8E864039B17B_6039_UN""","""O(CC(F)(F)Br)CC2C[N]1C(=NN=C1S2)C3=CN=CC=C3""",21,"""1B86BFDD7E20E421"""
-"""B25AE4ED0464B220_354D599E51F9EA12_6039_UN""","""O(CC(F)(F)Br)CC1=CC(=CC(=C1)C(=O)OC)C(OC)=O""",21,"""1B86BFDD7E20E421"""
-"""1094EED86CFF3F8F_2B81C6723EF84B5F_6039_UN""","""O(CC(F)(F)Br)CC(C2=CC1=C(CCN(C(C)=O)C1)S2)=O""",21,"""1B86BFDD7E20E421"""
-"""F0D41B6F54827522_E0D2B6E99F364FCB_6039_UN""","""O(CC(F)(F)Br)CC1=CN=C(C=C1)OCC2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""342361B52CA161A9_5B2C1C52463D0AC3_6039_UN""","""O(CC(F)(F)Br)CC(NC1=CC=C(OC(F)(F)F)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""9B93F354F7D5B607_12C4BDD071B2B8A1_6039_UN""","""O(CC(F)(F)Br)CCCCOC1=CC=CC(=C1)C(OC)=O""",21,"""1B86BFDD7E20E421"""
-"""65B5ADE3ECAA05A0_75AB14831EEE698D_6039_UN""","""O(CC(F)(F)Br)CCCCN2C(=O)C1=C(C=CC=C1)C2=O""",21,"""1B86BFDD7E20E421"""
-"""3B513D8EB0DB9C22_3C1DF62AFFC9A60A_6039_UN""","""O(CC(F)(F)Br)CCCCOC1=CC=C(C(OC)=O)C=C1""",21,"""1B86BFDD7E20E421"""
-"""80C3F2E52E82CB23_CC72C8811D12C3BD_6039_UN""","""O(CC(F)(F)Br)CC(NC1=NC(=CS1)CC(OCC)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""4AD977E862E9E170_03874CCA09C45E6F_6039_UN""","""O(CC(F)(F)Br)CC1=C(C=CC=C1)SCC2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""1329433D111F7F5A_7284076F42CB9155_6039_UN""","""O(CC(F)(F)Br)CC(NC1=CC=C(C(OCC)=O)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""A93FA1F30CE91626_1CBC9A8F40270517_6039_UN""","""O(CC(F)(F)Br)CC1=C[N](C)N=C1C2=CC=C(C=C2)C#N""",21,"""1B86BFDD7E20E421"""
-"""228C8D969646C4DC_3578FBD06C983958_6039_UN""","""O(CC(F)(F)Br)CC2C[N]1C(=NN=C1S2)C3=CC=CC=C3""",21,"""1B86BFDD7E20E421"""
-"""1463C3405C3FA4FE_E96B223384A6EAD1_6039_UN""","""O(CC(F)(F)Br)CC2C[N]1C(=NN=C1S2)C3=CC=NC=C3""",21,"""1B86BFDD7E20E421"""
-"""D178A37A7999FB32_4950D5FD113A6F8D_6039_UN""","""O(CC(F)(F)Br)CC1=CC=C(OCCOCCOC)C=C1""",21,"""1B86BFDD7E20E421"""
-"""A0E8FD8AB5D71DC2_CBEAC1FC122ECD8C_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC2=C(C=C1)NC(N(C)C2)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""16A83AC09B2841A6_970FFB6802BCD5EF_6039_UN""","""O(CC(F)(F)Br)CC2CN(CC1=CC=CC=C1)CCCO2""",21,"""1B86BFDD7E20E421"""
-"""641EEB7A42CC252A_A5739AF5643B8191_6039_UN""","""O(CC(F)(F)Br)CCCN1CCN(CC1)C2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""0F274DFD7DBDF59F_A202D8291626E3A6_6039_UN""","""O(CC(F)(F)Br)CCCCOC1=C(OC)C=CC=C1OC""",21,"""1B86BFDD7E20E421"""
-"""B1CB88BEB5031CFF_FFB8379D788000DB_6039_UN""","""O(CC(F)(F)Br)CC(NCC(C(C)C)C1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""5DD83A8237ECE013_AFFAA376B387B2FF_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC1=C(C2=C(S1)CCCC2)C#N""",21,"""1B86BFDD7E20E421"""
-"""06DE275162BFA4CF_9E7965AA4BD9060D_6039_UN""","""O(CC(F)(F)Br)CCCC(NC1=CC=CC(=C1)[N](=O)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""63BF5386504EAD86_388E16D10CACB898_6039_UN""","""O(CC(F)(F)Br)CCC(=O)NC2=C1C=CC=CC1=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""5CC7AB6BF4963A42_32C9262FE5CA4A3E_6039_UN""","""O(CC(F)(F)Br)CC(NCCC1=CC=C(C(C)C)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""772CB010086DA7D3_A01ADC659BF2B3C0_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC1=CC=N[N]1CC2=CC=CS2""",21,"""1B86BFDD7E20E421"""
-"""9BB5B43087705ED4_1E369E1457B041B8_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC1=NN=C(O1)C2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""C1DD38727D68AD9D_A99F15FEC9F89086_6039_UN""","""O(CC(F)(F)Br)CC(N(C1=C(F)C=CC=C1)CCC#N)=O""",21,"""1B86BFDD7E20E421"""
-"""F058163ACEE53356_D1B9BE35E4EF99B2_6039_UN""","""O(CC(F)(F)Br)CC2=NC1=C(C=CC=C1)C(=O)N2CC#N""",21,"""1B86BFDD7E20E421"""
-"""466ADC391901205C_75D21AD000DED436_6039_UN""","""O(CC(F)(F)Br)CCCC2=NC(C1=C(SC(=C1C)C)N2)=O""",21,"""1B86BFDD7E20E421"""
-"""8E5C86B044C30469_9A4855853EF3FD98_6039_UN""","""O(CC(F)(F)Br)CC2=CC=C(N1CCC(OC)CC1)C=C2""",21,"""1B86BFDD7E20E421"""
-"""E1D1544C390495D2_5405F43164321C28_6039_UN""","""O(CC(F)(F)Br)CC(NNC(C1=CC(=C(S1)C)CC)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""1AEEEBBA87BF7DAD_1808BF42A448EFF9_6039_UN""","""O(CC(F)(F)Br)CC1=NC(=NO1)C2=CC3=C(C=C2)OCO3""",21,"""1B86BFDD7E20E421"""
-"""EF4AD3E61F04FABE_64F1C3B13F67C4C3_6039_UN""","""O(CC(F)(F)Br)CC(C2=CC1=C(C=C(OC)C=C1)C=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""3E4D06E9C3AA5AA2_BB8B618A8BF590B7_6039_UN""","""O(CC(F)(F)Br)CC(C2=C1OCC(C1=C(OC)C=C2)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""EB963A362AF48019_AE92532B6FA11439_6039_UN""","""O(CC(F)(F)Br)CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""C61A42E599E63B0B_E7169C843D75541F_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC1=C(C=NO1)C2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""7DCDA4FA9572FD8F_3995E5B879E73E91_6039_UN""","""O(CC(F)(F)Br)CCCON2C(=O)C1=C(C=CC=C1)C2=O""",21,"""1B86BFDD7E20E421"""
-"""D254A1EBBA19D91D_5E3C6CC1AA30B408_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC=C([S](N(C)C)(=O)=O)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""0A449D231BEC01FC_3FB352AC8AD4CADB_6039_UN""","""O(CC(F)(F)Br)CC1=CC(=CN=C1)OCC2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""A3E13B912093BD0C_9722F5D08426011C_6039_UN""","""O(CC(F)(F)Br)CC1=COC(=N1)C2=CC=C([N](=O)=O)C=C2""",21,"""1B86BFDD7E20E421"""
-"""233C67F5708FD468_D4F0915DD67BEB92_6039_UN""","""O(CC(F)(F)Br)CC(NC(C(C)=O)CC1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""EDFC16DE48DDDF7B_1A16372E43032DB1_6039_UN""","""O(CC(F)(F)Br)CC3=NC1=C(OC2=C1C=CC=C2)C(=O)N3""",21,"""1B86BFDD7E20E421"""
-"""0DE1112F77629014_320F560FD1E4EEBD_6039_UN""","""O(CC(F)(F)Br)CC(=O)NNC(=O)CC1CC[S](=O)(=O)C1""",21,"""1B86BFDD7E20E421"""
-"""1B9B2FCF9F2745A5_8CC056D54C22BB6F_6039_UN""","""O(CC(F)(F)Br)CC1=CSC(=N1)C2=CC=C(C(O)=O)C=C2""",21,"""1B86BFDD7E20E421"""
-"""70A07178A7C444FD_7E2FF1E4422D300C_6039_UN""","""O(CC(F)(F)Br)CCC(=O)NC1=CC2=C(C=C1)OCCO2""",21,"""1B86BFDD7E20E421"""
-"""7F1CA44247534E53_3D2279416A93DDD1_6039_UN""","""O(CC(F)(F)Br)CC2=NN=C3N(C)C(=O)C1=C(C=CS1)[N]23""",21,"""1B86BFDD7E20E421"""
-"""0948E67890215AA7_8AD9491212991ED3_6039_UN""","""O(CC(F)(F)Br)CCC(NC1=C(C)C=CC(=C1)[N](=O)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""60BA6C0AC4BC10F6_4D7A70F59E34A715_6039_UN""","""O(CC(F)(F)Br)CC2=CC=C(OCC1=NC=C[N]1C)C=C2""",21,"""1B86BFDD7E20E421"""
-"""3E8664E16FE56410_434400613465D8B9_6039_UN""","""O(CC(F)(F)Br)CC(NC(C1=CC=C(C)C=C1)C2CC2)=O""",21,"""1B86BFDD7E20E421"""
-"""21DA4B05AA24A314_9B1EEA2FD111C843_6039_UN""","""O(CC(F)(F)Br)CC(NC1=CC=CC(=C1)C(N(C)C)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""4D99FDAB8108C935_B84F297E496ED5EF_6039_UN""","""O(CC(F)(F)Br)CC(N(C)CCOC1=C(C=CC=C1)F)=O""",21,"""1B86BFDD7E20E421"""
-"""06A8E747C46C3CE6_000A66836240CE99_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC1=C(N=CC=C1)N2CCCC2""",21,"""1B86BFDD7E20E421"""
-"""274FBB7079561877_4076497DED9C5C13_6039_UN""","""O(CC(F)(F)Br)CC(C1(NC(C(F)(F)F)=O)CCCC1)=O""",21,"""1B86BFDD7E20E421"""
-"""FFAB925AEA937195_884927CB8FBC0681_6039_UN""","""O(CC(F)(F)Br)CC(=O)NCCC1=C[NH]C2=C1C=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""74D0A35F45427F21_9A89D64BC23B0BA2_6039_UN""","""O(CC(F)(F)Br)CCC(N(CCCCC)CCCCC)=O""",21,"""1B86BFDD7E20E421"""
-"""FF9BAC84A2194272_B68180CE101AD5C7_6039_UN""","""O(CC(F)(F)Br)CC(=O)C1=CC=C(C=C1)N2CCOC2=O""",21,"""1B86BFDD7E20E421"""
-"""E28950E71DFE32E7_57F5F29EC6C5680A_6039_UN""","""O(CC(F)(F)Br)CC(C2=C[N](C1=CC=C(F)C=C1)N=N2)=O""",21,"""1B86BFDD7E20E421"""
-"""79CCC702AA23594D_8F20783C74359942_6039_DP""","""O(CC(F)(F)Br)CC(N[C@H](C(O)=O)CC1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""61A4D5F5C7F10081_5CF471CF54AC884D_6039_DP""","""O(CC(F)(F)Br)CC(N[C@@H](C(O)=O)CC1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""A13BA0DEFFC17376_792E870B51F4986B_6039_UN""","""O(CC(F)(F)Br)CC1=CC(=CC=C1)OCC2=NC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""977DA9E866E543B9_1162B78B1844F552_6039_UN""","""O(CC(F)(F)Br)CC1=C(C=CC=C1)OCC2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""CD270B16BABB76C7_D063278CF6BB93A0_6039_UN""","""O(CC(F)(F)Br)CC(C1CCN(C(C(F)(F)F)=O)CC1)=O""",21,"""1B86BFDD7E20E421"""
-"""59A4C0422149A218_CC7128AFB6FC30C6_6039_UN""","""O(CC(F)(F)Br)CC#CCN2C(=O)C1=C(C=CC=C1)C2=O""",21,"""1B86BFDD7E20E421"""
-"""A5662E606860DB79_253259D7CB75DCD6_6039_UN""","""O(CC(F)(F)Br)CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F""",21,"""1B86BFDD7E20E421"""
-"""DA587F94AEF777A9_E756EFACDEBAB519_6039_UN""","""O(CC(F)(F)Br)CC1=C(C=C(C(OC)=O)C=C1)C(F)(F)F""",21,"""1B86BFDD7E20E421"""
-"""DFA211C9A0121574_5D2AADE707FCEEE8_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC1=CC=C(C=C1)N2CCCC2""",21,"""1B86BFDD7E20E421"""
-"""3B8B8C6850A8EDC9_4BB0C675C41F7D52_6039_UN""","""O(CC(F)(F)Br)CC1=CSC(=N1)COC2=CC=C(C)C=C2""",21,"""1B86BFDD7E20E421"""
-"""205956839917191D_CEC0D22574BB8B44_6039_UN""","""O(CC(F)(F)Br)CC(N(C(C)(C)C)CC1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""D491A4342AB1ACF8_D01B0CC782EC9501_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=CC(=C(OC)C=C1)OC)=O""",21,"""1B86BFDD7E20E421"""
-"""5B6C836118014342_BF5CB29A744075C5_6039_UN""","""O(CC(F)(F)Br)CCCCCCCCCCCCCCC""",21,"""1B86BFDD7E20E421"""
-"""AB06F9D7D2AB855E_6636B9C179F9F9E4_6039_UN""","""O(CC(F)(F)Br)CC(=O)N1CCC(=CC1)C2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""8D79C4ACFABF8D34_72E6A19EDFEBA1BC_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C=CC(=C1)[S](C)(=O)=O)F)=O""",21,"""1B86BFDD7E20E421"""
-"""529990E418955CF7_9C027CE301ED36EF_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C=C([N](=O)=O)C=C1)C#N)=O""",21,"""1B86BFDD7E20E421"""
-"""BED0C8419EA7A210_432D7F375C564802_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(OC)C=C(C=C1)[N](=O)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""1112C8AC611E1B6D_9A4F02E44C9C971D_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C(OCC)=O)C=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""8FAEF256034C8001_D32A27B4F9E55412_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC(=C(C(=C1)OC)OC)OC)=O""",21,"""1B86BFDD7E20E421"""
-"""83A76503FC2D6018_FDC5557033869DE9_6039_UN""","""O(CC(F)(F)Br)CC(N(CC(N(C)C)=O)CC(F)(F)F)=O""",21,"""1B86BFDD7E20E421"""
-"""139E14D209DEFD58_81EC4E514B7986C1_6039_UN""","""O(CC(F)(F)Br)CCOC1=CC=C(C=CC(OC)=O)C=C1""",21,"""1B86BFDD7E20E421"""
-"""96B3CC10AD02F5A5_F8E951D48477C6EF_6039_UN""","""O(CC(F)(F)Br)CC2=C1N=CC=CC1=C(C(OC)=O)C=C2""",21,"""1B86BFDD7E20E421"""
-"""D3A9397B1176E41D_B9700BF234D3C063_6039_UN""","""O(CC(F)(F)Br)CC1=C(C(OCC)=O)C(=CO1)C(F)(F)F""",21,"""1B86BFDD7E20E421"""
-"""B2F739973AC6077C_117B83080408DCB4_6039_UN""","""O(CC(F)(F)Br)CC(C(C(OCC)=O)CCC(=O)OC)=O""",21,"""1B86BFDD7E20E421"""
-"""CFB019263ECB73B2_1633CDB24521568B_6039_UN""","""O(CC(F)(F)Br)CC(NC(NC1=C(C=CC(=C1)C)C)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""A613B3C9DD41F350_67447FB55E28A544_6039_UN""","""O(CC(F)(F)Br)CCCOC1=CC(=C(C=C1C)CC=C)C""",21,"""1B86BFDD7E20E421"""
-"""C95C778D84897243_A445E15A593337EA_6039_UN""","""O(CC(F)(F)Br)CC1=CSC(=N1)C3=CC2=C(C=CC=C2)O3""",21,"""1B86BFDD7E20E421"""
-"""3017BCAE5BAAB140_B80E76B7540353B9_6039_UN""","""O(CC(F)(F)Br)CC(NNC(CC1=C(F)C=CC=C1)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""FB6611FA7D860385_67BD1582A51BEA02_6039_UN""","""O(CC(F)(F)Br)CC1=N[N](C2=C1CCC2)C3=CC=CC=C3""",21,"""1B86BFDD7E20E421"""
-"""60E15441E6DDF790_F9867A20F6E47E4A_6039_UN""","""O(CC(F)(F)Br)CC(N(CCOC)CC1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""5425210CA2A1644E_CA835AD670203AD2_6039_UN""","""O(CC(F)(F)Br)CC(NCCCN(C(C)C)[S](=O)(=O)C)=O""",21,"""1B86BFDD7E20E421"""
-"""ED1B301DD7C54306_4D6272985D59569B_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C(OCC)=O)C=C(S1)C)=O""",21,"""1B86BFDD7E20E421"""
-"""D24F3B1E41D8C958_6716C4793F0DF60E_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC(=C(C=C1)NC(=O)C)SC)=O""",21,"""1B86BFDD7E20E421"""
-"""4F4903CEABC65AE8_0658E8D3722868D1_6039_UN""","""O(CC(F)(F)Br)CCC(NC1=CC=CC(=C1)[S](N)(=O)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""529F86198B94A01F_01962ABFA3348C61_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=CC=C(OC(F)F)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""0F850E3655DE10E1_E830E12639BA4ACF_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C=CC(=C1)C(OC)=O)C)=O""",21,"""1B86BFDD7E20E421"""
-"""86EEC570245067C1_9C0A40AA071AF7E3_6039_UN""","""O(CC(F)(F)Br)CC(N(CCC(N)=O)C1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""94B9328910B2B2AC_8552655FE388E10C_6039_UN""","""O(CC(F)(F)Br)CCC(=O)NC1=CC2=C(C=C1)NC(=O)N2""",21,"""1B86BFDD7E20E421"""
-"""75472C2FB4192116_4B50ACE846F908B1_6039_UN""","""O(CC(F)(F)Br)CC(C1=C(C)[N](C(=C1)C)C2=NC=CS2)=O""",21,"""1B86BFDD7E20E421"""
-"""4459AC2FC5E787A3_63898BDEC47EDA9D_6039_UN""","""O(CC(F)(F)Br)CC(=O)NC(=O)CCSC1=CC=CC=C1""",21,"""1B86BFDD7E20E421"""
-"""12765A51B80D0C1D_33BD1CD7A4D5A232_6039_UN""","""O(CC(F)(F)Br)CC(C1=C([NH]C(=C1C)C(OCC)=O)C)=O""",21,"""1B86BFDD7E20E421"""
-"""7BF41E7AACED4CEF_5A16A0B02F5D469F_6039_UN""","""O(CC(F)(F)Br)CCCCN(C(C)C)CC1=CC=CC=C1""",21,"""1B86BFDD7E20E421"""
-"""5BDAA13ABA20D18A_E65D4C5F312F30D4_6039_UN""","""O(CC(F)(F)Br)CC(N(CCCC)C1CC[S](=O)(=O)C1)=O""",21,"""1B86BFDD7E20E421"""
-"""7BEF64158C4A4706_7327ADEB51719584_6039_UN""","""O(CC(F)(F)Br)CCCCOC1=CC=CC(=C1)C(F)(F)F""",21,"""1B86BFDD7E20E421"""
-"""018B0A6548009E10_E5A137DF73082FA7_6039_UN""","""O(CC(F)(F)Br)CC1=CC=C(C=C1)C2=C(C=CC=C2)C#N""",21,"""1B86BFDD7E20E421"""
-"""DA9A0DA583EA79E9_ADD466496E01B0E1_6039_UN""","""O(CC(F)(F)Br)CCOC2=CC1=C(C(=CC(=O)O1)C)C=C2""",21,"""1B86BFDD7E20E421"""
-"""54BCF8C78132D4E4_ED3BB44F94DFA939_6039_UN""","""O(CC(F)(F)Br)CC(N(C1=C(C(OC)=O)C=CC=C1)C)=O""",21,"""1B86BFDD7E20E421"""
-"""8248362939EA83BC_BE7C078D4D8350B2_6039_UN""","""O(CC(F)(F)Br)CC(=O)NCC1CCCC2=C1C=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""4593180F68A60E50_4155A3FAE1CD1EF9_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC=C(CCNC(C)=O)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""A392C05F9F795EDF_B11A456CCB06A134_6039_UN""","""O(CC(F)(F)Br)CC1=CSC(=N1)C2=CC3=C(C=C2)OCO3""",21,"""1B86BFDD7E20E421"""
-"""7402D533AF90C6E8_ED154B813F0ED214_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC=C(CN(C)C(=O)C)C=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""E0D51C152C747E7F_659099A91FE6013E_6039_UN""","""O(CC(F)(F)Br)CC(NC1CCN(C(OCC)=O)CC1)=O""",21,"""1B86BFDD7E20E421"""
-"""E6CBBAC042B9E093_5693893F7BA91E7A_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC(=NO1)C2=CC=C(F)C=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""C583D78DFA27F5A0_04ACE1EE4081EACD_6039_UN""","""O(CC(F)(F)Br)CC2=NN=C(C1CC1)[N]2C3=CC=CC=C3""",21,"""1B86BFDD7E20E421"""
-"""8BBD9BB4770363B9_E3AB18AAC674B146_6039_UN""","""O(CC(F)(F)Br)CC(C1=C([N](CC(OC)=O)C(=C1)C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""71A6F90FFB84AEAD_79869EC854BC590C_6039_UN""","""O(CC(F)(F)Br)CCOC2=C1C=CC=CC1=C(OC)C=C2""",21,"""1B86BFDD7E20E421"""
-"""0E4CD1128474D95C_E300E7223F6036D1_6039_UN""","""O(CC(F)(F)Br)CC1=CC(=CC=C1)SCC2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""151CAC7B3D8273D1_73759E4480A99B72_6039_UN""","""O(CC(F)(F)Br)CC1=CC(=CC=C1)C(=O)N2CCCCC2""",21,"""1B86BFDD7E20E421"""
-"""5E1B303BA7D4339D_086D59EB9810D385_6039_UN""","""O(CC(F)(F)Br)CC(=O)NCCN1C2=C(CC1)C=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""1E78237378BE2047_11BBC6CED27213AF_6039_UN""","""O(CC(F)(F)Br)CC1CC(C(OCC)=O)(O1)C(=O)OCC""",21,"""1B86BFDD7E20E421"""
-"""2ED804842B51D129_753A04B578A59FA7_6039_UN""","""O(CC(F)(F)Br)CC1=C(C)OC(=N1)C2=CC=C(CC)C=C2""",21,"""1B86BFDD7E20E421"""
-"""7FCA4EB7792E1AE9_F27B1C6465E42B0A_6039_UN""","""O(CC(F)(F)Br)CCC[S](=O)(=O)C2=NC1=C(C=CC=C1)S2""",21,"""1B86BFDD7E20E421"""
-"""7D1EBF3077DF8EE5_B2EF427187518026_6039_UN""","""O(CC(F)(F)Br)CC1=CC(=CC2=C1C=CC=C2)C(OC)=O""",21,"""1B86BFDD7E20E421"""
-"""0A7402CAFA8FD7CA_A992A6CE394B3197_6039_UN""","""O(CC(F)(F)Br)CC2=NC1=C(C=CC(=C1)C(OC)=O)[N]2C""",21,"""1B86BFDD7E20E421"""
-"""1BF4519151FF0256_7E29FC63FFC53D18_6039_UN""","""O(CC(F)(F)Br)CC(NCC(C1=C(OC)C=CC=C1)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""F5733D1F996D38E1_25C86AD19787D590_6039_UN""","""O(CC(F)(F)Br)CC(C(C1=CC=C([N](=O)=O)C=C1)=O)(F)F""",21,"""1B86BFDD7E20E421"""
-"""2C030B347CFBE870_E7E13B5016510974_6039_UN""","""O(CC(F)(F)Br)CC(C1=CC=CC(=C1)[S](N(C)C)(=O)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""5D323118135A2531_997DE01D70033C6B_6039_UN""","""O(CC(F)(F)Br)CC2=CC1=CC(=C(OC)C=C1C=C2)OC""",21,"""1B86BFDD7E20E421"""
-"""B2BABF126AAD8AC8_7D7CE95703D1043C_6039_UN""","""O(CC(F)(F)Br)CC3CCC1(CCC2(CC1)OCCO2)O3""",21,"""1B86BFDD7E20E421"""
-"""ECD5F8439DBFEE92_4C8FC40190BFD75F_6039_UN""","""O(CC(F)(F)Br)CC(C(C1=CC=CC(=C1)[N](=O)=O)=O)(F)F""",21,"""1B86BFDD7E20E421"""
-"""25D4F85618DEA858_3B5C0AD1C8064C20_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(SCC(N)=O)C=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""635ADE147C3B1158_3EC75B837C57CBF9_6039_UN""","""O(CC(F)(F)Br)CCCCC[N]1C2=C(N=C1C)C=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""9A856BCF84D8FEC0_B539C49CFAE03CB2_6039_UN""","""O(CC(F)(F)Br)CC1=NC(=NO1)C2=CC=CC(=C2)[N](=O)=O""",21,"""1B86BFDD7E20E421"""
-"""071DF18644BC8706_6A90528BCEF6F893_6039_UN""","""O(CC(F)(F)Br)CC(NCC1=C(C(F)(F)F)C=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""2DB4506E268FAC7C_6FA42146BF3E6E1D_6039_UN""","""O(CC(F)(F)Br)CC(N(CCC)CC1=CC=C(C=C1)C)=O""",21,"""1B86BFDD7E20E421"""
-"""8BFC2BDE80A9B573_937FBFE8C0558E55_6039_UN""","""O(CC(F)(F)Br)CC(=O)NCC2COC1=C(C=CC=C1)O2""",21,"""1B86BFDD7E20E421"""
-"""62049069AB6EC81F_5D53C5354EEE055A_6039_UN""","""O(CC(F)(F)Br)CC(NC1=C(C=C(OC)C=C1)[N](=O)=O)=O""",21,"""1B86BFDD7E20E421"""
-"""F8439A5E1DEFBCBA_A3C925A822F68902_6039_UN""","""O(CC(F)(F)Br)CC(NC2=NC1=C(C=C(OC)C=C1)S2)=O""",21,"""1B86BFDD7E20E421"""
-"""53A3F33B6773B957_DFA83E99AFD300F8_6039_UN""","""O(CC(F)(F)Br)CC2=NN=C(C1=C([N](=O)=O)C=CC=C1)O2""",21,"""1B86BFDD7E20E421"""
-"""DA88EB7FE3E5DB94_FC44DFAFFF507071_6039_UN""","""O(CC(F)(F)Br)CC1=CSC(=N1)C2=CC=C(C(C)C)C=C2""",21,"""1B86BFDD7E20E421"""
-"""278711E2457AED9D_39A0F8B1AC14C249_6039_UN""","""O(CC(F)(F)Br)CC1=NN=C(S1)C(=O)NC2=CC=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""FDB02A71B62B897C_8A5819C11A14CFBD_6039_UN""","""O(CC(F)(F)Br)CC(C1=C([N](C(COC)C)C(=C1)C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""1BB9C1ACFA153038_BC33A05305708055_6039_UN""","""O(CC(F)(F)Br)CC(NC(CC(C)C)C1=CC=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""6E387D7B4B6304E7_4DC0AFFC45738396_6039_UN""","""O(CC(F)(F)Br)CC1=NC(=NO1)C2=CC=C(OCC)C=C2""",21,"""1B86BFDD7E20E421"""
-"""FF8EC18508A6A3AE_DAB395C3551D368A_6039_UN""","""O(CC(F)(F)Br)CC2=NC1=C(C(=C(S1)C(=O)O)C)C(N2)=O""",21,"""1B86BFDD7E20E421"""
-"""BE9FD08BBA7AC859_680AAC9C60EF874B_6039_UN""","""O(CC(F)(F)Br)CCC(NC1=C(C(F)(F)F)C=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""1402732F4E0BAB5C_0B40ABC5C511C82B_6039_UN""","""O(CC(F)(F)Br)CC(NC(C)C1=CC2=C(C=C1)OCO2)=O""",21,"""1B86BFDD7E20E421"""
-"""A6594E31789DD0A5_0011067500446275_6039_UN""","""O(CC(F)(F)Br)CCCC(NC1=C(C(C)=O)C=CC=C1)=O""",21,"""1B86BFDD7E20E421"""
-"""C868D44034D49E2F_760663560A72CC54_6039_UN""","""O(CC(F)(F)Br)CC(N(C(C1=C(OC)C=CC=C1)C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""CF70A35055A58134_9EA84C301C8013BB_6039_UN""","""O(CC(F)(F)Br)CC(N(CC(F)(F)F)CC1=CC=CO1)=O""",21,"""1B86BFDD7E20E421"""
-"""F271ACF7B5AE85E0_82DF9389779CACD8_6039_UN""","""O(CC(F)(F)Br)CC(NCCC1=C(C=C(C)C=C1C)C)=O""",21,"""1B86BFDD7E20E421"""
-"""A0FA4937B963CBF4_E84A34A1830D9E35_6039_UN""","""O(CC(F)(F)Br)CC(C1=C(C)[N](N=C1)C2=CC=CC=C2)=O""",21,"""1B86BFDD7E20E421"""
-"""DD84E6E08A20A938_0CB965E370360323_6039_UN""","""O(CC(F)(F)Br)CC1=CC=C(C=C1)OCC2=CN=CC=C2""",21,"""1B86BFDD7E20E421"""
-"""2A8626DF1F28892F_79F15644ACA4DB4E_6039_UN""","""CC2(OCC(=O)NCCCN1CCCC1=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""F1E7383BB01BF43B_B69D0335507EB8FF_6039_UN""","""CC2(OCC(=O)NCCOC1=CC=CC=C1)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""0B181209CEF3E199_B76BED69252170EA_6039_UN""","""CC2(OCCCC(OC1=CC=C(F)C=C1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""F217B1E46CF69AD3_1FEB5CCFB80CD66F_6039_UN""","""CC3(OCC1=NOC(=N1)C2=CC=C(C)C=C2)CCOCC3""",21,"""84B4DA20177CEA26"""
-"""6565CBEBFF916D78_2021EE3F0813E084_6039_UN""","""CC2(OCCC(NC1=C(SC)C=CC=C1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""A78F423248309DE5_4A26122343ED1DAC_6039_UN""","""CC2(OCC1=C(C(OCC)=O)CNC(N1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""3E917185B00F10B6_D1197ACF1B171950_6039_UN""","""CC3(OCC(=O)NC2=C1N=[S]=NC1=CC=C2)CCOCC3""",21,"""84B4DA20177CEA26"""
-"""393F35B4AF3236AC_3FAF4ED7667B86E9_6039_UN""","""CC2(OCCOC1=CC=C(OCCC)C=C1)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""3DE3D7E02BF24E97_AF06C188CF9763E9_6039_UN""","""CC3(OCC(=O)NC2=NC1=C(C=CC=C1)S2)CCOCC3""",21,"""84B4DA20177CEA26"""
-"""D8B49FBC5B1101E4_40DFD6492F6520C6_6039_UN""","""CC2(OCC(N(CC)CC1=CC=CC=C1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""1ABF7DBFA8C01418_CB79A21C6A39F504_6039_UN""","""CC3(OCC(=O)C2=C1C=CC=CC1=CC=C2)CCOCC3""",21,"""84B4DA20177CEA26"""
-"""58F44C8C41BCDCC9_7CD1CE4BF25FEA62_6039_UN""","""CC2(OCC(=O)NCCCC1=CC=CC=C1)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""65F68CB33069C5FB_456EBCEA25E31F55_6039_UN""","""CC2(OCC(C1=CC=CC(=C1)C(F)(F)F)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""A287BD167439A455_E29ECB0360F9C682_6039_UN""","""CC3(OCC2=NN=C(C1=CC=C(C)C=C1)O2)CCOCC3""",21,"""84B4DA20177CEA26"""
-"""0A6331D41BC20FED_AB1B316F1F663339_6039_UN""","""CC2(OCC(C1=CC=C(C(C)(C)C)C=C1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""417524588AF0DD71_E9BA1D15009D7E27_6039_UN""","""CC2(OCC(NCC1=CC=CC(=C1)OC)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""A9960E79CCAB8D76_F32F9643E87D8B27_6039_UN""","""CC2(OCC1=C(OCC)C=CC(=C1)C(=O)C)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""1B8C18CA3C744624_98891C5C11710C53_6039_UN""","""CC3(OCC2=NC1=C(C(=C(C)S1)C)C(N2)=O)CCOCC3""",21,"""84B4DA20177CEA26"""
-"""91E279FE958CF69A_0CA63013E0DEC93A_6039_UN""","""CC2(OCC(=O)NC(=O)NC1CCCCC1)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""B1BD9B87C3FB4A61_0E81B46F455D0182_6039_UN""","""CC2(OCC(C1=CC(=C(OC)C=C1)OC)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""B8BAFCC3DF8E7585_D2C97EB23E7174A8_6039_UN""","""CC2(OCC(NC1=NN=C(CC(C)C)S1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""9AFFA95189459B16_CCF1C193808EBBE5_6039_UN""","""CC2(OCC(C1=CC=C(CNC(C)=O)O1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""CBBEC9ECA761359C_1CD254B785DE8528_6039_UN""","""CC2(OCC(C1=C(C)[N](C(=C1)C)CC=C)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""90DA504E2C42BDD1_48680BA97D4510EA_6039_UN""","""CC3(OCC(C1=C(C)[NH]C2=C1C=CC=C2)=O)CCOCC3""",21,"""84B4DA20177CEA26"""
-"""6356970433E873C0_83E426358FF59883_6039_UN""","""CC2(OCC(C1=C(C=C(OC)C=C1)OC)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""7C97ECF9D80137CF_7706EBD5E85AE24F_6039_UN""","""CC2(OCC(=O)NNC(=O)C1=CC=CC=C1)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""3591FF9282EB7C63_D70742DE0E79D0DE_6039_UN""","""CC2(OCC(C1=CC=C(CCCC)C=C1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""C172BAFFBF378911_D511E05F5733023A_6039_UN""","""CC1(OCC(N(CC)CC(=O)NC(C)C)=O)CCOCC1""",21,"""84B4DA20177CEA26"""
-"""71F78FDB355E29D9_DBAC82E859593EEC_6039_UN""","""CC2(OCCC(NC1=CC=C(OC)C=C1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""9A2AFB79A928BC83_94EFD2043CF15446_6039_UN""","""CC2(OCCOC1=CC=C(C(C)(C)C)C=C1)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""E247D02767D24ECF_3FA44BCBB9B7F742_6039_UN""","""CC2(OCC(NCCC1=C(C)C=CC=C1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""0D2429EBDE1E9142_F26B99E122CB2FA0_6039_UN""","""CC2(OCC(NC1=CC=CC(=C1)C(O)=O)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""6119A60A0C067835_F05A117034CA7D86_6039_UN""","""CC2(OCC(=O)NC(=O)NCC1=CC=CS1)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""7E869336FB939991_B36DCBD52B34F84F_6039_UN""","""CC2(OCC(NC(C)C1=CC=C(C=C1)F)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
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-"""3F840D8D6351536E_954EDFF878F856A9_6039_UN""","""CC3(OCC(=O)N1CCO[C@@H]2CCCC[C@H]12)CCOCC3""",21,"""84B4DA20177CEA26"""
-"""72B06E38C6A257E5_8138330CF70B1A99_6039_UN""","""CC4(OCC2OC(=O)C1(CCC1)C23CCC3)CCOCC4""",21,"""84B4DA20177CEA26"""
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-"""8C39C5A944476666_28FC6E05C19E71D4_6039_UN""","""CC4(OCC(=O)C23CC1CC(CC(C1)C2)C3)CCOCC4""",21,"""84B4DA20177CEA26"""
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-"""494A0E5215907A47_04F204A665177C60_6039_UN""","""CC2(OCC(C(=C1C=CN(C)C=C1)C#N)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
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-"""9E598E8BEB6BE7BA_D336ACF93B95DF67_6039_UN""","""CC1(OCC(NC(C(CC)C)C(=O)OC)=O)CCOCC1""",21,"""84B4DA20177CEA26"""
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-"""B410C9BCD5C2A356_FDDAB27B31C5DB8F_6039_UN""","""CC2(OCC1=NOC(=N1)CCCC(OC)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
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-"""295F28B053879385_F7CAA408F48DA61B_6039_UN""","""CC2(OCC1=CC(=C(C=C1)OC(F)F)OC)CCOCC2""",21,"""84B4DA20177CEA26"""
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-"""32C566954B98319D_CBFCCD0C1D54597A_6039_UN""","""CC2(OCCC(C(F)(F)F)N1CCOCC1)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""22B0AB0B3DB94615_82FC18E7DD1106ED_6039_UN""","""CC2(OCCOC1=CC(=C(OC)C=C1)OC)CCOCC2""",21,"""84B4DA20177CEA26"""
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-"""F96FC7F11C151CEB_F3466BDAAE470533_6039_UN""","""CC2(OCC(C(C1=C(C)C=CC=C1)=O)(F)F)CCOCC2""",21,"""84B4DA20177CEA26"""
-"""056245F451C5F4CA_57180FF1475C3A18_6039_UN""","""CC3(OCC(C1=N[N](C)C2=C1C=CC=C2)=O)CCOCC3""",21,"""84B4DA20177CEA26"""
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-"""659673489103B65D_41A96C33837A4A4C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NCCC3=C(C)C=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""391D925E1D6566C4_8C66BE19180692AE_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=CC(=C3)C(O)=O)=O""",21,"""FAB9FDD82DB15728"""
-"""EC4B26D5CF7065EE_8E5736880E07C088_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NC(=O)NCC3=CC=CS3""",21,"""FAB9FDD82DB15728"""
-"""81F03D0459345385_CD60EC2D11F94541_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC(C)C3=CC=C(C=C3)F)=O""",21,"""FAB9FDD82DB15728"""
-"""A9B8D458187012E1_0047D43C95538441_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3CCN(C(C)=O)CC3)=O""",21,"""FAB9FDD82DB15728"""
-"""3DB2BDD0C3B6DDC8_2F4B6AB52FF95487_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C(F)(F)F)C=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""51EC56B9B519EADC_0C1BED9455DAA609_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=CC(=C3)OC(F)F)=O""",21,"""FAB9FDD82DB15728"""
-"""A4C75491292CDFD3_673EF50EF8EF24CC_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=CC(=C(C(C)C)C=C3)C""",21,"""FAB9FDD82DB15728"""
-"""1FA1CA41347247BA_D6AF444BB14DD4CF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NC3=CC=C(C=C3)CC#N""",21,"""FAB9FDD82DB15728"""
-"""7097CCF57857CC7B_F631857672507568_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C=CC(=C3)CC)CC)=O""",21,"""FAB9FDD82DB15728"""
-"""19D1571C687BCEEC_F1560C25874A7C38_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C)C3(CCCCC3)C#N)=O""",21,"""FAB9FDD82DB15728"""
-"""76946FEF3E0C15FF_F00C026205B23D9D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C)C=C(C=C3C)C(C)(C)C""",21,"""FAB9FDD82DB15728"""
-"""8D5365894643BC49_E03F6709F151E6B2_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C(=C(C)C=C3C)C)C)=O""",21,"""FAB9FDD82DB15728"""
-"""06B0DA2A0EBDAC9B_B74817E3CFAB4A3A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=NO3)C4=CC=C(C)C=C4""",21,"""FAB9FDD82DB15728"""
-"""CBD5DB6A808635C6_F037E5D078747DC6_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=CC(=C3)[S](N(C)C)(=O)=O""",21,"""FAB9FDD82DB15728"""
-"""83556610B4CD5D42_F98C11B6140E93B0_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C)[N](C(=C3)C)C4CC4)=O""",21,"""FAB9FDD82DB15728"""
-"""067F45155D427E47_F11B3934387A8191_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NN=N[N]3CC4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""D1EABF7F554F8D7B_4FB96E79344EFFBE_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C)CC3=CC(=CC=C3)F)=O""",21,"""FAB9FDD82DB15728"""
-"""FFA341B672AD1724_71F98561B376E88E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C)OC(=N3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""148C5B476B1BD9A6_8AEE2ACC0E4F0F03_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC4=C([N]3C(F)F)C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""DDBD1A690B53F6DB_8DB900AF3139C11A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=COC(=N3)C4=CC=C(C)C=C4""",21,"""FAB9FDD82DB15728"""
-"""17E25443F77056A7_97A52E0F1C5EEB92_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C(CC(OC)=O)S3)=O""",21,"""FAB9FDD82DB15728"""
-"""D2DDD22B5564E8B5_5C2B784EE06DA877_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=COC(=N3)C4=CC=C(F)C=C4""",21,"""FAB9FDD82DB15728"""
-"""58775E1C20347679_600C05B342904513_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC=C[N]3CC4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""1F48CA56003A4131_C20A238961CF2100_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NCCSCC3=CC=CS3""",21,"""FAB9FDD82DB15728"""
-"""30C2C9520B3BC289_FFB883F8C060DFA2_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(C(=C(C)O3)C)C#N)=O""",21,"""FAB9FDD82DB15728"""
-"""398D2D5AE7CB8A9B_30C8F1EA206D631C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(=O)NC3=CC=C(C=C3)C#N""",21,"""FAB9FDD82DB15728"""
-"""08A24430E0113F9E_2433CEF9490735D7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(=O)NC3=C(C=CC=C3)C#N""",21,"""FAB9FDD82DB15728"""
-"""9C736B785D68A1A6_A78BDEE94405232F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(NC3=C(OC)C=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""412A438748A278AE_4B0D811F6EBECFB1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(=O)NC3=CC(=CC=C3)C#N""",21,"""FAB9FDD82DB15728"""
-"""665B06B7CC028D0A_B675073697CF2C04_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N3CCCC3C4=CC=CS4""",21,"""FAB9FDD82DB15728"""
-"""08A3E5DF19CD2C2E_DFED425AC5236974_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C)CC(=O)NC(C)(C)C)=O""",21,"""FAB9FDD82DB15728"""
-"""B57005709236BC9B_1325A27EDF69550F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(OC3=CC=C(OCC)C=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""5D820D32F377BD62_A92C70445C883BD3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C([S](C)(=O)=O)C=C3)=O""",21,"""FAB9FDD82DB15728"""
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-"""528F18EF20F35DDD_6207C564C69F462D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NN=C(C3=C(C)OC(=C3)C)O4""",21,"""FAB9FDD82DB15728"""
-"""631516FE99254970_2A71F4F0219C78CD_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C(CNC(C)=O)S3)=O""",21,"""FAB9FDD82DB15728"""
-"""5E80A190BA7B82EF_A7429B491B9F7E23_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NN=C(C3=C(F)C=CC=C3)O4""",21,"""FAB9FDD82DB15728"""
-"""53025CD58EC8D4D7_528FEBA24F0B8098_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=C(C(=C3C)C(C)=O)C)C""",21,"""FAB9FDD82DB15728"""
-"""9B1E0C04BB2D8892_3E0DB33103BC9507_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NCCSC3=CC=CC=C3""",21,"""FAB9FDD82DB15728"""
-"""37FA41D04FE1B746_CEEE28572749FF92_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(CC)C3=CC=C(C=C3)F)=O""",21,"""FAB9FDD82DB15728"""
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-"""96935B71AC499B70_4FFED0FFAF9CF82D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC=C(C3=CC=C(F)C=C3)O4""",21,"""FAB9FDD82DB15728"""
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-"""A1BCB7B9114F119C_77A9825304757165_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC(=C(C(=C3C)C)C)C)=O""",21,"""FAB9FDD82DB15728"""
-"""27EE3339D235B636_12F53DD0B3DAAA3C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C(C(CC)C)C=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""409D175D50FA7B53_67F9536A693401CF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C)C4=C(S3)C=CC=C4)=O""",21,"""FAB9FDD82DB15728"""
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-"""642FD45A6DBFD961_1C3DCAD7AE74D8E5_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=C([S](C(F)F)(=O)=O)C=C3""",21,"""FAB9FDD82DB15728"""
-"""D66BD494C7936207_B815AB3E55FBC565_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C)CC3=C(C=CC=C3)C)=O""",21,"""FAB9FDD82DB15728"""
-"""9021BCCC24B5CBC0_E6A0AB6D1C6EA15F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N(CC#N)C3=CC=CC=C3""",21,"""FAB9FDD82DB15728"""
-"""D25ED09DF025CC17_A06BB0C5EB18C1DD_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=C(OCC(F)(F)F)C=C3""",21,"""FAB9FDD82DB15728"""
-"""33D2C38128E76099_CE6C70ABA4D644F0_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCSC3=CC=CC(=C3)C(F)(F)F""",21,"""FAB9FDD82DB15728"""
-"""31E64A5E2A1EE989_8B20330A2EA2505E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NCC3=CC(=CC=C3)C#N""",21,"""FAB9FDD82DB15728"""
-"""397749668CE4722F_816B65A2453882D5_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=NO3)C4=CC=C(F)C=C4""",21,"""FAB9FDD82DB15728"""
-"""694F86643FF91EF9_A0AA44189D4F61E8_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N3CCCC(NC(C)=O)C3)=O""",21,"""FAB9FDD82DB15728"""
-"""12C4F8CE70F50914_04957629C128F1B5_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N=C3C=CNN3CC(C)C)=O""",21,"""FAB9FDD82DB15728"""
-"""94CD0C9D51836C84_6B94B0401E690C63_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(CC(C)C)CC(F)(F)F)=O""",21,"""FAB9FDD82DB15728"""
-"""63A7752D788BCE21_DDDB8B0A6AFF36B5_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=CC(=C3)OCC(F)(F)F""",21,"""FAB9FDD82DB15728"""
-"""5F52885A9D7BA879_938CD5C686C2DC8D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N3CCCC(C(F)(F)F)C3)=O""",21,"""FAB9FDD82DB15728"""
-"""A77A8A9C69BF4694_85155C956BBE4447_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N3CCC(C(NC)=O)CC3)=O""",21,"""FAB9FDD82DB15728"""
-"""7CF4C2C905A09E6B_68D2BD0591C593EA_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N3CCC4(CC3)OCCO4""",21,"""FAB9FDD82DB15728"""
-"""EFFFA136527B4190_D114FBB8F0B5547A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N3CCCC3C4=CSC=C4""",21,"""FAB9FDD82DB15728"""
-"""8E58D08E230573CB_4210C335F473D42A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NC4=NC3=C(CCCC3)S4""",21,"""FAB9FDD82DB15728"""
-"""BB6955B48D45DCBB_D8EC3EC0D88D29D4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC4=C3C=CC=CC3=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""47CD31C33C950926_E0F2D3D22466DE5B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CSC(=N3)CC(OC(C)C)=O""",21,"""FAB9FDD82DB15728"""
-"""6C19BD3B65A575D5_783DD2BDD271574A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC[S](C3=CC=C(F)C=C3)(=O)=O""",21,"""FAB9FDD82DB15728"""
-"""E11D31F7EF468BA8_814FFE9EC51CD469_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NC3CCN(CC3)C4CC4""",21,"""FAB9FDD82DB15728"""
-"""E0A81D720244B57A_BFFFE91DB241C2A9_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C[NH]C4=CC=CC(=C34)C)=O""",21,"""FAB9FDD82DB15728"""
-"""48B524B1CD010A7E_D98EDFA8A77BADE9_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCOC3=CC4=C(C=C3)OCO4""",21,"""FAB9FDD82DB15728"""
-"""BACE5873BEB17918_466FECC905806287_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N(CC3=CSC=C3)C4CC4""",21,"""FAB9FDD82DB15728"""
-"""659DB1719A731869_4D30B62A955A103A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=CC=CC(=C3)C(OC)=O""",21,"""FAB9FDD82DB15728"""
-"""3A033F79012139AC_BA836D6A0F22E692_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC(=CS3)C(N(C)C)=O)=O""",21,"""FAB9FDD82DB15728"""
-"""9CA3736DF1051141_33592DAE8D46EB65_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NN=C(CC3=CC=CC=C3)O4""",21,"""FAB9FDD82DB15728"""
-"""0110C0E3AE2934FD_A69DC5302DAAC581_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCC3=CC=C(C=C3)[S](=O)(=O)Cl""",21,"""FAB9FDD82DB15728"""
-"""A79867408D2BD2CB_4F6B6C7412EADC2C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC[S](C3=CC=CC(=C3)OC)(=O)=O""",21,"""FAB9FDD82DB15728"""
-"""7630734C66B29829_6861C96757A5A33C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NCC(=O)C3=CC=CC=C3""",21,"""FAB9FDD82DB15728"""
-"""5521EE7DFFC0089E_308535DD97CB2FF2_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC3=C(C=CC=C3)[S](=O)(=O)N4""",21,"""FAB9FDD82DB15728"""
-"""52AB56337CC48610_30649110B0F47730_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CSC(=N3)C4=C(F)C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""94EA41561986E3BE_53AA36F4F7B34D5F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3CN(C(=O)O3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""EA1BA62D3FE82604_7336C9163D67C49E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCC4=C3C=CC=CC3=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""CD888C233BE536BA_AABAEC875F014EDB_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=C(C=C3)[S](=O)(=O)C)OC""",21,"""FAB9FDD82DB15728"""
-"""625E03BA0FECB933_705486A78D70A08B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3CCN(C(C)C)CC3)=O""",21,"""FAB9FDD82DB15728"""
-"""D03430DDDF63A39C_23CEBCEA56AC3ECA_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=C(OC)C=C3)[S](=O)(=O)C""",21,"""FAB9FDD82DB15728"""
-"""45BFA5E9706784D8_44373384FA9A8EFF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C(NC(N)=O)C=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""A57223743DB0F999_61A4B3273FF24342_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=C(OC)C=C(C=C3)C#N""",21,"""FAB9FDD82DB15728"""
-"""66322C94BFD48B7F_EADB1348F654DBE9_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=C4C(=CC=C3)C=CC=N4""",21,"""FAB9FDD82DB15728"""
-"""1370916EE76A2611_1A59E80F18A9CA6A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NN=C(C3=CC=CC(=C3)F)O4""",21,"""FAB9FDD82DB15728"""
-"""4C35C66B2F428D1B_5322E803078AA2EC_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=CC=CC(=C3)[S](C)(=O)=O""",21,"""FAB9FDD82DB15728"""
-"""3773BE30C566E3E5_D60425CD3A90CF76_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=NO3)C(OCC(C)C)C""",21,"""FAB9FDD82DB15728"""
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-"""03F24BC74CDC04A3_AC1158A62B8592D5_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=C(SC(N(C)C)=O)C=C3""",21,"""FAB9FDD82DB15728"""
-"""4F23274FA1744BB4_FEE302699DB8B3D1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC[N]3N=CC(=C3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
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-"""8842203F6980CB82_8B598C5A51784082_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N=C3N=C(SCCC)NS3)=O""",21,"""FAB9FDD82DB15728"""
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-"""45166E46BD2C3BBB_02A797CD5014CD92_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC=C(C3=CC=C(C)C=C3)O4""",21,"""FAB9FDD82DB15728"""
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-"""70126E716BE41924_8B76AAA3753C5275_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCN3CCC(C(OC)=O)CC3""",21,"""FAB9FDD82DB15728"""
-"""17B531ADBAA0E7A6_09CED1D51CC95584_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=C(C(OC)=O)C=C3)OC""",21,"""FAB9FDD82DB15728"""
-"""F507852B64DC1A3C_11E500CA2B4D51F5_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCN3C(=O)COC4=C3C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""3036153766A98B11_59E8524A3680B4E7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC[S](C3=CC=C(C)C=C3)(=O)=O""",21,"""FAB9FDD82DB15728"""
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-"""C5CA158C468738D6_D3F387D7418E24D4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=C(C(C)C)C=C3)=O""",21,"""FAB9FDD82DB15728"""
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-"""5CC36C0BC2110343_10244FAE06A66DF0_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C3=CC4=C(C=C3)NC(=O)N4""",21,"""FAB9FDD82DB15728"""
-"""A415C2C71007CE48_B5ACC696331BBD89_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(C(=C(C)S3)C)C#N)=O""",21,"""FAB9FDD82DB15728"""
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-"""80A2190AC7A63320_B8C902A4B0E5FA45_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCN4C(=O)C3=C(C=CC=C3)C4=O""",21,"""FAB9FDD82DB15728"""
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-"""88F9525D26D9E0AF_55515685E874B801_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC(CCC)(C)C(=O)OC)=O""",21,"""FAB9FDD82DB15728"""
-"""8B6EF785DB612CAA_129D3C098EE3EDFF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=C(C(OC)=O)C=CC=C3""",21,"""FAB9FDD82DB15728"""
-"""854C099DB1352610_7A2D1E86D2528FF0_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C([N](=O)=O)C=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""951525CDC0778931_FB8B6C12368DDADF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C3=CC4=C(C=C3)C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""34B633421F687AFA_D34DBCD813A0EA98_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C(OC(F)F)C=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""1DEDCC7B7FF653BE_45078F5DA4D07086_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=C(C(C)=O)C=C3)=O""",21,"""FAB9FDD82DB15728"""
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-"""2C672BC5411F01C1_DE88F5BAEF97C9CF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(C(C)=O)C=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""6C4D1435B574A363_9A760E036F2391A4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC[S](C3=CC=CC(=C3)C)(=O)=O""",21,"""FAB9FDD82DB15728"""
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-"""704BB30F1ABB0C34_C86EEE787FEFA3D0_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=NO3)C4=C(C)[N](N=C4)C""",21,"""FAB9FDD82DB15728"""
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-"""B0A8CB2DB6EA5791_854698F6BCF11962_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCC3=NC4=C(C=C3)C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""691DDCE310CE7DAE_0C51275D948A6993_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=N[N](C3=C(F)C=CC=C3)C=C4""",21,"""FAB9FDD82DB15728"""
-"""9A43C9771335FF89_CCCA1D245BCCA955_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C4COC3=C(C=CC=C3)O4""",21,"""FAB9FDD82DB15728"""
-"""3074E98F7D27A615_AD503492DBA6593A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C)C=C(C=C3)[N]4C=NC=C4""",21,"""FAB9FDD82DB15728"""
-"""F4ADBB7CB9243D64_3F14905FEAB100F1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NN=N[N]3CC4CCOCC4""",21,"""FAB9FDD82DB15728"""
-"""6C27E34534674B15_B5634DB882996A21_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=C(C=C3)[N](=O)=O)OCC""",21,"""FAB9FDD82DB15728"""
-"""18C00CEDBA0D5956_5DAA8B8E4778BF63_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=CC3=C(N(C)C(=O)CC3)C=C4""",21,"""FAB9FDD82DB15728"""
-"""F39F6462F263803B_4302CD52B85168C2_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=C([N](=O)=O)C=C3)[N](=O)=O""",21,"""FAB9FDD82DB15728"""
-"""241E3C219341A857_A74CA20737AD9C96_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=CS3)C4=CC=C(C)C=C4""",21,"""FAB9FDD82DB15728"""
-"""C1026E4AFF5D483A_BAE53FADB7E237FD_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC4=C(C)N=C3SC=CN3C4=O""",21,"""FAB9FDD82DB15728"""
-"""5541CE37A59383CF_D8434194D7A52D87_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=NC=C(C(F)(F)F)C=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""A1C2F3F837E55582_1FC44CEE603B8C81_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C4=C3C=CC=CC3=CC=N4""",21,"""FAB9FDD82DB15728"""
-"""45002063DB5BCE6B_F94FB4D7A2CB2A04_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CN=C([S](C)(=O)=O)C=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""B072B6475CE87C32_737F36212634DA04_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC(=NC=C3)C(F)(F)F)=O""",21,"""FAB9FDD82DB15728"""
-"""61F5429CF2EC6146_90547E63F1E05811_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(F)C=C(C(=C3)F)C(F)(F)F""",21,"""FAB9FDD82DB15728"""
-"""621B2EB7D123DEC7_A2CB27E948CE59A9_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NN=N[N]3C4=CC=C(F)C=C4""",21,"""FAB9FDD82DB15728"""
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-"""59CCE9A4233B9BFA_9859AD32FC159094_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NOC(=C3)C4=C(F)C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""3C1A4D0B3D90B17D_A84C3A424DBD8648_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC#CC3=CC=C(C(F)(F)F)C=C3""",21,"""FAB9FDD82DB15728"""
-"""E07F9DAD96821BB5_162685714492A290_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NN=N[N]3C4=CC=C(C)C=C4""",21,"""FAB9FDD82DB15728"""
-"""6673CA1B28B51456_0C2B6633AEC58686_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N3CCN([S](C)(=O)=O)CC3)=O""",21,"""FAB9FDD82DB15728"""
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-"""FEF9100A4D7449A6_9B3FD52C8A7CF29F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C(C)C)C3CCCCC3)=O""",21,"""FAB9FDD82DB15728"""
-"""7ABD25CA5E02B36E_74901C32B868F005_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C3CCCC4=C3C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""701647D368667450_CBAD2379F15F4D19_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=NO3)C4=NC=CC(=C4)C""",21,"""FAB9FDD82DB15728"""
-"""933E13557863C05C_B1B48AB29113A389_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N(CC=C)CC3=CC=CS3""",21,"""FAB9FDD82DB15728"""
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-"""4CC77746CED9BD1F_5FEADF2F6429BD71_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C)CC3=CC=C(C=C3)F)=O""",21,"""FAB9FDD82DB15728"""
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-"""AC7D4ECC573FBA00_D74780EB85764858_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=CC=C([S](Cl)(=O)=O)C=C3""",21,"""FAB9FDD82DB15728"""
-"""F75E0C2CAD72FF8F_C8F391E186E10FD4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC3=NC=C(O3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""596CCD30E3FE6C6C_DFA7EE6BCD465277_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC=C(C3=C(C)C=CC=C3)O4""",21,"""FAB9FDD82DB15728"""
-"""698147679E563DFD_B0345875F3E0E4C7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(=O)NCCC3=CC=CC=C3""",21,"""FAB9FDD82DB15728"""
-"""44BEB486D8AC546E_A586FA3F6C84C044_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=N[N](C3=CC=CC(=C3)F)C=C4""",21,"""FAB9FDD82DB15728"""
-"""7901B8B954526154_7603060C181A0862_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C(OC(C)C)C=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""59A460FE2EF469F5_E77ACF25ED7C3BC1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""FAB9FDD82DB15728"""
-"""8374143FC55C4FA3_2BB0B13F4D95A59B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(CC)C3=C(C=CC=C3)C)=O""",21,"""FAB9FDD82DB15728"""
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-"""04DE1C32FDCE1B55_9E12485047FC7015_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NCCCC3CCCCC3""",21,"""FAB9FDD82DB15728"""
-"""C707F6D9B54C3993_F7E94ECC0814CB5E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NCCCN(C)[S](=O)(=O)C)=O""",21,"""FAB9FDD82DB15728"""
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-"""8C033C6A5FF77B63_DCAB3173806E985C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=CC(=C3)C(C(F)(F)F)=O""",21,"""FAB9FDD82DB15728"""
-"""83F80F1996688286_72774138B8584AA1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CN=C(C=C3)C4=NC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""486B4406980B73A7_E343709E8CF85721_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(F)C=C(C=C3)C4=NC=CO4""",21,"""FAB9FDD82DB15728"""
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-"""C2CD026F4CE7832D_9676755974990088_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4CN(C3CCCCC3)C(=O)O4""",21,"""FAB9FDD82DB15728"""
-"""14740B0E73BB0D7E_EA4BD6AB3442BAAA_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(C(OC)=O)C3=CC=CC=C3""",21,"""FAB9FDD82DB15728"""
-"""66EFD4AB823D8E0E_35F70F9789E404A8_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NN=C(OCC(F)(F)F)C=C3""",21,"""FAB9FDD82DB15728"""
-"""750D63D0FC11C8CF_5B63D92DC7EE37B3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=C(C(O)=O)C=C3)[N](=O)=O""",21,"""FAB9FDD82DB15728"""
-"""8A86A600F74E4B95_E6006A205F8A581D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC3=C(C=CC(=C3)C(O)=O)[NH]4""",21,"""FAB9FDD82DB15728"""
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-"""58F01118C34A7A05_5BF754B20F70A308_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NN=C(C3(OC)CCOC3)O4""",21,"""FAB9FDD82DB15728"""
-"""CC35322833A4C65D_A3BEDEE7E5B3D075_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC4=CC3=C(OC(F)(F)O3)C=C4""",21,"""FAB9FDD82DB15728"""
-"""A8DB78A7979DA7DB_205BA396E02AFDCE_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C[NH]C4=C3C=C(F)C=C4)=O""",21,"""FAB9FDD82DB15728"""
-"""27DB854BC34D6778_8283CCA334C690AB_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C(OC)=O)C=CC=C3OC""",21,"""FAB9FDD82DB15728"""
-"""91B7E366D34D2761_E38C28FA6C0A922E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C=C([N](=O)=O)C=C3)F)=O""",21,"""FAB9FDD82DB15728"""
-"""C3B8AC68B88811AE_DF9E43BBCF5AA635_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=C3C=CC=CC3=C(OC)N=C4""",21,"""FAB9FDD82DB15728"""
-"""64AF5BDFD7D51588_6DAC1AF95C0E866B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=COC(=N3)C4=C(F)C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""FFC870D06EED97E3_D89005C6B2CC0F89_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3CCCC(C(F)(F)F)C3)=O""",21,"""FAB9FDD82DB15728"""
-"""4D5D0A75596BC645_8C7F0AE3B1B48AC3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C)[NH]C(=C3)C(OC)=O)=O""",21,"""FAB9FDD82DB15728"""
-"""F1A737C120872405_5B1A3AA7AB571971_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC3=CC=CC4=C3OC(F)(F)O4""",21,"""FAB9FDD82DB15728"""
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-"""37C2D110706053FD_25B5256D107E7BB7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCOC3=CC=C([N](=O)=O)C=C3""",21,"""FAB9FDD82DB15728"""
-"""F4DF5BE7CABBA5A8_97718C312C79C392_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C)C=CC4=C3C=CC(=C4)C""",21,"""FAB9FDD82DB15728"""
-"""8099DC92654B176F_ADA1ED02DC763BC0_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC4=C(O3)CC(C)(C)CC4=O""",21,"""FAB9FDD82DB15728"""
-"""AC57F9B621B6D37E_86BDC32AC122749B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C)N=C(O3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""754D6FE41BE9C3DC_B58655D046950D0C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3CCCC(O3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""D41DB9C635B5BD1A_328E3213765509C1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=CC(=C3)C(OC)=O)OC""",21,"""FAB9FDD82DB15728"""
-"""F68877112C5ADED9_F55B32A4F4CBD02D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(OCC)C=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""EE8D233940685EBA_B733E12447B522DC_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=C(C(N)=O)C=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""E3A639D1D6D5E5BF_36BC94E0D86F77A1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(CC)C=CC4=C3C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""B42EC9E9E4E7F762_4F4F0FBD5C7EE7C9_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=CC(=C3)[N](=O)=O)=O""",21,"""FAB9FDD82DB15728"""
-"""8F6D70E329270E1E_0AEA1E1D6862582F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C3=CC4=C(C=C3)NC(=O)C4""",21,"""FAB9FDD82DB15728"""
-"""E6338AAF80DD687D_7713AAC3B077E889_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NCCC3=CC=C(F)C=C3)=O""",21,"""FAB9FDD82DB15728"""
-"""6DCF421A5C53B273_824A03D21BCBE406_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=C([N](=O)=O)C=C3)=O""",21,"""FAB9FDD82DB15728"""
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-"""23211DF47CAD3967_9B22F9102642F163_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N3C4=C(CC3C)C=CC=C4)=O""",21,"""FAB9FDD82DB15728"""
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-"""BBD07F133B962CB2_2E63E9253F2625BD_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(C(=C(F)C=C3)F)F)=O""",21,"""FAB9FDD82DB15728"""
-"""C8AAAD6AF5E88733_D71D9C490D242459_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=C(C=C3)N4CCOCC4""",21,"""FAB9FDD82DB15728"""
-"""BEED28378F554701_204219236B49A2CF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C4=CC3=C(C=CC(=C3)C)O4)=O""",21,"""FAB9FDD82DB15728"""
-"""0FBA2D656306F9C3_E6E31D63EFAA498D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC3=NN=N[N]3C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
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-"""2CD2EC38B1A62162_6C1A833128317E4D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC5CC3(CC4(C3)OCCO4)CO5""",21,"""FAB9FDD82DB15728"""
-"""F34B002F4A994C0E_B0728013EE44902F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NOC(=N3)C(OCC)OCC""",21,"""FAB9FDD82DB15728"""
-"""765A90324487B876_EB43F8004235EBA7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N3CCO[C@@H]4CCCC[C@H]34""",21,"""FAB9FDD82DB15728"""
-"""CB1E5C770602AC7F_FF3514F4CDC6A797_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4OC(=O)C3(CCC3)C45CCC5""",21,"""FAB9FDD82DB15728"""
-"""046D804AD3E8679D_8E971E9FFCD5F175_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOCCOCC3=CC=CC=C3""",21,"""FAB9FDD82DB15728"""
-"""4ADD2D4FDA8CC83C_7E818301D29529E2_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(OC(O3)=O)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""4E82EB61D62CF57C_4D5BBDBB40153AC2_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC4NC(=O)C3=C(C=CC=C3)O4""",21,"""FAB9FDD82DB15728"""
-"""782BA4ED601D9788_437F10D2EF72F423_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NCC=CC3=CC=CC=C3""",21,"""FAB9FDD82DB15728"""
-"""E15E14BB6A299558_56F149FDFB53CCDA_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C45CC3CC(CC(C3)C4)C5""",21,"""FAB9FDD82DB15728"""
-"""578ABD7F056F671A_C7D6E74989B545C1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C([N](CCC)C(=C3)C)C)=O""",21,"""FAB9FDD82DB15728"""
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-"""F729D17B21517C45_CFD4B193E96F4BDD_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C[N](C)C4=C3C=CC=C4)=O""",21,"""FAB9FDD82DB15728"""
-"""C204015CAAAF9033_EAD078E83ED3DBE3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=CC4=C(C=C3)C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""6B0BF18AAA24965C_F60D6A157C3D261B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(C(OC)=O)SC=C3)=O""",21,"""FAB9FDD82DB15728"""
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-"""D5891DCDC3F96298_043EFC4FAC4BB3D4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C(=CC(=C3C)C)C)C)=O""",21,"""FAB9FDD82DB15728"""
-"""898363A43627D064_83D795830B086681_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NOC(=N3)CCCC(OC)=O""",21,"""FAB9FDD82DB15728"""
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-"""745DCBDBF269C54F_358227CB7EDC563A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=CC(=C3)C(N)=O)=O""",21,"""FAB9FDD82DB15728"""
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-"""A4ECFC1F76DFBC96_B42C93F3C4DFABC3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=CS3)C4=CC=C(F)C=C4""",21,"""FAB9FDD82DB15728"""
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-"""6CE9A6B934CE849C_D58CFDFBC785A51A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=CC(=C3)[N](=O)=O)[N](=O)=O""",21,"""FAB9FDD82DB15728"""
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-"""124FC652ECBB820E_891982190FB3D545_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC3(C(OCC)=O)CCCC3=O""",21,"""FAB9FDD82DB15728"""
-"""12D647A8F678ED17_2E7DEDAFFFB93DBC_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C)CC3=C(C=CC=C3)F)=O""",21,"""FAB9FDD82DB15728"""
-"""7152C4421D795A50_E45F1BF5F2B850E3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC4=C([N]3CC)C=CC=C4F""",21,"""FAB9FDD82DB15728"""
-"""034419C08D613D8C_AA2B1CA7BC99A9A7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCCCCOCCOCCC""",21,"""FAB9FDD82DB15728"""
-"""80F7CF9C490BA9FC_F5676A8F13E72EBB_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NOC(=C3)CC4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""AF4F0A9C381B05FC_E0EB522EAF687340_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=COC(=N3)OC4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""4568DDF41E8DD5EE_E2405851475F56C7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CN=C(N=C3)C4=CN=CN=C4""",21,"""FAB9FDD82DB15728"""
-"""937797D32C88E757_496FF56D946735C9_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=C(C=C3)C#N)C(OC)=O""",21,"""FAB9FDD82DB15728"""
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-"""A79A1BBEA2864F8B_37919C501B05B357_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4CCC3(CCCCCCC3)O4""",21,"""FAB9FDD82DB15728"""
-"""1B614EA3200ED773_2EB93516DCB66EF3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=N[N](C=C3)CC4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""5E31667CA4F0566E_F58B91EA51C18A98_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=COC(=N3)CC4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""1546ACB9337E4569_FC2B5AEB17A9E6C8_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=CC(=C3)OCC(OC)=O""",21,"""FAB9FDD82DB15728"""
-"""05505985AC928E0D_15BFA3A9A9AAE4E4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=CC(=C3)[S](CCC)(=N)=O""",21,"""FAB9FDD82DB15728"""
-"""0DA61569B90C2592_ACF1D484B7E4DA27_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C(OCC)=O)C=NC(=N3)C""",21,"""FAB9FDD82DB15728"""
-"""2F0408558BEA824D_D2E790D829AE5378_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=N[NH]C(=C3C)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
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-"""39E384914E2704FF_80B7996EE5D3E688_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3(O)CSC(=N3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
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-"""685FBD4B2C7F2866_6AB71840AB00C12F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C(C)C)C3=CC=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
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-"""8D2E79D06B281D12_293A9A3DF222AF31_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=CC(=C3)OC)[S](=O)(=O)N""",21,"""FAB9FDD82DB15728"""
-"""6CF67D1AA7BF3063_A4A9164323CC98F8_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=N[N](C3=CC=C(C)C=C3)C=C4""",21,"""FAB9FDD82DB15728"""
-"""7F7624C63C777354_7858A1E86C43C33E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=CC(=C3)OC)[S](=O)(=O)F""",21,"""FAB9FDD82DB15728"""
-"""7A70C87915880FD2_CBFC987132210F7B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C)N=C(S3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""34C74B404BAD914F_CBEFC22ED9BABA4C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=CC(=C3)OC)[S](=O)(=O)Cl""",21,"""FAB9FDD82DB15728"""
-"""744FEF4BCFA07F2F_E6608B034AE1E1FB_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(F)C=C(C=C3F)C(F)(F)F""",21,"""FAB9FDD82DB15728"""
-"""8783F9BE6364C73B_AA39CA1389BABFAA_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=CC(=C3[N](=O)=O)C(O)=O""",21,"""FAB9FDD82DB15728"""
-"""051C69BD83728FBF_9619299A9F4F2809_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC4=C([N]3CC)C=CC(=C4)F""",21,"""FAB9FDD82DB15728"""
-"""06D1E10AAB41F97E_920EBBD68AE01EA6_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NOC(=N3)C4=CC=CC(=C4)F""",21,"""FAB9FDD82DB15728"""
-"""F8033F2A05A501C5_0C06BDB1ECEC4CE1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NOC(=N3)C4=C(F)C=CC=C4""",21,"""FAB9FDD82DB15728"""
-"""AB006D8C767AD2F1_AD968833322330FE_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC([C@@H]3CC[C@H](C(F)(F)F)CC3)=O""",21,"""FAB9FDD82DB15728"""
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-"""2CDED6037C0E425B_AE0BF4B78E025F3D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C(C(F)(F)F)C=C3)=O""",21,"""FAB9FDD82DB15728"""
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-"""CA021C31A497BEF0_E7638A94C36318B1_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCN2CCOCCC2""",21,"""5A9F5D185F50D637"""
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-"""4808B84BAF61D282_66DF10C453DD4186_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC(=C(C)C=C2)C""",21,"""5A9F5D185F50D637"""
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-"""4E300B18E38DF418_1469A13A0D937202_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCOCC2CCCC2""",21,"""5A9F5D185F50D637"""
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-"""898B3E38E75E5709_4E9A4D2572561463_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2CCCCCC2""",21,"""5A9F5D185F50D637"""
-"""8589CE0071F12134_27BDEFA00027D3E4_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC3=N[N]2CCCC2=C3""",21,"""5A9F5D185F50D637"""
-"""A5D3A1093848EBF1_F1D361332AA7D5B8_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCC2CCNCC2""",21,"""5A9F5D185F50D637"""
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-"""ABB09FEB1F84D1D3_45FE05109E597C68_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCC2=CN=CC=C2""",21,"""5A9F5D185F50D637"""
-"""DDCE2F6F05775702_0A658134A044F724_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC=CC(=C2)SC""",21,"""5A9F5D185F50D637"""
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-"""63ABD790F5793ED2_B1866E6BB8F837EF_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCC#C[Si](C)(C)C""",21,"""5A9F5D185F50D637"""
-"""774BF8D0C148AEEB_9C0FBCE8FF7528E8_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(OC)C2CCOC2""",21,"""5A9F5D185F50D637"""
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-"""B90FDA897976FA82_E9B85AA58F91D72B_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2NC(OC2C)(C)C""",21,"""5A9F5D185F50D637"""
-"""DFBBD8532826608B_2D681D38271AC963_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC(=CS2)C(O)=O""",21,"""5A9F5D185F50D637"""
-"""756D87F8F38A05ED_558BA232F017A5E7_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC(=NO2)C3CC3""",21,"""5A9F5D185F50D637"""
-"""2BE9CE3D161DA254_3CE230B4F56B8A52_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2CC(C)(C)C(N2)=O""",21,"""5A9F5D185F50D637"""
-"""CD3CE2259110133E_38D4A72E6A689A6D_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NN=C(C(C)C)S2""",21,"""5A9F5D185F50D637"""
-"""182DE345FC80C662_E9DF073D72DB1A02_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCOC2CCOCC2""",21,"""5A9F5D185F50D637"""
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-"""23C3EEC5951F050A_8FCF859D5972CF32_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC3CC2(CCC2)CO3""",21,"""5A9F5D185F50D637"""
-"""D1E0B3040486C2EC_F672B9C212D593FE_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC3[N]2N=CN=C2CC3""",21,"""5A9F5D185F50D637"""
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-"""870AEB5C27E168BE_DBA101096ACBC355_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=COC(=N2)C3CC3""",21,"""5A9F5D185F50D637"""
-"""998A4F73C96FE504_CEC338AF80BDBDD9_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2CCC(C)(C)CO2""",21,"""5A9F5D185F50D637"""
-"""B5F91770CA3BD2D4_90D2B92E1D8D62C6_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C(OCC)=O)=NO""",21,"""5A9F5D185F50D637"""
-"""8393D7BD2A92FF75_379C5F9D7AD8755E_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2CCCC(C)(C)O2""",21,"""5A9F5D185F50D637"""
-"""D45C428B8CFCFF88_6C3F8F5DA2F5720A_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C([N](N=C2C)C)C""",21,"""5A9F5D185F50D637"""
-"""F3DF34093332AB6E_873538CE0326D4B7_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC(=NS2)C3CC3""",21,"""5A9F5D185F50D637"""
-"""4E1D8754788BCCD1_22EBAC86818B2818_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC3CCC2(CCC2)O3""",21,"""5A9F5D185F50D637"""
-"""0E1FA02DCFC05124_2C0501B2D45A7889_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(CC(OCC)=O)=O""",21,"""5A9F5D185F50D637"""
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-"""40FEF10BDF8EA2E5_AAA15C12740D3D02_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2=CC=C(F)C=C2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""6D972556A4E99EA7_30A45879E6E4DD82_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(OC)C=CC(=C2)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""0CAC2C40419FD8B3_670624EA7A2A8AB0_6039_UN""","""CC1=C(C=CC(=C1)OCC(=O)NC(=O)NCC=C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""70B41713A1EE6599_575DC121236816DC_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2=NC=CC(=C2)C)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""8FDBE6D49A6F144A_06856ACA850420D0_6039_UN""","""CC1=C(C=CC(=C1)OCC2=N[NH]C(=N2)C(C)(C)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""A728DBEA88A1B994_C60154119DD6D152_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2=C(C)N=CC=C2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""7A0CB538E8BC3919_A55216B27EBBF542_6039_UN""","""CC1=C(C=CC(=C1)OCCSCC2=CC=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""15DDBAEF76386BDF_B9C9F885797E76CB_6039_UN""","""CC1=C(C=CC(=C1)OCC(=O)C2CC[S](=O)(=O)C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""7862AF4AFD46B864_2A930D82CD296539_6039_UN""","""CC1=C(C=CC(=C1)OCC(=O)NCC2CCCO2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""3B1C8AC60EC30630_2A0463D022CAAEA2_6039_UN""","""CC1=C(C=CC(=C1)OCC(=O)N2CCCCCC2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""34A57188E4B4247E_528B6888344DB1F0_6039_UN""","""CC1=C(C=CC(=C1)OCC(N2CCCC(C)C2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""5B63848945B4F1D0_E33E9CD896EBE276_6039_UN""","""CC1=C(C=CC(=C1)OCC(N2CCCCC2C)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""3986D873D881ACC1_69A72AC6567F1AA5_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=CC(=C2)C(C)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""09D8AF4F7FF01DF6_A8C0B80DA10B8FD2_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C(O)=O)C=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""F4FBA8A2E2EFE612_724940CD95ECBAA1_6039_UN""","""CC1=C(C=CC(=C1)OCC(NCCCCCC)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""E45DDA9C29D52D43_AF8D854EDDB31905_6039_UN""","""CC1=C(C=CC(=C1)OCC(NCCCOCC)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""0E790F83AED098EF_01C05EBF426D4028_6039_UN""","""CC1=C(C=CC(=C1)OCC[S](=O)C2=CC=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""CFA843E51EA38E49_6356B55580558FF6_6039_UN""","""CC1=C(C=CC(=C1)OCC(NNC(C(C)C)=O)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""B797F10257732381_D0FF471FAD7E008F_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NC=N[N]2CC(C)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""83BC15A6279C1F4B_F0ACE837EC4F08D8_6039_UN""","""CC1=C(C=CC(=C1)OCCCC2=C(C)C=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""E269BD58BBEEF7EE_024E048CEC95D1EE_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2=C(F)C=NC=C2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""119BF400D16BC340_B65EA09C66CE28AC_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NC(=CO2)C(OC)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""C8623874DD74457C_62490CA38A00AAEF_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2(C(F)(F)F)CC2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""63C4B34E0A2CDD59_9F90EA8B2D4C3171_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NOC(=C2)CC3CC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""271D231790209227_B5DE615DFAA5A648_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NC(=C[NH]2)C(F)(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""29CCD1D98434A9E1_CCDFEA910390FBE7_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NO[C@@H]3CCCC[C@H]23)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""A27D300DA6AC2549_D5C375AFFE964112_6039_DP""","""CC1=C(C=CC(=C1)OCCC3CC2CCC(N2)C3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""964A7AB13A97E96A_75DD638B650E25A3_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=CC(=C2)C(N)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""A912CA015D0F88E8_B0B5C41C95B51DD8_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=C(C(OC)=O)S2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""E1E4A8CCF41D2A7C_A865130A039B22C8_6039_UN""","""CC1=C(C=CC(=C1)OCC(NCCCC(O)=O)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""0A06E7BB9E6FD389_C025C7774DE168AE_6039_UN""","""CC1=C(C=CC(=C1)OCC(=O)NCC2=CC=CS2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""481662FAE5907F75_8A691FC092E3EF66_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=CC3=NON=C23)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""D6C983FCD4A830C2_9A811E9EF3265D46_6039_UN""","""CC1=C(C=CC(=C1)OCC3=C[N]2C=CC=NC2=N3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""C518046DF12FE468_0513605E3F8039C3_6039_UN""","""CC1=C(C=CC(=C1)OCCOC2CCCCC2C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""019A7B4456201603_D7ADC0ABCDE49769_6039_DP""","""CC1=C(C=CC(=C1)OCC3=CC2=C(C=C[NH]2)C=C3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""27372DE3893C1708_BD5D3478534845FE_6039_UN""","""CC1=C(C=CC(=C1)OCCOCC(C(F)F)(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""A757C552725853DA_5BB943632C04AE96_6039_UN""","""CC1=C(C=CC(=C1)OCC(NC(NCCC)=O)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""C3E4B5D5442B5F88_FDAA2529E6F43240_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NN=C([N]2C)C3CC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""73F907EB73ED7FD3_AAC068E9139506CF_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NN=C(S2)C3CCC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
-"""9EE9864E8139459A_61F5C199561E0CED_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=CC(=C2)C(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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-"""CDEAE3280F420770_F4B22CDC4D106A96_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCOC(C)=O""",21,"""DD8ACFD5B9DF1DDB"""
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-"""107DA525781D3CC0_E65F4EDAEA9EC02C_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3OC3(C)C""",21,"""DD8ACFD5B9DF1DDB"""
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-"""48B17FBD879797E1_0025EBFB9FB73501_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=CSN=C3""",21,"""DD8ACFD5B9DF1DDB"""
-"""25F1DCF8C5927B7B_E7F5FE4971693A9B_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=NCCO3""",21,"""DD8ACFD5B9DF1DDB"""
-"""65DBDD6FFCE4CF6F_7B4D602CD3308BF9_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=NN=CS3""",21,"""DD8ACFD5B9DF1DDB"""
-"""FB331F9D6DBA6EDA_0AF8B16B80C22FA9_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCC3CC3""",21,"""DD8ACFD5B9DF1DDB"""
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-"""0F1C1AEE618C3084_4AD7AF1F2BBC315D_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(OCC)=O""",21,"""DD8ACFD5B9DF1DDB"""
-"""E3AE8C192399AEE1_19AFB8FC4CC7795D_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC[S](N)(=O)=O""",21,"""DD8ACFD5B9DF1DDB"""
-"""DB9E4DCBF02C510B_3FABBE0C6D904AE4_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCCC#N""",21,"""DD8ACFD5B9DF1DDB"""
-"""7A073BAB0DA3F0C3_C0FA7CF9842DD761_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC=CC=C""",21,"""DD8ACFD5B9DF1DDB"""
-"""014F20BF055E5528_17A6BFFDFDD653FA_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCNC(C)=O""",21,"""DD8ACFD5B9DF1DDB"""
-"""BAF92241487F9D8E_5AF48198FC659E4B_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC[S](=O)(=O)Cl""",21,"""DD8ACFD5B9DF1DDB"""
-"""987745A7440335E8_1404DE75728C8326_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCCCC""",21,"""DD8ACFD5B9DF1DDB"""
-"""1EE5B1DA72FCDB2B_0540431F23E6AF36_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC(CC)C""",21,"""DD8ACFD5B9DF1DDB"""
-"""BAC8FE13F2E6BDCE_3221AC358120B9F6_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCC(C)=C""",21,"""DD8ACFD5B9DF1DDB"""
-"""05B0EDF4666A86B6_8D0AD95D4121C13F_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(=C)CC#N""",21,"""DD8ACFD5B9DF1DDB"""
-"""75390D5E0674D227_FC264A4E0B1B8C3A_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCC(F)F""",21,"""DD8ACFD5B9DF1DDB"""
-"""E25FC9ABC2F1E4F0_59351D8A75D90156_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC=C(C)C""",21,"""DD8ACFD5B9DF1DDB"""
-"""84092F69A460B8B4_E7BC78A93CD3CA8E_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC=C(C)C#N""",21,"""DD8ACFD5B9DF1DDB"""
-"""28B8B8F1D2CA3B03_7E153652030CCFF2_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(NCO)=O""",21,"""DD8ACFD5B9DF1DDB"""
-"""275DBBA911F0DC4A_33108429DC804136_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCOC(F)F""",21,"""DD8ACFD5B9DF1DDB"""
-"""2217660D726619A9_33726331B4F0BC84_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC3(C)CC3""",21,"""DD8ACFD5B9DF1DDB"""
-"""CECAAE93BE97B56F_51B8072BBA712B02_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC#CC3CC3""",21,"""DD8ACFD5B9DF1DDB"""
-"""C1C1CDA45F445E2E_90A1C29A6EB90D30_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC3COC3""",21,"""DD8ACFD5B9DF1DDB"""
-"""A6C838D754D45E4C_1CBB1323FC649C48_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCC(N)=O""",21,"""DD8ACFD5B9DF1DDB"""
-"""D17BF6DEE58D29AE_38966180283CF039_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC(C)(F)F""",21,"""DD8ACFD5B9DF1DDB"""
-"""080D45FFF708C8B3_BFC97A149F9EDECA_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC3(C)N=N3""",21,"""DD8ACFD5B9DF1DDB"""
-"""F69D8C72537608AA_8FDC1D713F40850C_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3CCCN3""",21,"""DD8ACFD5B9DF1DDB"""
-"""2DA1475579243AA7_9C9EB4C91AF03D2C_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC([C@@H](C)N)=O""",21,"""DD8ACFD5B9DF1DDB"""
-"""B5D3F1E94377BE58_B579FD8DB385FD3B_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCN3CCC3""",21,"""DD8ACFD5B9DF1DDB"""
-"""B063C93348A537A7_7A3101BB2D2562C3_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=N[NH]C=C3""",21,"""DD8ACFD5B9DF1DDB"""
-"""C37F48AB52CA0323_A5BCAEEAA84C16AE_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC(C)(C)F""",21,"""DD8ACFD5B9DF1DDB"""
-"""9D95DEDAAA471380_67680622C396460D_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(C(C)C)N""",21,"""DD8ACFD5B9DF1DDB"""
-"""F47CCD737BA26176_EBF52D39DEFF95F7_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCN=[N]#N""",21,"""DD8ACFD5B9DF1DDB"""
-"""DFB4BB715A9CD05A_DFD128A984E2B4C4_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC[N+](C)(C)C""",21,"""DD8ACFD5B9DF1DDB"""
-"""C951CF2051A1EDEB_B961795C10A9C5E3_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCCCO""",21,"""DD8ACFD5B9DF1DDB"""
-"""4E54250E205FB101_CB1645CCA79DBFEB_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCOCCC""",21,"""DD8ACFD5B9DF1DDB"""
-"""8A2654832FF0BAC7_A157B77E7FEDCA16_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=NC=CS3""",21,"""DD8ACFD5B9DF1DDB"""
-"""8EA5FEC28C5C6A28_C0E91D7D00FAEB5E_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=NSC=C3""",21,"""DD8ACFD5B9DF1DDB"""
-"""B7665091A96EA433_7C70BE344743BC4A_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCCC#C""",21,"""DD8ACFD5B9DF1DDB"""
-"""4F127645FDB8948A_FB4F00E92C6AA48B_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(C)N(C)C""",21,"""DD8ACFD5B9DF1DDB"""
-"""C8A2071784BFC635_3918B9F21EAE7F74_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCC3CO3""",21,"""DD8ACFD5B9DF1DDB"""
-"""63FAB941957023FB_A561D1C80CBC2F25_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC3CCC3""",21,"""DD8ACFD5B9DF1DDB"""
-"""83043FB00683945E_D6B67F881A1CE9C6_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCNC3CC3""",21,"""DD8ACFD5B9DF1DDB"""
-"""F657E97E5B3BD059_C2FE6A859617FA37_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCN(CC)C""",21,"""DD8ACFD5B9DF1DDB"""
-"""75645F045B94733D_77B3FA70F3843232_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3OC3CC""",21,"""DD8ACFD5B9DF1DDB"""
-"""7DD80BF7DBB5CA1E_8B8B6FED57457DC5_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCC=CC""",21,"""DD8ACFD5B9DF1DDB"""
-"""E81435ED4D3B2895_56D03F3F3A469ABF_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=N[NH]C=N3""",21,"""DD8ACFD5B9DF1DDB"""
-"""EB043941B3B32277_FA515087F2917D38_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=CN=CO3""",21,"""DD8ACFD5B9DF1DDB"""
-"""8BBC59D5699302E7_6BAE93A46380ABC2_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(=O)C(Cl)Cl""",21,"""DD8ACFD5B9DF1DDB"""
-"""F532C1785231907E_29D3DAA9F6613379_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC([C@H](C)N)=O""",21,"""DD8ACFD5B9DF1DDB"""
-"""BAF92241487F9D8E_A6FB194528234122_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC[S](Cl)(=O)=O""",21,"""DD8ACFD5B9DF1DDB"""
-"""A2BD18CEE4B26023_CED345EBAB0CC687_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCSCC""",21,"""DD8ACFD5B9DF1DDB"""
-"""6063B7CB83501135_097BD8C68590A0C4_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(NOC)=O""",21,"""C48C1039567EC847"""
-"""19245B9372D15D36_B6FE517E77BD3BA2_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC(OC)=O""",21,"""C48C1039567EC847"""
-"""90DE7AC774D70DA2_33F90A5639061D13_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(OC)OC""",21,"""C48C1039567EC847"""
-"""C2F832CA895C1F70_790B6606B75898BC_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(C(O)=O)=O""",21,"""C48C1039567EC847"""
-"""8CA2B07DFAD47E2C_3C411E8FA52DB3C9_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCOC(C)C""",21,"""C48C1039567EC847"""
-"""F5E3D73A258C923F_BA764769E8D4A3D0_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3OCCO3""",21,"""C48C1039567EC847"""
-"""AB04B162296C7A3A_12E166C252EDAE27_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3CCCO3""",21,"""C48C1039567EC847"""
-"""BA535B76BAEDFB4E_221FECE44DFD75C3_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC(NC)=O""",21,"""C48C1039567EC847"""
-"""418914AF4039C29E_7FF8E8A02841FD93_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCN=C=O""",21,"""C48C1039567EC847"""
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-"""3ACE6BDACC9E6C82_A6F44C35CF331275_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(=O)C3CC3""",21,"""C48C1039567EC847"""
-"""3331C617A437BAD2_9579D4D204035885_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(CCC)=O""",21,"""C48C1039567EC847"""
-"""9231953BFF5EE899_1D0D927D99C4F511_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(C(C)C)=O""",21,"""C48C1039567EC847"""
-"""A75C7D2E257BA1EE_07A05A9E1570EF76_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCCOC""",21,"""C48C1039567EC847"""
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-"""3C8EF0465BCFAD79_17EFDC2D1913A086_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCOCC""",21,"""C48C1039567EC847"""
-"""7C6349DFA3D5FDF2_3C53D9866A0EF590_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCC(C)=O""",21,"""C48C1039567EC847"""
-"""C8BB56C796516189_FEE4BDCF271FBC45_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=NOC=N3""",21,"""C48C1039567EC847"""
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-"""2E78295817F47F43_8C56B9864946CED3_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)C[CH]=[C]3C[CH2]C3""",21,"""C48C1039567EC847"""
-"""4E9E377C7C5BDE95_8073E5AC0FD1D3AB_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(N(C)C)=O""",21,"""C48C1039567EC847"""
-"""D3768BD534705431_8E684D249FE5D816_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC#CCOC""",21,"""C48C1039567EC847"""
-"""750341C461E24CF9_3AAD554C8F8BBA97_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC(Cl)(Cl)Cl""",21,"""C48C1039567EC847"""
-"""CFFD76CDA9C41C18_A5D2B5031C897BDF_6039_DP""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCC(O)=O""",21,"""C48C1039567EC847"""
-"""6BA9F769FFEAB7AF_0AC627A7266DAF97_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=C[NH]C=N3""",21,"""C48C1039567EC847"""
-"""7B6F89A82A8CF39F_AD052BC715D71AE3_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC=CCC""",21,"""C48C1039567EC847"""
-"""2FD3AA5F688A87A5_C5F4CC76E89DCDD0_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCC(C)C""",21,"""C48C1039567EC847"""
-"""0AA9BF98388F9584_257971B70F41C0FE_6039_DP""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCOCCN""",21,"""C48C1039567EC847"""
-"""328B4C832B21CA1B_8DA7ABEA0408C93D_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC(NO)=O""",21,"""C48C1039567EC847"""
-"""4B3D61AEF38A8C75_079314C1B8E159FA_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=C[NH]N=C3""",21,"""C48C1039567EC847"""
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-"""37B25349DD7F7D78_CF3144B27B85F87F_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(COC)=O""",21,"""C48C1039567EC847"""
-"""7D9883A856EA24B3_5DE636907464B1F5_6039_DP""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC3CNC3""",21,"""C48C1039567EC847"""
-"""7D4BE89AF585DAFF_501CF7D0BB22CA13_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCCCF""",21,"""C48C1039567EC847"""
-"""907217890E712C5F_0E3B12D516BDD4EB_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCSC(C)C""",21,"""C48C1039567EC847"""
-"""D6413B8D7FECB7C8_4383F87DCA06B05E_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=C[NH]N=N3""",21,"""C48C1039567EC847"""
-"""FB3E799AF1134617_C802FAFCF7E782CA_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(OCC)=N""",21,"""C48C1039567EC847"""
-"""43EE7593CB44BEBA_125EB2FFC3D5B889_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=CC=N[NH]3""",21,"""C48C1039567EC847"""
-"""21A896749B2ABD70_5C8ED687AD6CD35B_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(C(C)=O)=O""",21,"""C48C1039567EC847"""
-"""31B1D194EDF9337D_44AECE5EC15B00B1_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=CN=NS3""",21,"""C48C1039567EC847"""
-"""5C0DF8A5FEF73625_7284C97CA604C5F0_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC[S](F)(=O)=O""",21,"""C48C1039567EC847"""
-"""7E9949C3B5EA6B78_FAFF391964D60E49_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)C[C@H]3CCCO3""",21,"""C48C1039567EC847"""
-"""0C0DE014AC223459_29AEFD8F29F0A3F1_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC[Si](C)(C)C""",21,"""C48C1039567EC847"""
-"""39981E38C429806B_94BFCD4DE1BAFF24_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(NCC)=O""",21,"""C48C1039567EC847"""
-"""BDC4CDF635F55AC2_33358B6A953C4A3A_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCOCC=C""",21,"""C48C1039567EC847"""
-"""BF33D05F2560092C_B765F10A1425C293_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=CSC=C3""",21,"""C48C1039567EC847"""
-"""807A0DBFE860C91C_A2A3E9036DF9F871_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=COC=C3""",21,"""C48C1039567EC847"""
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-"""93030FCE62E722A6_BFD07CC73278B5CF_6039_UN""","""O(CCOCCOCC=C)CC1=CSC(=N1)C2=CC=CO2""",21,"""C4BC6016E67B1F4B"""
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-"""C17FD7304F251402_AB6F4C6DD7FF3FF6_6039_UN""","""O(CCOCCOCC=C)CC(C1=CC(=C(C)C=C1)C)=O""",21,"""C4BC6016E67B1F4B"""
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-"""78FE2C22AD74ACAC_647C7354618E066B_6039_UN""","""O(CCOCCOCC=C)CCOC1=CC(=CC(=C1)C)C""",21,"""C4BC6016E67B1F4B"""
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-"""04E3010E6EFEBF3E_590C0F0F7E9825F2_6039_UN""","""O(CCOCCOCC=C)CC(NC1=NN=C(CC)S1)=O""",21,"""C4BC6016E67B1F4B"""
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-"""8329AE7026F4692F_F6F1FDBDE73BD825_6039_UN""","""O(CCOCCOCC=C)CC(CC1=C(F)C=CC=C1)=O""",21,"""C4BC6016E67B1F4B"""
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-"""559CEA83917CCA6E_79908DE2F8362D0A_6039_UN""","""O(CCOCCOCC=C)CC1=CC=C(C(F)(F)F)C=C1""",21,"""C4BC6016E67B1F4B"""
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-"""711B49B65C9E425D_C4924050EE3AEC43_6039_UN""","""O(CCOCCOCC=C)CC(NC(C)C1=CC=CO1)=O""",21,"""C4BC6016E67B1F4B"""
-"""41C602BBF9700F1E_296627CA8E52A92F_6039_UN""","""O(CCOCCOCC=C)CC1=COC(=N1)C2=CC=CS2""",21,"""C4BC6016E67B1F4B"""
-"""9D10717B274DAFEC_F7E5192CC2AD2DAF_6039_UN""","""O(CCOCCOCC=C)CC1=NC(=NO1)C2=CSC=C2""",21,"""C4BC6016E67B1F4B"""
-"""3A86755925FE4800_13638370817D9A49_6039_UN""","""O(CCOCCOCC=C)CC1=NOC(=N1)C2=CC=CS2""",21,"""C4BC6016E67B1F4B"""
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-"""575F1AB1E8887663_E9C98304008A818E_6039_UN""","""O(CCOCCOCC=C)CC(=O)C1=CN=C2[N]1C=CS2""",21,"""C4BC6016E67B1F4B"""
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-"""997E11465384DB4E_FFB22D6D81C9EF46_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOC1=CC=C(OCC)C=C1""",21,"""66E3F8A0D87DF815"""
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-"""293C59A3973C69DA_C2A91C3738D0F674_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(OC)C=CC(=C1)[N](=O)=O""",21,"""66E3F8A0D87DF815"""
-"""167203A0125C9FC3_12824A7EF4055B9D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=NO1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""0B0AF0BDF1A70915_F63CC5F2F299AE32_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=C(OC)C=C(C=C1)C)=O""",21,"""66E3F8A0D87DF815"""
-"""44858630212429DD_AA4695092C3EFAC2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NOC(=N1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
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-"""91879DFBFA1011D5_70E5C4BE4C9B66C7_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NC(=C1C=CC=CC1=N2)C""",21,"""66E3F8A0D87DF815"""
-"""9B04620C70F5725A_84B1F94E31261903_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CSC(=N1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""CB0C4C9D4D3BD553_575F2AC0C3A7DC5D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC=C(CC(N)=O)S1)=O""",21,"""66E3F8A0D87DF815"""
-"""166F5070CEE1E77B_9949C7160C74DD20_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NNC(=O)C1=CC=CS1""",21,"""66E3F8A0D87DF815"""
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-"""310B10DEC150865D_14EBF7800B215F66_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NCC(=O)N1CCCC1""",21,"""66E3F8A0D87DF815"""
-"""DFD57C2B6004EBC8_655A22B39FD7568E_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NC1=CC(=C(C=C1[NH]2)F)F""",21,"""66E3F8A0D87DF815"""
-"""9F819F7E60457701_CD070D48F8739144_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=C(OC)C=CC(=C1)F)=O""",21,"""66E3F8A0D87DF815"""
-"""8A34603B78E921C1_2BE1F350025A373F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCOC1=CC=C(OC)C=C1""",21,"""66E3F8A0D87DF815"""
-"""C679FB086CBBB895_02B7FF90C8B44902_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(CCCC)CCCC)=O""",21,"""66E3F8A0D87DF815"""
-"""BF979C8DFAA7155F_5239290D9AB65660_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(C1CCC(C)CC1)C)=O""",21,"""66E3F8A0D87DF815"""
-"""B3D8A3338B61B46A_0D50670C5ABF4EB0_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC(NC(COC)C)=O)=O""",21,"""66E3F8A0D87DF815"""
-"""33C26563358AAEE8_9996A05601478AE5_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=CC=N[N]1C(C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""93080278E975DECD_250291BE4EE852B6_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NOC(=C1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""BE0BB0CEEBB7A85A_8C625C8B443D9F92_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(C)CC1=CC=C(C)O1)=O""",21,"""66E3F8A0D87DF815"""
-"""84258B9F7EE7804D_C8E658AD4167FF96_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC(=NO1)C2=CN=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""19C58516114BAA83_6F5E4B1B3006B7E0_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCN1C(NC(C)(C)C1=O)=O""",21,"""66E3F8A0D87DF815"""
-"""7DD359306C5B84DE_A70C402AA7F72D61_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOC1=CC=CC(=C1)[N](=O)=O""",21,"""66E3F8A0D87DF815"""
-"""0A73F543C1DD2F3A_040561973B23D855_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOC1=C(OCC)C=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""F5222C23A2A4BA59_8A241971F3C1771B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOCCOC1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""599F75D48E62E4AB_885FDE6E25A7CB40_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=CC2=C1N=CC=C2)F""",21,"""66E3F8A0D87DF815"""
-"""B076C14B82AE5FC0_3C0887EF5A3219B1_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NOCC1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""A11549051A2AA998_76EA4B908A41A60F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C[N](N=C1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""D4AF64A9D7DC9C39_F69C1B408B37971B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC(NCC(F)(F)F)=O)=O""",21,"""66E3F8A0D87DF815"""
-"""7817016BA1403B5B_125FC4BBB908131F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=C([N](CC)C(=C1)C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""0564501D0C98BAA4_1F93B151FF950729_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NCC1=C(F)C=CC=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""A3AD638E8072089B_CB2893DA8E220B13_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=C(C)N=C1C=CC=CC1=N2""",21,"""66E3F8A0D87DF815"""
-"""0BA368AAC9E0EADD_B8D060DE35718BDF_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CN=C(S1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""0D9386EE8D918B5A_D8C27B45B35FFBB2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(C)C1CC[S](=O)(=O)C1)=O""",21,"""66E3F8A0D87DF815"""
-"""DA7EF84BCE9C503F_58FCBDD2238EDE58_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC=C(C(C)C)C=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""ED520B05CFB9A7B7_ED8FAC395567647C_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C(C#N)C1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""86DF10F6C3257413_DD2CFDA9876760A3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOC1=CC=C([N](=O)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""6551B43724763C48_F459B730A47934B0_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=CC(=CC(=C1)F)F)=O""",21,"""66E3F8A0D87DF815"""
-"""F99906F751F7BD76_0D91B2124A5D0603_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C1=CC2=C(C=C1)OCC2""",21,"""66E3F8A0D87DF815"""
-"""E6CEA86566C1DC5D_87E770D3A6C24DC3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCOCCC1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""C29F2F981E5D978D_4F6BFA2F6E9A11AB_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=C[N](C)C(=C1)C(=O)N)=O""",21,"""66E3F8A0D87DF815"""
-"""AB0245D83C2B37CD_C316B81FA1D6F7EE_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NC1=NN=C(O1)C2CC2""",21,"""66E3F8A0D87DF815"""
-"""2FE264204A4E98D6_6CE5232F1871CD25_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CSC(=N1)C2CCCCC2""",21,"""66E3F8A0D87DF815"""
-"""53CB4D94B3E029B5_D0D8B68AE6D29348_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CSC(=N1)C2=CC=C(C)O2""",21,"""66E3F8A0D87DF815"""
-"""B3BFC87D3FFA66BB_E408418A2B309C53_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CSC(=N1)CC(N(C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""F4D153809F34FED2_B9BA60DC1B222EA0_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NCC1=CC=CC(=C1)F)=O""",21,"""66E3F8A0D87DF815"""
-"""522A88C447CEB24E_24F4EE82AD6678A7_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(C)CC1CCCCC1)=O""",21,"""66E3F8A0D87DF815"""
-"""33D02C5DBAAECC67_0F963F5EEEBACC3A_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NCCC1CCCCC1""",21,"""66E3F8A0D87DF815"""
-"""8AA5A09DD2B0CC8F_A8629525B38C3FB4_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NCC1=CC=C(CC)S1)=O""",21,"""66E3F8A0D87DF815"""
-"""8E58F11CA9759A2F_F7E7DA1B1947AE24_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NC2=NC1=C(CCC1)S2""",21,"""66E3F8A0D87DF815"""
-"""FB58FEC9735A8E68_8995952528DAB3D7_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)N(C1CC1)C2CCCC2""",21,"""66E3F8A0D87DF815"""
-"""B44CC5B2EE34B468_C9D928F4FA91D6ED_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=CC=N[N]1CCC)=O""",21,"""66E3F8A0D87DF815"""
-"""FF6C5E1E98116481_7D292A3392A568B6_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NCC1CC[S](=O)(=O)C1""",21,"""66E3F8A0D87DF815"""
-"""7FAA06348E8D6FED_D5E292B4DA28535C_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=CC(=C1)C(N(C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""C6010637AC196605_63B6DE5B2923D9AB_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NC1=C(C=N[N]1C)C(N2)=O""",21,"""66E3F8A0D87DF815"""
-"""188BE01B54CA1CE3_F19F06BB4A609154_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=NC(=C(S1)C)CC)=O""",21,"""66E3F8A0D87DF815"""
-"""8C9605C0E024E597_D1DB6BB382692F40_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C([S](N(C)C)(=O)=O)O1""",21,"""66E3F8A0D87DF815"""
-"""89EF69A094D2440E_BD0FC49C2581D529_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=N[N](C=C1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""38672B76F3521A43_BF150D442F602E67_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1=CC=C([S](N)(=O)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""B0C976961349EA68_AB9E3FD7EFFD767B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NCCOCCC(C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""EA5093D955AA3844_0665D2088F44622D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C1=CC2=C(C=C1)CCC2""",21,"""66E3F8A0D87DF815"""
-"""D42E64621AD2B972_84461EE0DC1ECD91_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOC(=O)NC1=CN=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""DE8CE68BEFCC34CC_75D320D13A175133_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCN(CCCC)CCCC""",21,"""66E3F8A0D87DF815"""
-"""4654481A3FE07524_4C874E3BAD112CDF_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NCC1=C(ON=C1C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""192C358F99911ADC_23F906EBE71828E1_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC(=CO1)C(OC)=O)=O""",21,"""66E3F8A0D87DF815"""
-"""931BF4A625F42CCE_C59685AA7E7EB2D1_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NN=C(C1=C(C)C=CO1)O2""",21,"""66E3F8A0D87DF815"""
-"""483A207622FF4CC7_87527A7239360ED7_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CN=C(C=C1)[N]2C=NC=C2""",21,"""66E3F8A0D87DF815"""
-"""1F9075C6FFC8B968_BE7B1B3472BFED5D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C[N](N=N1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""588B67566ED8B68D_5AFDE1C1935122D0_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C)OC(=N1)C2=CSC=C2""",21,"""66E3F8A0D87DF815"""
-"""CDCA54FCE40748CA_E9DACD2E77B3A805_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1=CC2=C(C=C1)C=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""7ABCBD3465057D85_CC02943B61E58C08_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1SC(=NC1)N2CCOCC2""",21,"""66E3F8A0D87DF815"""
-"""DAFD4D1ECAC9F459_D8ACC5B097C3F968_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=C(C)OC(=C1)C(=O)O)=O""",21,"""66E3F8A0D87DF815"""
-"""0D9EC17CE6ABB427_B9AF3B966FB9545D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NCC(=O)C1=CC=CS1""",21,"""66E3F8A0D87DF815"""
-"""36D33276C4FD1CE8_CE304DE20C84CD33_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCOC1=CC=C(C=C1)C#N""",21,"""66E3F8A0D87DF815"""
-"""C3929102D3C32E66_F99960F72A882327_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NCC1=CC=CC(=C1)C)=O""",21,"""66E3F8A0D87DF815"""
-"""7AC288E67F01F83A_DEE9A09D074388F2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NOC(=N1)CCC(OC)=O""",21,"""66E3F8A0D87DF815"""
-"""B3A2A6941DB9331B_D4DF17E9D02B3437_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=NC2=C1C=CC=C2)C""",21,"""66E3F8A0D87DF815"""
-"""CFAD59967CE40759_2206588CAA2B906C_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=C(C(=C(C)S1)C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""F182DFF5F29223FE_F907F414108ABE90_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC(=C(C)C=C1F)F)=O""",21,"""66E3F8A0D87DF815"""
-"""B23999E1A09DB5AD_92C46CBD1D2EAEA5_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)N1CCN(CC1)CC#C""",21,"""66E3F8A0D87DF815"""
-"""73839EF3A8EB4F75_2FCE17E318306C33_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCN[S](C1=C[N](C)N=C1)(=O)=O""",21,"""66E3F8A0D87DF815"""
-"""D508ABA64B5EA3CD_8ACE4B21C32B70B8_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC=CC1=CC=CC(=C1)OC""",21,"""66E3F8A0D87DF815"""
-"""F878A02D4DEE293A_9295842A669BD750_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C=CC(=C1)OC)[N](=O)=O""",21,"""66E3F8A0D87DF815"""
-"""FDC5BE64A27B2B28_CF062E98FE1A575D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOCC1=CC=C(OC)C=C1""",21,"""66E3F8A0D87DF815"""
-"""6D13775E7C300212_8161B50C5DC88132_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C)OC(=N1)C2=CC=CO2""",21,"""66E3F8A0D87DF815"""
-"""2A9E4E742DD5F9D1_DD37A765F7AF932A_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOC1=CC=C(C=C1)CC#N""",21,"""66E3F8A0D87DF815"""
-"""FB5E4E2CCE3D2772_5E6F5ADEBE796514_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC(=C(C(=C1)C)F)C)=O""",21,"""66E3F8A0D87DF815"""
-"""6EB9EEA8AF548836_C3CDFDD2690F48BC_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NOC(=N1)C2=C(C)N=CS2""",21,"""66E3F8A0D87DF815"""
-"""3DECABA0581E96BC_EE435E60DE58DBB0_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=C(C(OC)=O)C=C1)F""",21,"""66E3F8A0D87DF815"""
-"""1942D2AFC2A0EDEA_13CC1D8E7AFC5053_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCN1C2=C(CCC1)C=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""F198FB374EEE65D6_7FAD1F5577B576ED_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCOC1=CC(=CC=C1)C#N""",21,"""66E3F8A0D87DF815"""
-"""DE1BCDF330F13675_105E6D3B1C755E1B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=NN=C(C(C)C)S1)=O""",21,"""66E3F8A0D87DF815"""
-"""2BAAA9E797E768C0_42024209B1F89E82_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C1=CSC2=C1C=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""639DEC03ABA7C9FC_804082628586CCE4_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=CC(=C1)[N](=O)=O)OC""",21,"""66E3F8A0D87DF815"""
-"""B9159B1D1DD10545_1CA8C40F5313A770_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1=C[N](CC(OC)=O)N=N1""",21,"""66E3F8A0D87DF815"""
-"""1AC42D986C3FD5F2_43EB52AA9AF8C507_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCC1=NN=C(C(F)(F)F)O1""",21,"""66E3F8A0D87DF815"""
-"""27AA36632B861B91_42956C51422C30E2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC(N(C)C1=CC=CC=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""839161CF1E0DF91F_0E855D4C34010CE5_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NC1(CCCCC1)C#N""",21,"""66E3F8A0D87DF815"""
-"""9EE8ECE05D4B43F6_4CA75FF01E4B1D71_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=CC=C(SC)C=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""5907C1AB278AB516_62CCD885552E26E1_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NN=C(O1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""A27D4A906CC9474E_4557F5B75E31FA39_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC(=NO1)C2=NC=CC=C2""",21,"""66E3F8A0D87DF815"""
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-"""89D253E5CD484A0B_01C1C05692576EF6_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NN=C(S1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""CD92A097E25CC3E6_BEE66DB2026A70E6_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=NC=C1)OCCOC""",21,"""66E3F8A0D87DF815"""
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-"""6F12D243EAFDC5D8_9055EB4A52BBE091_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=CC(=C(F)C=C1)F)=O""",21,"""66E3F8A0D87DF815"""
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-"""955AF101C44A11E9_D3C8184CADF0684C_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=NO1)C2=C[N](C)N=C2""",21,"""66E3F8A0D87DF815"""
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-"""085A1852F874D738_4F7A6ABF5A25FCD9_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(C(C)C(=O)O)C=C1""",21,"""66E3F8A0D87DF815"""
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-"""8C1797BFD93A8814_676F9482EB5A829C_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(C=C1)C2=CC=CS2""",21,"""66E3F8A0D87DF815"""
-"""BE70638EC114C301_F60B7DBB5E4FA851_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(C=C1)OCC2CC2""",21,"""66E3F8A0D87DF815"""
-"""99BDC9E7D73D913E_AB2D5626C4DCA09F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC=C[N]1C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
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-"""75343F67F94385AA_F0C04BD240C0355D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC(=CS1)C2CCCCC2""",21,"""66E3F8A0D87DF815"""
-"""9E1E6F3B6A60EF2B_D9F411B6782711A4_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCC2=NC1=C(C=CC=C1)[NH]2""",21,"""66E3F8A0D87DF815"""
-"""CCB15768C64099F2_E1218729316C4AAC_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCC1=N[N](C)C=C1C(=O)O""",21,"""66E3F8A0D87DF815"""
-"""48BCED768E22D5E3_004B8CD54C414ED6_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NN=N[N]1C2CCOCC2""",21,"""66E3F8A0D87DF815"""
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-"""9A077CA2251C9DD8_473A454A63507CBE_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC[S](=O)(=O)CC1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""21C25DF6B1453C37_5463C26716EDAC3F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C1(CC1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""107EAD0FDD0E7921_2558F11B20F21651_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC(=N[NH]1)C2=NC=NC=C2""",21,"""66E3F8A0D87DF815"""
-"""E61457FDD872D723_81A198F516FD6D5B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCB1OC(C)(C)C(O1)(C)C""",21,"""66E3F8A0D87DF815"""
-"""339F09476AFA775E_EB3971F8A6EF4C25_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC=C(CCC)C=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""5EE8A124476D76AD_538D2E3EAC81840D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(C(CC)(C)C)C=C1""",21,"""66E3F8A0D87DF815"""
-"""7ACCF359EBEF4FE1_B299D1BB7F4DA209_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=CC1=C(OC(F)(F)O1)C=C2""",21,"""66E3F8A0D87DF815"""
-"""9154C22BBA6919E3_9109C29B3984F563_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C(CC)(CC)C(=O)OC)=O""",21,"""66E3F8A0D87DF815"""
-"""7DE1D0AEF68B2B71_A996D5E8DEB249E1_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=CC(=C1)OCC(C)C""",21,"""66E3F8A0D87DF815"""
-"""7D8B7AB2A30BC5EB_EEF05A4107409508_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC(C1=CC=C(OC)C=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""D161779F3E5ED238_9D6916F0295F8B94_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N[C@H](C(OC)=O)C(C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""44593569105B8826_B1AB5075ED1F075B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CN=N[N]1C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""76ACB7D726537FE3_DCDB677648DE01E3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=N[NH]C(=C1C(OCC)=O)C""",21,"""66E3F8A0D87DF815"""
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-"""738B4C662F49D1E1_B581924481C3E638_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(CC)N=C(C=C1)C(C)C""",21,"""66E3F8A0D87DF815"""
-"""52034C79F9EDA68E_52B454E0903E7C6F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NCCC1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""BBCB73818B9902D3_97F8AFB028442EE2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=C(OC)C=CC=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""B0C6A9035A8C53DA_0F90B6F548F358E8_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C([S](CC)(=O)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""66E7F993E63095A6_816C346E28C89189_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NC1=CC=C(C=C1)C#N""",21,"""66E3F8A0D87DF815"""
-"""0E7D942575124AC0_80F1C122F515DACE_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C([N](=O)=O)C=CC=C1C#N""",21,"""66E3F8A0D87DF815"""
-"""B72900D63835090B_D59F318F6A99EF2A_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NN=N[N]1C2CCCCC2""",21,"""66E3F8A0D87DF815"""
-"""F50D95DA8A12F52B_2FC049400BECE147_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCN2N=C1C=CC=CN1C2=O""",21,"""66E3F8A0D87DF815"""
-"""9B3C458FAA6F4515_5EC7ED3EB69425A8_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=CC1=C([N](N=C1C)C)N=C2""",21,"""66E3F8A0D87DF815"""
-"""E88F9829F48A22D0_06A75D892C3A4683_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=C1N=CC=CC1=C(F)C=C2""",21,"""66E3F8A0D87DF815"""
-"""C5D0D44034400F7C_90B7520D004FDCF3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCOC1=C(C)C=CC=C1C""",21,"""66E3F8A0D87DF815"""
-"""6DDD276A2232EF3A_006898ECCE989E50_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=C(OCC)C=CC=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""D733F6EBD98FE04A_E498573A3118A396_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCOC1=CC(=C(C)C=C1)C""",21,"""66E3F8A0D87DF815"""
-"""6A77F3113ACA5B22_B54731B783809FAE_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(C)CC1=C[N](N=C1)C)=O""",21,"""66E3F8A0D87DF815"""
-"""51B97292BA354BF1_7C81BE0E69A36A67_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(C(C)C)CC(F)(F)F)=O""",21,"""66E3F8A0D87DF815"""
-"""62F0CD33C557B1C2_5A54EC2ADF924530_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC(CCCCCC)C)=O""",21,"""66E3F8A0D87DF815"""
-"""0FB77A70D8C28970_638B96F321F10A3A_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CN=C(C(OCC)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""DC5686E25CE62C37_E665B55D044DD549_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C(C)(C)C1=CC=CC=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""68553E922EA77CD1_D8B5E66BB9A71EF9_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(OC)C=C(C=C1)[N](=O)=O""",21,"""66E3F8A0D87DF815"""
-"""29FE4FFFBEDF59A8_5258FFDC02164FF1_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(C=C1)N2CCCC2""",21,"""66E3F8A0D87DF815"""
-"""953B4352D22E8938_C06D4F43EA600991_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC=C(C(OC)=O)O1)=O""",21,"""66E3F8A0D87DF815"""
-"""B05F24E9CEC55CF6_E3BE88DBB8A3BC37_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C(C1=NC(=CS1)C)C#N)=O""",21,"""66E3F8A0D87DF815"""
-"""B667B9292CA146BC_C6A4433D4A4A509A_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC2=C(C=C1)OC(C)(C)C2""",21,"""66E3F8A0D87DF815"""
-"""C0E993426F10F917_BF97E3D2D9DDC31D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NC1=NC(=NO1)C2CC2""",21,"""66E3F8A0D87DF815"""
-"""221B36B951551E09_01900738B744B223_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC(NC1=C(F)C=CC=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""CDAD47DAA00B3794_87A13D980F856195_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(C=C1)[N]2C=CC=N2""",21,"""66E3F8A0D87DF815"""
-"""489D4EC3899FFD11_80AD9FE6E8E4FD18_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC(=NO1)C2=NC=NC=C2""",21,"""66E3F8A0D87DF815"""
-"""8D0D30AD2011EF16_DEDD25210006BD24_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CSC(=N1)C2=NC=CC=N2""",21,"""66E3F8A0D87DF815"""
-"""47A0A46833198374_7E7D32BA8D3509F7_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(C(C)C)C1CCCC1)=O""",21,"""66E3F8A0D87DF815"""
-"""F4848E4B9D2D016A_D31D886DF635EA7B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NCC(NC(C)(C)C)=O)=O""",21,"""66E3F8A0D87DF815"""
-"""1FD23222454B7551_E190D87752A3AE98_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCCCCCCCC(O)=O""",21,"""66E3F8A0D87DF815"""
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-"""DA41AEDD56F9FB48_C89C587088C76112_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C(=C(F)C(=C1F)F)F)F""",21,"""66E3F8A0D87DF815"""
-"""C780249A5E5C8CBE_A99F6F0DBE7439E4_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC=C(C(OCC)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""2CFD100CFDB5AB95_3AC3AE0B165CC2BB_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC(=C(C=C1F)F)C)=O""",21,"""66E3F8A0D87DF815"""
-"""E117DCEB748EF74C_A72EEE2C8C90D5FC_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C(OC)=O)C=CN=C1F""",21,"""66E3F8A0D87DF815"""
-"""42BF7DAFBBFC5A94_050DDA1E36D83880_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C=C(C(OC)=O)C=C1)F""",21,"""66E3F8A0D87DF815"""
-"""FEC5BC712F612051_8C785E41F4070AAA_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NC1=C(C=CC=C1)NC2=O""",21,"""66E3F8A0D87DF815"""
-"""7455E712EAA3E226_06D295DF86015AE2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOC1=C([N](=O)=O)C=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""C1D3659E4980ABD1_5B6BAE0E02DB4CCD_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NOC(=N1)C2CCOCC2""",21,"""66E3F8A0D87DF815"""
-"""EDE285C334DF7786_7930C1ECA404E7EB_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC(=CS1)C2=CN=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""75E987F3ADC3328A_5E400BED307EA0AC_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)CC1=CC=C(C=C1)C#N""",21,"""66E3F8A0D87DF815"""
-"""F07B98A9C31D6482_9A678DDC10298764_6039_DP""","""O(C(CC(=O)O)C(=O)O)CC(N[C@@H]([C@H](CC)C)C(=O)O)=O""",21,"""66E3F8A0D87DF815"""
-"""ADB417A9DA5AAA8E_5C568BD97D19D8A9_6039_DP""","""O(C(CC(=O)O)C(=O)O)CC(N[C@H](CC(C)C)C(=O)O)=O""",21,"""66E3F8A0D87DF815"""
-"""750727AAEE7E1EC3_C8D14F6D17DBC28F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=CC1=C(C=CC(=C1)C)N=C2""",21,"""66E3F8A0D87DF815"""
-"""66519D3DE7769577_C4AF13ACCB596B4B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=C(F)C=CC=C1F)=O""",21,"""66E3F8A0D87DF815"""
-"""626937EBDD37FC33_A95987ABC1EC7E6B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=CC(=C1)OC(F)(F)F""",21,"""66E3F8A0D87DF815"""
-"""B47E915BB6EBB143_1A641B1830230933_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC=CC1=CN=CC(=C1)OC""",21,"""66E3F8A0D87DF815"""
-"""752A6A6084F1B238_BE3216FF312243E4_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOC(CC)C1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""0927DB6BD5BDE57D_E70C37AE70133928_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C([S](N(C)C)(=O)=O)S1""",21,"""66E3F8A0D87DF815"""
-"""447C1C4D29C41E57_A473A10AE3E9D52F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C([N](=O)=O)C=C(C=C1)C#N""",21,"""66E3F8A0D87DF815"""
-"""086F2004EC7EE528_E73543A185012029_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(OC)C=CC(=C1)C(C)C""",21,"""66E3F8A0D87DF815"""
-"""C6EA95F6B16D8418_FFD79B848B812FD5_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CN=C([N]1C)SC(F)(F)F""",21,"""66E3F8A0D87DF815"""
-"""0ABFD60FB8C17E2F_D622AA611384099B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(OC(F)F)C=CC(=C1)F""",21,"""66E3F8A0D87DF815"""
-"""51106DB429EDFE28_811889CB017611D2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(C[S](C)(=O)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""3C205B4A41656E05_9A296DAA76D4EA66_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(OC(F)F)C(=CC=C1)F""",21,"""66E3F8A0D87DF815"""
-"""B9DC04359B352340_8F92E0263D1FA6C3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=CC2=C1OC(F)(F)O2""",21,"""66E3F8A0D87DF815"""
-"""DDDB4E79269A2E96_EFE0ACB46A9D57DA_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOCCN1C(=O)CSC1=O""",21,"""66E3F8A0D87DF815"""
-"""212B61D1FC33ACD6_10B8FF33BE0A0BD3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2CN=C(C1=C[N](C)N=C1)O2""",21,"""66E3F8A0D87DF815"""
-"""7B6D3D36DFF67123_5FDC3D7B26C13B27_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(COC1=CC=C(F)C=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""7325E2A2A2398210_D2A950CF0FBDB019_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NC1=C(C=CC=C1)C(=O)N2""",21,"""66E3F8A0D87DF815"""
-"""EF12BBFDF2D44D23_3E3B354274B86888_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC(=NO1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""AA13BC3FE18A7089_A6CCD3345C1BB462_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C([S](NC)(=O)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""2B06D03572186CA1_3666AFABC3A24CE9_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NN=C(O1)C2CCCOC2""",21,"""66E3F8A0D87DF815"""
-"""8C56324F6F71D6C0_230E3F76203BBEE0_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N[C@H](C)C1=CC=CC=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""4F22209EFB63BF76_B9567FA8957D3911_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CN=C(O1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""5D56C85559A7B44C_AB5EDEFE26EAEFC5_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(CCNC(C(F)(F)F)=O)=O""",21,"""66E3F8A0D87DF815"""
-"""06146DE8197ADEBD_BE56F6E22F64C4F4_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(CCC)CC(F)(F)F)=O""",21,"""66E3F8A0D87DF815"""
-"""D5E679C160C6B2F9_247D5D635A265E30_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC=C(C(OC)=O)S1)=O""",21,"""66E3F8A0D87DF815"""
-"""A110AEDE29F7AC54_EF62D89D145C2215_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCN(C)CC1=CC=C(C=C1)F""",21,"""66E3F8A0D87DF815"""
-"""5C67C87FC123DD97_7C829C9A781225D7_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=CC1=C(OC(N1C)=O)C=C2""",21,"""66E3F8A0D87DF815"""
-"""632A426BAFFE2DF7_76A1C7AF70223007_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=CC(=N1)C(OCC)=O""",21,"""66E3F8A0D87DF815"""
-"""FC414EB1C9C23321_BB8289FB543C6BB9_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=COC(=N1)C2=NC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""FECCD6CBE6A2EDEF_55C3B8E8BF010451_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=COC(=N1)C2=CC=NC=C2""",21,"""66E3F8A0D87DF815"""
-"""1569031C9A3C6BB7_D1A6436CAFCF2117_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC(=NO1)C2=CN=C[N]2C""",21,"""66E3F8A0D87DF815"""
-"""5A517A40444F9D3B_0336C6ADDDDF4D6B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NC1=C(COCC1)C(=O)N2""",21,"""66E3F8A0D87DF815"""
-"""393E4A75E6BA71BB_0B635EE93E70DD11_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CNC(=O)C2=C1C=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""44C5050E447062FC_45502012AF7B8FE5_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NOC2=C1CC(C)(C)CC2""",21,"""66E3F8A0D87DF815"""
-"""B31BC9B020A288F3_D3E5B617C19B1F16_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CSC(=N1)C2=N[N](C)C=C2""",21,"""66E3F8A0D87DF815"""
-"""BD3FBB32FA737E10_25CA556B9CAECA3C_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NN=C2[N]1C=CN(C)C2=O""",21,"""66E3F8A0D87DF815"""
-"""0A6467D9D79BFE23_9952682D90B6C93C_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2CCC1(CCOCC1)CO2""",21,"""66E3F8A0D87DF815"""
-"""9E43179C4B858B49_9BF9186AA90CD65D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2OC1=C(C=C(OC)C=C1)C2""",21,"""66E3F8A0D87DF815"""
-"""30E3BC1F569E8781_C9AB4ACCDD36AC9B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=CC=CC(=C1)CC)=O""",21,"""66E3F8A0D87DF815"""
-"""A089300A53FA5D6A_20B2B6AEB8942154_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=CC=CC(=C1)SC)=O""",21,"""66E3F8A0D87DF815"""
-"""6642849D914F7774_B007BBA43462AE56_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCC[S](NC(C)(C)C)(=O)=O""",21,"""66E3F8A0D87DF815"""
-"""62856DFF4518F49B_F15B8FD348BE4846_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(C(N(C)C)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""3937958DDBE89921_1DC17DD5CF729797_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N1CC(C)OC(C1)(C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""564DFA7E232D7F65_AD2701099CA023AB_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC=CC(=C1)[N](=O)=O)=O""",21,"""66E3F8A0D87DF815"""
-"""24566BE8C891471F_6589EE7494AE8701_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1CCC(O1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""C0C9A930C6FD179A_059F1CDC9271E7C6_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C[N]2C(=N1)N=C(C)C=C2C""",21,"""66E3F8A0D87DF815"""
-"""1BD57BDAC9B7629A_E29BBB4CF20C6D4D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=C(C)C=CC=C1C)=O""",21,"""66E3F8A0D87DF815"""
-"""CCAF90A1B0082F80_FF13BA375EDFB141_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C(=C(C)C(=C1C)C)C)C""",21,"""66E3F8A0D87DF815"""
-"""B6EBD1D12EAD3646_53CA5285D7E4CAEB_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(OC)C=CC(=C1)C(=O)C""",21,"""66E3F8A0D87DF815"""
-"""71B0057D8BEBCBAD_BDD440BF650ACACA_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NC1=C(C=CC=C1)C#N""",21,"""66E3F8A0D87DF815"""
-"""825198EB5F684B8C_367334532E197EC3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=CC=C(CC)C=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""9ED0D1C996885099_F3F872F04025E822_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(CC)C1CCCCC1)=O""",21,"""66E3F8A0D87DF815"""
-"""925C7446A868D41C_47733026075F9128_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(CC)C1=CC=CC=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""92BD1652F3172262_BECEE628F68D6448_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N1CCC(C(O)=O)CC1)=O""",21,"""66E3F8A0D87DF815"""
-"""6B40806AC9CE3FA2_89068983531F8993_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC2C1CC3CC(C1)CC2C3""",21,"""66E3F8A0D87DF815"""
-"""BE61C09483EE9771_3A6AEBFEE0C08598_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOC1=CC2=C(C=C1)OCO2""",21,"""66E3F8A0D87DF815"""
-"""01BADEFC1B990E91_81C5BB0C421DBC68_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1=CC=CC(=C1)C(F)(F)F""",21,"""66E3F8A0D87DF815"""
-"""33F9966EA9FB1D66_15694AB2AE0B877D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1=CC=C(C(F)(F)F)C=C1""",21,"""66E3F8A0D87DF815"""
-"""342068E575172847_1AC1B7827D6A6B74_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NC1=C(C=CC(=C1)OC)[NH]2""",21,"""66E3F8A0D87DF815"""
-"""AFC725F24A7FBF5C_D82FFF96D2061EE2_6039_DP""","""O(C(CC(=O)O)C(=O)O)CC1OC(CC12CCNCC2)=O""",21,"""66E3F8A0D87DF815"""
-"""E619AE14404CBB4D_FB889C2B9E3859D1_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1OC(=O)CC12CCOCC2""",21,"""66E3F8A0D87DF815"""
-"""D1127636E227E784_7313DBB80318E49A_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NC1=CC=C(C=C1)C#C""",21,"""66E3F8A0D87DF815"""
-"""CF150E89A93A440D_0FAE840BBC5AC8A4_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C)C=CC(=C1)[S](=O)(=O)F""",21,"""66E3F8A0D87DF815"""
-"""1BC7C255DD146882_ADBCECF35D86A0C4_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCCCCCCCC1CC1""",21,"""66E3F8A0D87DF815"""
-"""45CA1F3927C60AF0_221AAA25607B340A_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C)C=CC(=C1)[S](=O)(=O)Cl""",21,"""66E3F8A0D87DF815"""
-"""600EA8DA1815B572_3B140444F931A18B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2CCC1(CCCCCC1)O2""",21,"""66E3F8A0D87DF815"""
-"""12EF7CE0C8228700_0CDCA11527BAF9BA_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)CCCC1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""C9FB7C669E0DC8AA_9927E13EAC82E2EA_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=C(OC)C=C1)C(=O)C""",21,"""66E3F8A0D87DF815"""
-"""BB0A2E9D90959B07_1C31CC6940ADFBA2_6039_UN""","""O(C(CC(=O)O)C(=O)O)C[C@@H]1CCC[C@@H](C(OCC)=O)O1""",21,"""66E3F8A0D87DF815"""
-"""D80DAE51AFE3496A_3D63925D6F2F2E45_6039_DP""","""O(C(CC(=O)O)C(=O)O)CC2CCC1(CCNCC1)CO2""",21,"""66E3F8A0D87DF815"""
-"""91C4F1AEFD327CD1_F90D23E9994E7FE2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=N[N](C=C1)C2CCCCC2""",21,"""66E3F8A0D87DF815"""
-"""D9BDDCD4C5D8C4C1_BD212741A003D12B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CSC(=N1)COCC(F)F""",21,"""66E3F8A0D87DF815"""
-"""7718D3A0509F4FD7_5185B418C394578D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CSC(=N1)C(C)(C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""7EA0EEF9099F628E_1197E50411ACCDE3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2CC1(CCOCC1)C(=O)N2""",21,"""66E3F8A0D87DF815"""
-"""8786C7B5CE102FD5_B4FC62205006336A_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NC(=O)C1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""34A4C173CDC0193A_DF67719347F7B6F0_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NCCC[N]1C=CC=N1""",21,"""66E3F8A0D87DF815"""
-"""3C3E94E083581AF1_142531DFFC08A779_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=C(C=C1)[N](=O)=O)OC""",21,"""66E3F8A0D87DF815"""
-"""00584569E7ECF1E0_805E9376AB7C7535_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(N[S](C)(=O)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""83240FEB66C50688_0BA590CB9857C0C2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NN=N[N]1C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""9E69D9F5C6DDCB48_A27D8D854B80E2CB_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC=C(S1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""19279FA154A793BE_D6711BAAEF1805F6_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=C(OC)C=CC(=C1)C)=O""",21,"""66E3F8A0D87DF815"""
-"""B70CBD43BCACC3CC_3C3B6017F66FBF24_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)N1CCOCC1C2CC2""",21,"""66E3F8A0D87DF815"""
-"""79DE5A427D6AC1AF_6226A6C87CAB04D3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C2=CC1=C(C=CC=C1)O2""",21,"""66E3F8A0D87DF815"""
-"""C1EA8C81925F93EB_84E938D827D77829_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOC1=C(C(C)=O)C=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""5CEA33E7F341994F_EF90810638CF9D24_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC=NNC(=O)C1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""A17A4DAFD56B749C_479BF21CBC9B7602_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=CC=CC(=C1)OC)=O""",21,"""66E3F8A0D87DF815"""
-"""5DF2244E17371980_0A3BA287BDEB9C2D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC(=O)NC1=C(C=CS1)C#N""",21,"""66E3F8A0D87DF815"""
-"""A77554169452271D_588595B1553CC188_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(CCCC)C(C)CC)=O""",21,"""66E3F8A0D87DF815"""
-"""39A862974EA1B628_9B1FAE516DADD353_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NCCCC(OCC)=O)=O""",21,"""66E3F8A0D87DF815"""
-"""EE606719F1150018_9E0E1F070A5DB6ED_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(C=C1)[N]2C=NC=C2""",21,"""66E3F8A0D87DF815"""
-"""C0E40C18C0659096_EE3B0F32EC1ADBAB_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(OC(F)(F)F)C=C1""",21,"""66E3F8A0D87DF815"""
-"""F880B5AF3224DD67_2DE197E34D7915FA_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCOC1=C(C=CC(=C1)C)C""",21,"""66E3F8A0D87DF815"""
-"""BC40771DED9C928B_A0DBE12369F6AB31_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NCC1=C(C)C=CC=C1)=O""",21,"""66E3F8A0D87DF815"""
-"""CD8D788E9B6705FE_25A63A72FFE1FB40_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=C(C(OC)=O)C=C1)C""",21,"""66E3F8A0D87DF815"""
-"""8DDA0FF1CAF5C179_FC8569D7BE9DB8E7_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=N[N](C(=C1[S](=O)(=O)N)C)C""",21,"""66E3F8A0D87DF815"""
-"""D928EF77682F3F35_25789D6AF19AD718_6039_DP""","""O(C(CC(=O)O)C(=O)O)C[C@@H]1C[C@](OC)(CN1)C(F)(F)F""",21,"""66E3F8A0D87DF815"""
-"""B23891C063909D00_D963EC01B26F8D78_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(NC1=C([N](N=C1C)C)C)=O""",21,"""66E3F8A0D87DF815"""
-"""A3AE9D9B560302F0_F715187603983EB2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NN=C(O1)C2CCOCC2""",21,"""66E3F8A0D87DF815"""
-"""C1AC4806E5A03479_3F085CC008461816_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC(C(F)F)N1CCOCC1""",21,"""66E3F8A0D87DF815"""
-"""B09A7E61D6880509_4CC16EE375E7C49F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(CCOC)CCOC)=O""",21,"""66E3F8A0D87DF815"""
-"""BBD30CF05465A279_11C32B0970D91C10_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NOC(=N1)N2CCOCC2""",21,"""66E3F8A0D87DF815"""
-"""71257CC75D5DC030_04B52BEBD9B11A33_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(C=C1)C2CCCC2""",21,"""66E3F8A0D87DF815"""
-"""2BC2FE1759190D9E_704741FF590809E6_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC(=NS1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""EAC89759CB0750A4_AD016E472C6181D5_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=CC(=C1)OC(C)=O)C""",21,"""66E3F8A0D87DF815"""
-"""9EB9017DA36F507B_1A89BE62D099A99F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=CC=C1)OCC2CC2""",21,"""66E3F8A0D87DF815"""
-"""3D0F394C9FCD48D4_8456FC53085C0309_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NC1=C(CCCC1)C(=O)N2""",21,"""66E3F8A0D87DF815"""
-"""730D67EBEA41B144_06F7B01A1829CB23_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C2=CC1=C(C=CC=C1)[NH]2""",21,"""66E3F8A0D87DF815"""
-"""A409B35C2B7715C9_58E7446B131A0FC2_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NC1=C(CC(C)(CC1)C)S2""",21,"""66E3F8A0D87DF815"""
-"""7B753DE907CFA92F_69757FC94AAD8943_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C1=CN=C2N=CC=C[N]12""",21,"""66E3F8A0D87DF815"""
-"""DFDC3D4EA14BE180_60D418A36D81CADB_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=C[N](C)N=C1C(F)F)=O""",21,"""66E3F8A0D87DF815"""
-"""51989EED303A7C29_CB20BA6467A104C7_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C2=CC1=C(C=CC=C1)S2""",21,"""66E3F8A0D87DF815"""
-"""CE096E263889EBCA_DFC4AA6605C1789B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C1=CN=C2[N]1C=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""8C55520FC12DB60C_A7D736C898AB579E_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NN=C([N]1C)C2=CC=CS2""",21,"""66E3F8A0D87DF815"""
-"""F94C549515A49CE0_96A29702141B79F3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)C1=CC2=C(C=C1)OCO2""",21,"""66E3F8A0D87DF815"""
-"""7E41B60C4FF91861_33C3FE54046F46A6_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=C(C(OC)=O)N=C1)F""",21,"""66E3F8A0D87DF815"""
-"""1F912F38642CDAEA_8D70E90E1A041F6B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CSC(=C1)C(OC)=O)=O""",21,"""66E3F8A0D87DF815"""
-"""AF1DB82C97215B9E_8722F23EEB186D15_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=CC2=C1OC(C)(C)C2""",21,"""66E3F8A0D87DF815"""
-"""3975608B939F8E94_484FFF4D54AF47E9_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=C(C=C1)C)C(OC)=O""",21,"""66E3F8A0D87DF815"""
-"""374A66A9C62CD470_78A5E1FD8089B84E_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NC=N[N]1C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""3FDAE37F857B0E7D_6B7A41A3076E15AA_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC2=NC1=C(C=C(OC)C=C1)S2""",21,"""66E3F8A0D87DF815"""
-"""D94F13D402CE6B49_FE6DCC8C5CBE1A61_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC(C)OCC1=CC=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""F72C791988BE9F3B_12878673E7478407_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=NN=C[N]1C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""73206311BDE2DB70_5D7480A4B4978786_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(OC(F)(F)F)C=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""144D502A2B4F0BAD_EE8953FF147B98FA_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC(=C(C=C1)C#N)F)=O""",21,"""66E3F8A0D87DF815"""
-"""684441FF28738033_9A577BE1D5ADB641_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=CC(=C1F)C(F)(F)F""",21,"""66E3F8A0D87DF815"""
-"""A36CF5BBF17D3726_A9746C6B96062D06_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=CC(=C1)C(F)(F)F)F""",21,"""66E3F8A0D87DF815"""
-"""6D7067128194A95D_0FDC15B282C3CDA3_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C=CC(=C1)F)C(F)(F)F""",21,"""66E3F8A0D87DF815"""
-"""727ABAB9BC85B0F9_4CAA9B3C0B180D02_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1=CC=C(NC(C)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""64FF15982B0DF500_D71781ACA0248956_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC(=C(F)C=C1)C(F)(F)F""",21,"""66E3F8A0D87DF815"""
-"""7AFF78A0742D190E_70F151590A0384D0_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1=CC(=C(OC)C=C1)OC""",21,"""66E3F8A0D87DF815"""
-"""97658078B41E9267_D7383C05FE8FDB0B_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CC=C(O[S](F)(=O)=O)C=C1""",21,"""66E3F8A0D87DF815"""
-"""FAF013BABC585615_0E05AC3E80F930BD_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1=CC=CC(=C1)NC(C)=O""",21,"""66E3F8A0D87DF815"""
-"""F288DF9A0CA5F769_F3B54DE51393E622_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C)C=C(C=C1)C(F)(F)F""",21,"""66E3F8A0D87DF815"""
-"""0F8247FD73545BB1_C237881CA1E28E1A_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1=C(C(F)(F)F)C=CC=C1""",21,"""66E3F8A0D87DF815"""
-"""CE0A55A0921D0A9E_F7A951942E8B5F02_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1=C[N](C)C2=C1C=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""4F1848C6F8C32B02_B5A3CB3F04D68136_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)NCCCCCN=[N]#N""",21,"""66E3F8A0D87DF815"""
-"""DEB26D1EF5627033_D76591267E88B6E9_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC1CCCC(C(F)(F)F)C1""",21,"""66E3F8A0D87DF815"""
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-"""101631D14024AD1E_663245716643CA76_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=N[N](N=C1)C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""43EAE7AE6FC9ADF0_161DFBDFD0A82318_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC[N]1N=C(C)C(=C1C)C(=O)O""",21,"""66E3F8A0D87DF815"""
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-"""EF1264E86630724F_B91A12FDD6707993_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=C(C=C([N](=O)=O)C=C1F)F""",21,"""66E3F8A0D87DF815"""
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-"""6D299301A335FA91_3C3E9455D4576B66_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=CSC(=N1)C2=NC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""10DE4575E819ACC3_7C2AC9BD638DE80F_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1=N[N](C(=C1[S](=O)(=O)Cl)C)C""",21,"""66E3F8A0D87DF815"""
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-"""D40FE9AA70B30368_68142E09062BCD8E_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N(C)C1=CC=C(C=C1)C)=O""",21,"""66E3F8A0D87DF815"""
-"""BE58450420A9F53D_D843902DDCD57F0D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2""",21,"""66E3F8A0D87DF815"""
-"""E27F4F7BEEB5A491_612393239C6BF2C5_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCCCCCCCCN=[N]#N""",21,"""66E3F8A0D87DF815"""
-"""92B0EA5C15518BAB_69AACF60A205AB88_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=CC=C(C(N)=O)C=C2""",21,"""DBDE9615DC7CD085"""
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-"""1CCE6C110B96259D_E3524C146A96FBA3_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(N2C(C=C(C)O2)=O)=O""",21,"""DBDE9615DC7CD085"""
-"""098BE04CAA63D655_0AE2CB6679DC4385_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(NC2=CC(=NO2)C)=O""",21,"""DBDE9615DC7CD085"""
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-"""1B7141FA27554C9D_983E80ED7C47306D_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C(OCC)C=CC=C2""",21,"""DBDE9615DC7CD085"""
-"""2E1E7E7695E02284_6FC2534FA69DC343_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCCCCCCCCC""",21,"""DBDE9615DC7CD085"""
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-"""BD3A8CAFC6B066F7_4DAC9E32F060DBF0_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C(OC)C=CC(=C2)C""",21,"""DBDE9615DC7CD085"""
-"""C30F7C507D03D77C_1A0EE2A16CAE8CC2_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(=O)NC(=O)NCC=C""",21,"""DBDE9615DC7CD085"""
-"""15C974A401C52516_222D0022B3DE5E9B_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(C2=CC=C(C)C=C2)=O""",21,"""DBDE9615DC7CD085"""
-"""5D3390E872CD98A3_96E9B95CD95DBDCD_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(NC2=NOC(=C2)C)=O""",21,"""DBDE9615DC7CD085"""
-"""D366A5BCE6D35BF6_4A027EADE144C8DD_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCC(=O)NC2CCCC2""",21,"""DBDE9615DC7CD085"""
-"""8B130A120A23F9E7_C595747DF1C531B8_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(N(CCC)CCC)=O""",21,"""DBDE9615DC7CD085"""
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-"""F833C7A6A24F059E_569204EFCC834D32_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCCC[N]2C=CN=C2C""",21,"""DBDE9615DC7CD085"""
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-"""7FE48B77CBE34287_9E5372D5A2186B40_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(=O)NC2=CN=CC=C2""",21,"""DBDE9615DC7CD085"""
-"""37027CB566CAB21F_CE001AD840166A38_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=CC=CC(=N2)N(C)C""",21,"""DBDE9615DC7CD085"""
-"""5CDA1BD30723AACD_63D4376409F71C74_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=NN=C(C)[N]2C3CC3""",21,"""DBDE9615DC7CD085"""
-"""09100E1E70168BAB_F1C58D8F4D03AC6D_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC3=CC2=C(C=CC=C2)S3""",21,"""DBDE9615DC7CD085"""
-"""07C05E79288C110D_C89BDD437816F628_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCN2CC3CCC(C2)O3""",21,"""DBDE9615DC7CD085"""
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-"""A47DD7552D4CEF44_C4667A533CB4B398_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=NOC(=N2)C(F)(F)F""",21,"""DBDE9615DC7CD085"""
-"""844C3E639AF410D8_B29E26FA73A8E4F4_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=CC=CC(=N2)C(C)C""",21,"""DBDE9615DC7CD085"""
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-"""533CD77D3D1BE894_C63B3D0040A4F689_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=CC(=C(OC)C=C2)C""",21,"""DBDE9615DC7CD085"""
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-"""0887132F522C73B9_224348B7C9DF92C2_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C([N](=O)=O)C=CC=C2""",21,"""DBDE9615DC7CD085"""
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-"""2324E6A4FC747EEA_509F12BC14F785F6_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C(N=C(CCC)O2)C""",21,"""DBDE9615DC7CD085"""
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-"""D07D3CAC4DC98008_BB88E66E80BB30FA_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(C2=C(ON=C2C)C)=O""",21,"""DBDE9615DC7CD085"""
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-"""EF27B60039C29E52_FF5694C6C6A98078_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCCN2CCN(C)CC2""",21,"""DBDE9615DC7CD085"""
-"""1151B2012CB18539_7A5FAD6ABC8F4F08_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCNC(NC(C)(C)C)=O""",21,"""DBDE9615DC7CD085"""
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-"""2FFC899B7BAE0E4A_23EEA393442F8021_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=NN=C(O2)C3CCC3""",21,"""DBDE9615DC7CD085"""
-"""ADE891848DAA750B_E975B07B92563F68_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCC(=O)C2=CC=CC=C2""",21,"""DBDE9615DC7CD085"""
-"""3107EA88FFD06483_52A2D45D526A965B_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=CSC3=NCCCN23""",21,"""DBDE9615DC7CD085"""
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-"""29F06D5C5EA26247_D831CCF93B4F0586_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=CC3=C(C=C2)[NH]C=N3""",21,"""DBDE9615DC7CD085"""
-"""046C6FDA412E3EA5_D99A7EAF036EB6E3_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCOC2=CC=C(F)C=C2""",21,"""DBDE9615DC7CD085"""
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-"""215C35FA8C6BE96B_654EC035E30CE2F9_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(=O)NC2CCCCC2""",21,"""DBDE9615DC7CD085"""
-"""C0241652FC014C64_B0ADDBEBC11E24B6_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCOC2=C(F)C=CC=C2""",21,"""DBDE9615DC7CD085"""
-"""2EEFA5A5104B5C78_3400BA25E1E49660_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCOC2=CC=CC(=C2)C""",21,"""DBDE9615DC7CD085"""
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-"""238D4E0CA1C8B45E_188A35AA26B969C4_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=NC(=CO2)C(C)(C)C""",21,"""DBDE9615DC7CD085"""
-"""F691FBB69A1C5788_4B5F7CC06D076538_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C[N](C(C)C)N=C2C""",21,"""DBDE9615DC7CD085"""
-"""383AEF4FB84BF9DE_6E00A577081A63A7_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC3CCCC2(CCC2)O3""",21,"""DBDE9615DC7CD085"""
-"""4BA8F35D83C40C18_7E51E9973500D5B7_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=NOC3=C2COCC3""",21,"""DBDE9615DC7CD085"""
-"""2B9E08B52FC8F77B_E2F8F043D819CFE9_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=CC=C(B(O)O)C=C2""",21,"""DBDE9615DC7CD085"""
-"""42BB05D15BEE7E63_F508FB711AFE8A98_6039_DP""","""O(C(C(=O)O)C1=CC=CC=C1)CC3OCC2(CCNC2)C3""",21,"""DBDE9615DC7CD085"""
-"""2C0A14C338E779B6_FF16BA3EA2BB3E72_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=CC=N[N]2C3CCC3""",21,"""DBDE9615DC7CD085"""
-"""E9D659BCEC64061F_C9C770CDC3EBAAE9_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C(C(C)C)C=CC=C2""",21,"""DBDE9615DC7CD085"""
-"""ED9F17CA655C923D_198E8C40B2272C07_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(=O)C2=CC=CNC2=O""",21,"""DBDE9615DC7CD085"""
-"""E055084800131351_9C92B30D94C22BB5_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(C2=C(N=C(C)S2)C)=O""",21,"""DBDE9615DC7CD085"""
-"""1D1C5DA6C6C5F9FA_171F218F15613B46_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCCCC2(CCC2)C#N""",21,"""DBDE9615DC7CD085"""
-"""869D39A4772A3867_AD2D973ACB708761_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C(ON=C2C)C3CC3""",21,"""DBDE9615DC7CD085"""
-"""F2B4103E0995C81B_A3EAA7AB3E8F82AF_6039_DP""","""O(C(C(=O)O)C1=CC=CC=C1)CC2OC(CC23CNC3)=O""",21,"""DBDE9615DC7CD085"""
-"""163C9320AFCDFA05_B330AE772F48BA30_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2OC(=O)CC23CCC3""",21,"""DBDE9615DC7CD085"""
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-"""395191818696BEA6_C35A1B52FFDF6B24_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC23OCC(C)(CO2)CO3""",21,"""DBDE9615DC7CD085"""
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-"""59CDD3908545D577_5DFDB278FC2CF161_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=NC=C(C(O)=O)C=C2""",21,"""DBDE9615DC7CD085"""
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-"""771AEF16FE55C6D5_FE862D6CBEA17B5E_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=NC(=NO2)C(C)(F)F""",21,"""DBDE9615DC7CD085"""
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-"""77E4DD6BFA5E6089_40ADCEE35918C005_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCCN2CCOCCC2""",21,"""DBDE9615DC7CD085"""
-"""320F8942DA4F34DE_C6A6D352494BE97A_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC3COC2=CSC=C2O3""",21,"""DBDE9615DC7CD085"""
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-"""51D574E92AA59D84_1FF74EBBBA50CF02_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCC=CC2=CC=CC=C2""",21,"""DBDE9615DC7CD085"""
-"""7075CEABB6B89798_09D56EBABC0EF61A_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCCN[S](=O)(=O)C2CC2""",21,"""DBDE9615DC7CD085"""
-"""0BC0EB95C0523E5C_52DAA0F1D6469023_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C[N](C(C)(C)C)N=N2""",21,"""DBDE9615DC7CD085"""
-"""E20E44177C898349_576AFF45AB51A614_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(C2=C(C)C=CC=C2)=O""",21,"""DBDE9615DC7CD085"""
-"""6DD7AD75873FB945_56BF6ADC3607E707_6039_DP""","""O(C(C(=O)O)C1=CC=CC=C1)CC3CC2(CCNCC2)O3""",21,"""DBDE9615DC7CD085"""
-"""05528DC914EA875D_A92FC00DB14C034B_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCC2(C(F)(F)F)CCC2""",21,"""DBDE9615DC7CD085"""
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-"""E0201E960D365F28_1099467995DF3216_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCN2C(C)(COCC2)C""",21,"""DBDE9615DC7CD085"""
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-"""84C2D56A2C392729_B5B475A0D628D561_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C(OC)C=CC(=N2)C""",21,"""DBDE9615DC7CD085"""
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-"""36E01A5CA6893EEF_BD807D484626DC95_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C(C=CC=C2)C3CC3""",21,"""DBDE9615DC7CD085"""
-"""3094A1173EE425FB_A75B243081411188_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC3CC2(CCC2)C(=O)O3""",21,"""DBDE9615DC7CD085"""
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-"""01C08E2373E68B15_9CACAAD98218E074_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCCN2C(=O)CNC2=O""",21,"""DBDE9615DC7CD085"""
-"""72BEB7DAE673E864_EC73DE4A214CA98D_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=CC=C(C=C2)C3CC3""",21,"""DBDE9615DC7CD085"""
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-"""39FABA15CC6BF299_FF6E1D90F4EC0FCB_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(C2=C(C)[N](N=C2)C)=O""",21,"""DBDE9615DC7CD085"""
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-"""92A39EBEA6B52692_059FB687305B12C5_6039_UN""","""O(C(CC=C)C=C)CC(NC1=C(SC(F)F)C=CC=C1)=O""",21,"""96EB72B01CCC5F6F"""
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-"""2185F3911E73ED74_77CC30D29759CF71_6039_UN""","""O(C(CC=C)C=C)CC(NC1=C(C(=C(C#N)S1)C)C#N)=O""",21,"""96EB72B01CCC5F6F"""
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-"""783296258131DD26_C228ED703B728124_6039_UN""","""O(C(CC=C)C=C)CC(=O)NC23CC1CC(CC(C1)C2)C3""",21,"""96EB72B01CCC5F6F"""
-"""48ECAD104BC54D50_A316F175A283B42A_6039_UN""","""O(C(CC=C)C=C)CC(NC1=C(C)C=C(C=C1)[N](=O)=O)=O""",21,"""96EB72B01CCC5F6F"""
-"""35851646639E19B0_E04E10646C396006_6039_UN""","""O(C(CC=C)C=C)CC(NC1=CC=CC(=C1)NC(C)=O)=O""",21,"""96EB72B01CCC5F6F"""
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-"""574ED5918E1700AE_5D8527F20EC37586_6039_UN""","""O(C(CC=C)C=C)CC(C1=CC=C(NC(CC)=O)C=C1)=O""",21,"""96EB72B01CCC5F6F"""
-"""2A604DD183B77FD4_AEC17423A84133D3_6039_UN""","""O(C(CC=C)C=C)CC(NC1=NN=C(CCCCC)S1)=O""",21,"""96EB72B01CCC5F6F"""
-"""F96AC94E338A4A75_107497F176BC26C4_6039_UN""","""O(C(CC=C)C=C)CC(NNC(C1=CC=CC(=C1)C)=O)=O""",21,"""96EB72B01CCC5F6F"""
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-"""7373380D261A2304_A666E3650C10B809_6039_UN""","""CC(C)(COCC(N(C)C)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
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-"""AF2CC286DFBDA574_1CB853858C4AD135_6039_UN""","""CC(C)(COCCC(Cl)(Cl)Cl)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
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-"""7AAE9923C19B3687_2CD3216E25ACC435_6039_UN""","""CC(C)(COCC1=C[NH]C=N1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
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-"""C2F07FA71FF0540A_E3E1CABFEB5CA672_6039_UN""","""CC(C)(COCCCC(C)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
-"""0FC6453CFEF123DA_036C777E0C80AB5C_6039_DP""","""CC(C)(COCCOCCN)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
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-"""5EAF48DABA89F980_8D8C4A31EF8823CB_6039_UN""","""O(CCCC1C(NCC1)=O)CC3CN2CC(CCC2=O)O3""",21,"""2BD09AE10BE769AD"""
-"""A711306BA50214B8_C47B509E15E91903_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NN=C(O2)N3CCCC3""",21,"""2BD09AE10BE769AD"""
-"""3646F629BD978537_8839D6C25B9A3A83_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC3=C2CCCCC3""",21,"""2BD09AE10BE769AD"""
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-"""C1C146F26EAB0146_0B4187516E81881C_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC3=C2OC(=N3)C""",21,"""2BD09AE10BE769AD"""
-"""CB5171BF2B224A4F_D1FF1198DC21616A_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(N=[S](C)(=O)C)=O)=O""",21,"""2BD09AE10BE769AD"""
-"""BC4E49F63475294E_EF54EA84755E8AC8_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(F)(F)F)N=CC=N2""",21,"""2BD09AE10BE769AD"""
-"""4934C2B309DA471C_B4A08DE44C823E75_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)[S](C)(=N)=O""",21,"""2BD09AE10BE769AD"""
-"""F051C5B1C3D1FEB6_58C9581B62B3E605_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC(=N2)C(OCC)=O""",21,"""2BD09AE10BE769AD"""
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-"""449C1A10423B0CCA_7697523DD16D7CAF_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=N[NH]2)C(OCC)=O""",21,"""2BD09AE10BE769AD"""
-"""3BD3D9FB3952C54F_7778C8742C3CE5C4_6039_UN""","""O(CCCC1C(NCC1)=O)CC3CC2(CCCC2)C(=O)O3""",21,"""2BD09AE10BE769AD"""
-"""E0540497D2B9212E_139F30BFB5A6CEDE_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=N[N](C)C=C2[S](=O)(=O)N""",21,"""2BD09AE10BE769AD"""
-"""A547C1FC33C94B83_16B2110DC05E63E8_6039_DP""","""O(CCCC1C(NCC1)=O)CC3CCC2(CCNCC2)O3""",21,"""2BD09AE10BE769AD"""
-"""A535AA46DBFBC67F_77C69E3D8DE7513B_6039_UN""","""O(CCCC1C(NCC1)=O)CC(OC2CN(C)CCC2)=O""",21,"""2BD09AE10BE769AD"""
-"""534B214327F0E481_4849CA768DE38EF6_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=NC(=C2)OC)OC""",21,"""2BD09AE10BE769AD"""
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-"""5E94957F118B77EA_342AD1791E446463_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC=CC(=C2)OC)C(F)F""",21,"""EF6E251F992375CB"""
-"""8D1EAAF2169C5FF5_06E341FED31F546E_6039_UN""","""CC(C)(OCC(N1C2=C(CCC1C)C=CC=C2)=O)C(F)F""",21,"""EF6E251F992375CB"""
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-"""40C01C023B33D970_91ABB82462CFABD0_6039_UN""","""CC(C)(OCC1=CC(=NO1)C2=CC=C(OC)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
-"""492EE69BFC6F6EC6_7959C4FBBF0A9875_6039_UN""","""CC(C)(OCC(C1=C([N](CCOC)C(=C1)C)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
-"""DAC6AC4B06C95E9B_E2C0F9E036843463_6039_UN""","""CC(C)(OCC2=C1N=CC=CC1=C([N](=O)=O)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
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-"""7D317B8E1905E587_352258FB4841E588_6039_UN""","""CC(C)(OCC(N(CC1=CC=C(SC)C=C1)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
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-"""F8F8F671617AD454_03D5BF13258AB8B5_6039_UN""","""CC(C)(OCC(NC1=C(C(OC)=O)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
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-"""5AEDECCE0F8805EC_5638E9D9FC0AEDED_6039_UN""","""CC(C)(OCC1=N[N](C=C1)CCC2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
-"""8C9A3485F2AD261D_076F389153306E73_6039_UN""","""CC(C)(OCCC(NC1=C([N](=O)=O)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
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-"""A191157B1BF110E3_12A8BB904F72575F_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC(C=NO)=NO)S2""",21,"""52F48F38535C2F4E"""
-"""51BFC1057E88AC23_1B88412F8114AC09_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCCC2CCOC2)S3""",21,"""52F48F38535C2F4E"""
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-"""43783C3B7955B29F_358C063E6CD56C18_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCCC2CN(C)C2)S3""",21,"""52F48F38535C2F4E"""
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-"""834DA1276F380B72_844DBAED80008941_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=NC=CN=C2)S3""",21,"""52F48F38535C2F4E"""
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-"""087E49406A4BFD76_5BD47289B363F061_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCC[Si](Cl)(Cl)Cl)S2""",21,"""52F48F38535C2F4E"""
-"""6FD3EBF9FD718EC1_2764959A73EEAEC4_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC#CCSC#N)S2""",21,"""52F48F38535C2F4E"""
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-"""7810E8C14C1FFE18_0F4FF2D56F3BA31F_6039_DP""","""O(C(CC1=CC=CC=C1)C(=O)O)C[C@H]2NC(O[C@@H]2C)(C)C""",21,"""BE31E61089F8B603"""
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-"""0335B50337C8926E_621D2006DB1F0150_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CSC(=N2)COC""",21,"""BE31E61089F8B603"""
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-"""79FD3B3ED29E26F9_16A58FC3F1D40904_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCCN[S](CC)(=O)=O""",21,"""BE31E61089F8B603"""
-"""AFE3307F9C16741F_2E19EFF9348FFBC8_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC(=C(F)C=C2)F""",21,"""BE31E61089F8B603"""
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-"""8E1A1C749DFC7BD9_99F53C2340FF2E1A_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCOCC(OCC)=O""",21,"""BE31E61089F8B603"""
-"""0642825CDD3AD623_F7A5C5A3DBB1E508_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC[N]2N=C(C)N=C2C""",21,"""BE31E61089F8B603"""
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-"""D4365BABFBD0D7F1_1E475CE1A9F07323_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCCC2CCOCC2""",21,"""BE31E61089F8B603"""
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-"""A550ABC7E811A6B2_A3B5E77BEA358662_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCOC2CCCCO2""",21,"""BE31E61089F8B603"""
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-"""CB4871BDC7B1AB5F_F0C71A32DB3B1236_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCOCC2CCCC2""",21,"""BE31E61089F8B603"""
-"""86FE4F0795A48A60_A583F0C2B53E149A_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=C(N=N[N]2CC)C""",21,"""BE31E61089F8B603"""
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-"""03D64B7673C2235E_317126052851A5F4_6039_DP""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC2CCCNCC2""",21,"""BE31E61089F8B603"""
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-"""E69D0F7730237BD7_C0EE21E4913BA5AD_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NC=C(CC)C=C2""",21,"""BE31E61089F8B603"""
-"""B169F27A55026DF2_AD57653F13EA4C93_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(=O)N2CCCCC2""",21,"""BE31E61089F8B603"""
-"""8C22906D7F4D8CC9_490B08B21F5D351B_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC(C)(C)C(F)(F)F""",21,"""BE31E61089F8B603"""
-"""D4D2DBA2892D8C2E_594002B5831FA0F3_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=C(F)C(=NC=N2)Br""",21,"""BE31E61089F8B603"""
-"""25C91A67491C485B_04636DB90D75F376_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CSC3=CN=C[N]23""",21,"""BE31E61089F8B603"""
-"""E78E2ADD8121D64B_D0E6E51AC35D7AF3_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NC(=C[NH]2)C(O)=O""",21,"""BE31E61089F8B603"""
-"""198C548D498C8B96_6CDF94620B01DFD8_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2CC(F)(F)C(N2)=O""",21,"""BE31E61089F8B603"""
-"""B4BFC32D8C4E4230_CD276FE1BAD005F3_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NC(=CO2)C(O)=O""",21,"""BE31E61089F8B603"""
-"""B39BB38302FB47D5_DD9AAA0CEE6D8354_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCCC(NCCC)=O""",21,"""BE31E61089F8B603"""
-"""DE24E15073E5250C_F3B886FA562DC044_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC(=NO2)C(F)F""",21,"""BE31E61089F8B603"""
-"""CD879B2498F28116_87E2B01BC9D00443_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=C[N](N=N2)C3CC3""",21,"""BE31E61089F8B603"""
-"""5DFFEFA06EEB10D5_E057FA39118213DC_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2=NOC(=C2)C)=O""",21,"""BE31E61089F8B603"""
-"""74166043F1FABDB1_0484AF81F9675E6A_6039_DP""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=COC(=N2)[C@H](C)N""",21,"""BE31E61089F8B603"""
-"""6CD5B6EB1EB65846_2A4B70E2F8B22588_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=C(C(F)F)OC=N2""",21,"""BE31E61089F8B603"""
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-"""CA15A2B9B72A6A5D_0FE928CD6AC95880_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2=C(C)C=CS2)=O""",21,"""BE31E61089F8B603"""
-"""3C421FE8B632D3F6_97A83368B76AAF97_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NN=C(COC)O2""",21,"""BE31E61089F8B603"""
-"""6C835A2DB9C6F2E4_B2A792A350C6123D_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2=CC(=CS2)C)=O""",21,"""BE31E61089F8B603"""
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-"""CEC3ACA50465DCD4_A0C2B9BE54ABC88F_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC2(CCC#C)N=N2""",21,"""BE31E61089F8B603"""
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-"""8ACC2A52C55DB245_8E6AAD0294987750_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2=C(C)N=NS2)=O""",21,"""BE31E61089F8B603"""
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-"""91625BF9DEFBA866_7B241EA0ECC32F85_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2=C(C)OC=C2)=O""",21,"""BE31E61089F8B603"""
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-"""6C4460B6362279D3_66C15FC11758BA31_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2=C(C)N=CS2)=O""",21,"""BE31E61089F8B603"""
-"""B528678527480013_F95D9532209F65C7_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(F)C2=CC=CC=C2""",21,"""BE31E61089F8B603"""
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-"""3B0272B7197E02A4_EBFCB58E2C33E7E7_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCCCC[S](Cl)(=O)=O""",21,"""BE31E61089F8B603"""
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-"""1715726E2B2C8A77_1E940210FA3E362E_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CN=C(C(C)C)S2""",21,"""BE31E61089F8B603"""
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-"""B9366C42BD526176_0D106FD548DFA539_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC(=C(C=C2)F)C""",21,"""BE31E61089F8B603"""
-"""EE3A5B40CFCB0C3B_4FB93A4054008148_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2N(C)CC(C2)(C)C""",21,"""BE31E61089F8B603"""
-"""90870A475BE1C4D9_A2F43765D996CF69_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2CC(F)(F)C2)=O""",21,"""BE31E61089F8B603"""
-"""573CF1AB13F3802D_DF9EFBF2CB718523_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC=C(C=C2)C#C""",21,"""BE31E61089F8B603"""
-"""031C3B03F80FB660_117FFD1607CA022E_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC(=O)N2CCCC2""",21,"""BE31E61089F8B603"""
-"""03FA967FA35777A7_7116A9725D789A08_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC(=CC=C2)C#C""",21,"""BE31E61089F8B603"""
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-"""13EB513FF2468176_61D07D2D4333F5C3_6039_DP""","""O(C(CC1=CC=CC=C1)C(=O)O)CCCN2CCNCC2""",21,"""BE31E61089F8B603"""
-"""129B3506574416FD_E3C0D92509225184_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NOC(=C2)COC""",21,"""BE31E61089F8B603"""
-"""E49A037339A02808_503147B608C05FC5_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2OCCCC2(C)C""",21,"""BE31E61089F8B603"""
-"""9263123C54D81233_DFD0300D6E6B09FA_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC2(CC2)[S](=O)(=O)Cl""",21,"""BE31E61089F8B603"""
-"""9CACA91BC98C87B0_E0C3F0B1F28DF408_6039_DP""","""O(C(CC1=CC=CC=C1)C(=O)O)CCOC2CCNCC2""",21,"""BE31E61089F8B603"""
-"""8168827F692FCFEC_E68E15244DDA6D2D_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC(N(CC)CC)=O""",21,"""BE31E61089F8B603"""
-"""C1BDF90106CED4D7_B967B912408F39E2_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(NC(CC)(C)C)=O""",21,"""BE31E61089F8B603"""
-"""E934B5767E26AACB_366FB82865594594_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC2=C[N](CC)N=N2""",21,"""BE31E61089F8B603"""
-"""E4A54690EA1A0B67_FE3B3E7043421058_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC2=CC=CC(=C2)C""",21,"""BE31E61089F8B603"""
-"""C67CADEEBFC6F3DE_7B66B9D6DEEDE043_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCN(C)CC(F)(F)F""",21,"""BE31E61089F8B603"""
-"""F33BE0776666230B_BD0A55A3837DB69F_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCN2CC(C(C)C2)C""",21,"""BE31E61089F8B603"""
-"""6F288A475F3C21BD_AFABF41B1562E435_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=N[NH]C(=C2)C(C)C""",21,"""BE31E61089F8B603"""
-"""626A4C8143151224_73BEC3F0D64FF0E2_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCN2C[C@H]([C@@H](C)C2)C""",21,"""BE31E61089F8B603"""
-"""28BEC10C2FE66D83_C8E83FCA424E5AEF_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2=C[N](C)C=N2)=O""",21,"""BE31E61089F8B603"""
-"""4C896BC1714FF5E9_4B69BCDC126185D1_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=C(OC)C=CC=N2""",21,"""BE31E61089F8B603"""
-"""D631A4C5ED81063B_8374903ADD08DD9B_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=C(N=CC(=C2)C)F""",21,"""BE31E61089F8B603"""
-"""F49207483F56787C_BFD07CA632C2E498_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCN2CC(F)(CC2)F""",21,"""BE31E61089F8B603"""
-"""1A4DE8BCBB577BC5_BE89D795E3B2A87F_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC(=NC=C2)C#N""",21,"""BE31E61089F8B603"""
-"""5ACBC6E28479FD95_8B941A73F6D09EE7_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCOC(C)(C)C(=O)O""",21,"""BE31E61089F8B603"""
-"""D8D6BBD111447662_B7F099C5C1965CFE_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC3CC2OCCC2O3""",21,"""BE31E61089F8B603"""
-"""A73463F9F0B199EF_227AC9DEA1D2AFBB_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2=CC=C(C)O2)=O""",21,"""BE31E61089F8B603"""
-"""652C5CB4BB3ADF9C_44D5AD2E18B84F5B_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCCC2(C(O)=O)CC2""",21,"""BE31E61089F8B603"""
-"""12936F25C663FEC1_8F3023F63B9EC6DD_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=C(COC)OC=N2""",21,"""BE31E61089F8B603"""
-"""6E6C66B0F5B17662_F9F97CE7843A6F00_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC2CC(C)(C)OC2""",21,"""BE31E61089F8B603"""
-"""E46CEC9CAEEBF13C_F322E33930975B1A_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC2NC(=O)NC2=O""",21,"""BE31E61089F8B603"""
-"""EE367F5A41B84DA0_3BD53EACE0FF4CF8_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NO[C@@H]3COC[C@H]23""",21,"""BE31E61089F8B603"""
-"""43DCDF8FBFFC1A99_0F99AE5C5180289B_6039_DP""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2CCCNC2)=O""",21,"""BE31E61089F8B603"""
-"""D14B4236D6DBA121_9CEE747A24D5AD98_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC(=NO2)COC""",21,"""BE31E61089F8B603"""
-"""F1E451638F14DCF5_FADF99805BF00071_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NOC(C(O)=O)C2""",21,"""BE31E61089F8B603"""
-"""90B34FF1545DE9B4_CBE5130886AE4666_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC(=NC=N2)OC""",21,"""BE31E61089F8B603"""
-"""F8831F831799650C_FD9816EA9FA7F428_6039_DP""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=C(CCN)OC=N2""",21,"""BE31E61089F8B603"""
-"""4555E1DE43935124_9886E51C178FDFCB_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC2=CN=C(C)C=C2""",21,"""BE31E61089F8B603"""
-"""DEA4FD1D958E70DF_6E292154E4A9B693_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=C(C)C=C(N=C2)F""",21,"""BE31E61089F8B603"""
-"""D0BE733F095BC9B4_B6D9BCA843CE5B74_6039_DP""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2CNC(CO2)(C)C""",21,"""BE31E61089F8B603"""
-"""D8C03F7F5E42C590_279C93B6902FD19D_6039_DP""","""O(C(CC1=CC=CC=C1)C(=O)O)CC(C2CCNCC2)F""",21,"""BE31E61089F8B603"""
-"""DD3C8A1C3773B8B0_9298AB9CA01381E8_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCOC(C#N)C2CC2""",21,"""BE31E61089F8B603"""
-"""CE6802BF8C0399B3_21D9FDBB0EC5AFB4_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2CC(=NO2)C3CC3""",21,"""BE31E61089F8B603"""
-"""E9F3B7B52E752A55_9C9F84F353FC1571_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC=NC(=N2)OC""",21,"""BE31E61089F8B603"""
-"""9C9744776FD47A51_17E790039DE71EF5_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=C(ON=C2OC)C""",21,"""BE31E61089F8B603"""
-"""B90E4411F8263981_22CC0F2C44245412_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCOCC(OC)OC""",21,"""BE31E61089F8B603"""
-"""FBA082216FD2EAE2_1CCEA650576D1FD0_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NC(=CC=C2)C#N""",21,"""BE31E61089F8B603"""
-"""C1DB4B4A1F2EE743_72E8D3AF09D71D24_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NNC(=O)NC2=O""",21,"""BE31E61089F8B603"""
-"""EA75EBDF9E656554_91AC498488F014AF_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=N[NH]C3=C2CCC3""",21,"""BE31E61089F8B603"""
-"""665A8482F6FE3C50_E7A53B8940A8BC3E_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC2CCN(C)CC2""",21,"""BE31E61089F8B603"""
-"""101B06B890341E10_EAC593CDF3860BCB_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NOC(=C2C)CC""",21,"""BE31E61089F8B603"""
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-"""5D9299232CD220EB_CCD41FEBDEFA9127_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CN=C(N(C)C)C=C2)F""",21,"""37D5B129C4DC888D"""
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-"""D1F6898D6A16A52E_10F9CB969E8DF697_6039_UN""","""COC1=C(C(=NC=C1)COCC3=N[N]2CCCCC2=C3)F""",21,"""37D5B129C4DC888D"""
-"""37CA092CF56D32E2_C2449210D2B833ED_6039_UN""","""COC1=C(C(=NC=C1)COCC2CN=C(C(C)(C)C)O2)F""",21,"""37D5B129C4DC888D"""
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-"""81756EA1C065960F_817921FA55A77893_6039_UN""","""COC1=C(C(=NC=C1)COCCSC2=CC=CC(=C2)C)F""",21,"""37D5B129C4DC888D"""
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-"""887B0E1FEDD40EC8_7653206C38AE639A_6039_UN""","""COC1=C(C(=NC=C1)COCC2=COC(=C2)[S](N)(=O)=O)F""",21,"""37D5B129C4DC888D"""
-"""AD4B97525D70C0B0_1E7910BFAB365422_6039_UN""","""COC1=C(C(=NC=C1)COCC(OC)C2CCCCC2)F""",21,"""37D5B129C4DC888D"""
-"""419DF78960936927_87F423905CFABE25_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC(=C(C=N2)C)OC)F""",21,"""37D5B129C4DC888D"""
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-"""26C83089336F98EC_D9BED2EA50BCEEEE_6039_DP""","""COC1=C(C(=NC=C1)COCC(N2CC(C)NCC2)=O)F""",21,"""37D5B129C4DC888D"""
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-"""BBDCD38547099392_C0F753C60021265A_6039_DP""","""COC1=C(C(=NC=C1)COCC2CNCC3(O2)CCC3)F""",21,"""37D5B129C4DC888D"""
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-"""833E09A949C111B2_28FBC70B855E1B34_6039_DP""","""COC1=C(C(=NC=C1)COCC2=N[NH]C3=C2CNCC3)F""",21,"""37D5B129C4DC888D"""
-"""80711DA278CB7F8B_EF9304DADDA40876_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C3C(=N[NH]2)CCCC3)F""",21,"""37D5B129C4DC888D"""
-"""FD2C78F5514893A4_55219B1F72337D76_6039_UN""","""COC1=C(C(=NC=C1)COCCC2=C([N](N=C2C)C)C)F""",21,"""37D5B129C4DC888D"""
-"""D939F92F858A46DF_E018D83C20E6B22F_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C(C(OC)=O)SN=C2)F""",21,"""37D5B129C4DC888D"""
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-"""584376C641D73B7D_F34AEDD48424F495_6039_UN""","""COC1=C(C(=NC=C1)COCC(C2(C(F)(F)F)CC2)=O)F""",21,"""37D5B129C4DC888D"""
-"""034204F126383A5A_C38013885B311333_6039_DP""","""COC1=C(C(=NC=C1)COCC2CNC3(CO2)CCC3)F""",21,"""37D5B129C4DC888D"""
-"""4EFE1B9299B6D8FD_87F3B1D0B20F768B_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C(C(C)(C)C)OC=N2)F""",21,"""37D5B129C4DC888D"""
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-"""F063E4175A27BAE7_6D256CFBDF4D4F03_6039_UN""","""COC1=C(C(=NC=C1)COCCC(C(OCC)=O)(F)F)F""",21,"""37D5B129C4DC888D"""
-"""64EEEADC92343339_01F154AC72C0501F_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C(SN=C2OC)OC)F""",21,"""37D5B129C4DC888D"""
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-"""23834EB5BDEF65CB_4F54E46723A45DC8_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC3=C(C=C2)OCO3)F""",21,"""37D5B129C4DC888D"""
-"""6A4462A4A29532A5_24DD802AF481F832_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NC(=C[NH]2)C(F)(F)F)F""",21,"""37D5B129C4DC888D"""
-"""41E5080BAE6FD10C_5DDC0BE60DB4A59D_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NO[C@@H]3CCCC[C@H]23)F""",21,"""37D5B129C4DC888D"""
-"""AD9FD7497391D435_D0D5889B41BCED87_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC=NC(=N2)COC)F""",21,"""37D5B129C4DC888D"""
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-"""6C7B8C7BB655664D_3E11F9710B9A205B_6039_UN""","""COCOC1=CC(=C(C=C1)OCC(NCC)=O)C(=O)OC""",21,"""6E222405BC5E1738"""
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-"""CB60521DB185A472_0D5617C8C6E57F03_6039_UN""","""COCOC1=CC(=C(C=C1)OCC2=NOC=C2)C(=O)OC""",21,"""6E222405BC5E1738"""
-"""F4FCFA6C2D52DC5F_229C37F707AB76B6_6039_UN""","""COCOC1=CC(=C(C=C1)OCCCCC=C)C(=O)OC""",21,"""6E222405BC5E1738"""
-"""876A73B4334D7D6C_F39061181FADCE2F_6039_UN""","""COCOC1=CC(=C(C=C1)OCC2=NSN=C2)C(=O)OC""",21,"""6E222405BC5E1738"""
-"""350B9F02E0F8EFC6_8C6C52BA2C37836F_6039_UN""","""COCOC1=CC(=C(C=C1)OCC2=CC=NO2)C(=O)OC""",21,"""6E222405BC5E1738"""
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-"""0F56D5BB77215144_C9BC0190B7310124_6039_UN""","""COCOC1=CC(=C(C=C1)OCC2COCO2)C(=O)OC""",21,"""6E222405BC5E1738"""
-"""D1FA9C19C911D1E5_5F0A4814E957675D_6039_UN""","""COCOC1=CC(=C(C=C1)OCCSC(C)=O)C(=O)OC""",21,"""6E222405BC5E1738"""
-"""B6144FE57038FFFA_A59AC393A4348362_6039_UN""","""COCOC1=CC(=C(C=C1)OCC(CC)OC)C(=O)OC""",21,"""6E222405BC5E1738"""
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-"""9F299CB9CE572883_5FC592556C0DDE73_6039_UN""","""COCOC1=CC(=C(C=C1)OCCC(F)(F)Cl)C(=O)OC""",21,"""6E222405BC5E1738"""
-"""068B344D8B904A7A_786BA7683C7F5E9B_6039_UN""","""COCOC1=CC(=C(C=C1)OCC[S](O)(=O)=O)C(=O)OC""",21,"""6E222405BC5E1738"""
-"""A5E4F0D6FE6E0EA7_8A806CB5F5EC9E1E_6039_UN""","""COCOC1=CC(=C(C=C1)OCCOC2CC2)C(=O)OC""",21,"""6E222405BC5E1738"""
-"""EBD8C8058E9AE253_43628BB7D98928DD_6039_UN""","""COCOC1=CC(=C(C=C1)OCC2=CN=CS2)C(=O)OC""",21,"""6E222405BC5E1738"""
-"""DCF9964844E82818_BD146FC9C582A339_6039_UN""","""COCOC1=CC(=C(C=C1)OCC2=CC=NS2)C(=O)OC""",21,"""6E222405BC5E1738"""
-"""9DF6B519D9BE722E_7AA39E3AD5D6B7CE_6039_UN""","""COCOC1=CC(=C(C=C1)OCC2CC(=O)O2)C(=O)OC""",21,"""6E222405BC5E1738"""
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-"""700B0C5EBBC6EDB4_D1D23C6543CD32F2_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=CSC(=C2)[N](=O)=O)C""",21,"""00F9030A5E100ABA"""
-"""CD31E6405B8E9F6E_72470AC06B5E4117_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCCCC2=C[N](C)N=C2)C""",21,"""00F9030A5E100ABA"""
-"""4388122FC7C3E16C_131997EAD002D755_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCCCC(NC(N)=O)=O)C""",21,"""00F9030A5E100ABA"""
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-"""EC9F60E5454BC2F0_8D0557DB86A1E97C_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=C[N]3C(=N2)SC=C3)C""",21,"""00F9030A5E100ABA"""
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-"""347E0B965C16053F_8A4A2CC7EE784D8C_6039_UN""","""COC(COCCSC1=CC=C(C)C=C1)C2CCCCC2""",21,"""7CED175701B741FF"""
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-"""650E3692426CB1E6_0D9687A206AB0061_6039_DP""","""COC(COCC2=CC1=C(C=C[NH]1)C=C2)C3CCCCC3""",21,"""7CED175701B741FF"""
-"""53F8C1B6FAC692F9_8AECA94464504EB6_6039_UN""","""COC(COCC1=C(C(=NO1)C)[N](=O)=O)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""A90ECB2B938EBC88_6CE4C2DE51FCCFED_6039_UN""","""COC(COCCOC1=CC=C(C)C=C1)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""C7360E47FAB9E7A7_676673719807D2F6_6039_UN""","""COC(COCCOCC(C(F)F)(F)F)C1CCCCC1""",21,"""7CED175701B741FF"""
-"""C96C6C74512AB92C_8182046AE74B399E_6039_UN""","""COC(COCC(NC(NCCC)=O)=O)C1CCCCC1""",21,"""7CED175701B741FF"""
-"""9063FBE94891EE99_279162202DBBA548_6039_UN""","""COC(COCC1=NN=C([N]1C)C2CC2)C3CCCCC3""",21,"""7CED175701B741FF"""
-"""EC08FA4C96BF5A14_70FB2FE0D8DA91C7_6039_UN""","""COC(COCC1=NN=C(S1)C2CCC2)C3CCCCC3""",21,"""7CED175701B741FF"""
-"""81A58F979FAB3E44_BBCE86909D519BE5_6039_UN""","""COC(COCC1=CC=CC(=C1)C(F)F)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""2EC37FBFD155C2F4_0284CC6A73D4B9B0_6039_UN""","""COC(COCC1=CC(=C(C=C1)C)OC)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""7FD9846BE82331C0_1AB3FC0A9BED4DEF_6039_UN""","""COC(COCC1=C(C=CC=C1)C2CC2)C3CCCCC3""",21,"""7CED175701B741FF"""
-"""654DE9B1F0436C98_0068A5725C8A80F2_6039_UN""","""COC(COCC2CC1(CCC1)C(=O)O2)C3CCCCC3""",21,"""7CED175701B741FF"""
-"""B4BC727EB6A5F47E_38E6E3BF6ED42219_6039_UN""","""COC(COCC(NCC(C(C)C)=O)=O)C1CCCCC1""",21,"""7CED175701B741FF"""
-"""D515AD52EE2D9B25_BDFDBB3C6B1F0573_6039_UN""","""COC(COCC2=NC1=C(C=CC=N1)O2)C3CCCCC3""",21,"""7CED175701B741FF"""
-"""A28024B14B9644C9_00DB84EC64952CA8_6039_UN""","""COC(COCCC1=CC=C(C=C1)C#N)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""DF709223DC6DC34B_52D6AD2393955911_6039_UN""","""COC(COCC1=CC(=C(C=C1)C#N)C)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""96E613CD7FC64605_3B9F2B9B5FD3710E_6039_UN""","""COC(COCCCN1C(=O)CNC1=O)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""E80ECC2C7E94891D_4B405F08FC8738F7_6039_UN""","""COC(COCC1=CC=C(C=C1)C2CC2)C3CCCCC3""",21,"""7CED175701B741FF"""
-"""98403E99B6FFEF7A_6117A53C281216F5_6039_UN""","""COC(COCC1=NC=N[N]1CC(F)F)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""55C5DE8DF57DA077_297B44B5F3E0C901_6039_UN""","""COC(COCC1=CC(=C(OC)N=C1)C)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""FFAC6734CE03AB3E_8785FA32CF085267_6039_DP""","""COC(COCC2=NN=C(C1CNC1)S2)C3CCCCC3""",21,"""7CED175701B741FF"""
-"""7458646A8E89AFA3_585D9CD229279EB1_6039_UN""","""COC(COCC(C1=C(C)[N](N=C1)C)=O)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""0B404EE925541BC5_445C4DD7E6FD30F1_6039_UN""","""COC(COCC1=CC=C(C(F)(F)F)S1)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""70723B593F69F043_6401BE8D479A0510_6039_UN""","""COC(COC[C@H]1CC[C@@H](C(OC)=O)O1)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""A874EFDC7FE0D201_1B3850BA97CF5538_6039_UN""","""COC(COCC1=CON=C1C(F)(F)F)C2CCCCC2""",21,"""7CED175701B741FF"""
-"""6B46B705803F07A1_92218F4C5FCF1931_6039_UN""","""COC(COCC1=NOC(=N1)C2=CSC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""34FE12257722F7C5_530EA7B01CE43BB3_6039_UN""","""COC(COCC1=CSC(=N1)C2=CC=CO2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""1334AC4F4126E657_A69BF5CA4D04B7DD_6039_UN""","""COC(COCC1=CSC(=N1)C2=CC=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""9C965F6EE8CE1DD7_E9888965B1701A0B_6039_UN""","""COC(COCCOC1=CC=CC(=C1)CC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""64D3BF35DA84A651_01757266FBA050F3_6039_UN""","""COC(COCCC(C1=CC=C(F)C=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D5C6AC5B4888581F_23A7F89BF0BD4690_6039_UN""","""COC(COCCCOC1=C(C)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9896AF4CF45C677C_6D29741B2273EE2B_6039_UN""","""COC(COCCOC1=CC(=CC=C1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9CC35D2A30D5E08E_47B1971AF963B18A_6039_UN""","""COC(COCC(C1=CC(=C(C)C=C1)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2D67DC208F3CB4BC_95747EAAC1684BB4_6039_UN""","""COC(COCC(C1=CC(=C(F)C=C1)F)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""4F56A5DCE627A78F_88A2A8234F128817_6039_UN""","""COC(COCCOC1=CC(=CC(=C1)C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""5F0CE5996276AD02_2AFA3B24275ADB29_6039_UN""","""COC(COCC(NC(NC(C)(C)C)=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""3B3BD76F5B0B959D_B8F349B3DFDAD9D1_6039_UN""","""COC(COCC(=O)NC1CC[S](=O)(=O)C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""590A788178B0195B_B5D2D4785004AB8E_6039_UN""","""COC(COCC(NC1=NN=C(CC)S1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""40C01A2C7A10CDD6_0E44983E640C6713_6039_UN""","""COC(COCC1=C(C(OCC)=O)C=CO1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A53FEF6D22CC10F8_C15F1E43E2F614A6_6039_UN""","""COC(COCCOC1=CC=C(OC)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A79D791AFCB34A51_1A2F26CAC9A75659_6039_UN""","""COC(COCC(CC1=C(F)C=CC=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""E19E1A89A79514FE_16DD7DCAA08270CD_6039_UN""","""COC(COCC(CC1=CC=C(F)C=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""3C1D2849BF6D613B_C8CBF10813EBA897_6039_UN""","""COC(COCC(NC1=C([NH]N=C1C)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B14F259F368FADF1_954E5695D6AAA376_6039_UN""","""COC(COCC1=CC=C(C(F)(F)F)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""388E23610A5F21C4_C52B59AED2467BD0_6039_UN""","""COC(COCC1=C(C=CC(=C1)OC)OC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""4ECCDAE59D409103_284C9B27C0A6623F_6039_UN""","""COC(COCC(NC(C)C1=CC=CO1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""65C8690F19D4E9C7_C5B8FCBDA0CE2753_6039_UN""","""COC(COCC1=COC(=N1)C2=CC=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""458E1542A7747642_1B3BC25BEC31A3D3_6039_UN""","""COC(COCC1=NC(=NO1)C2=CSC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""689B452F37A9406A_FFBD5807AFE11435_6039_UN""","""COC(COCC1=NOC(=N1)C2=CC=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""6511EFC44ADF8809_7108632B67FE2EEF_6039_UN""","""COC(COCC(NC(CCC(C)C)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""FF6144E93933C7B5_5AE22C4077DE8164_6039_UN""","""COC(COCCOC1=CC=C(C=C1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EEAB2D67FEC16342_E85F1B4E6181CD5C_6039_UN""","""COC(COCC(=O)NCC1=NC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""0BDAF6BE1AE0B689_3B752EFEBE9920C6_6039_UN""","""COC(COCC1=CC2=C(C=C1)C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""FCFD615BB15F385F_0916FC1B0EAAF17F_6039_UN""","""COC(COCC2=C[N]1C=C(C)C=CC1=N2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""C04DAA0C74A99676_1E2B6877FCF5E01A_6039_UN""","""COC(COCC2=C[N]1C=CC=C(C)C1=N2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""C0260DD89B7BBD5A_B7837789D51B9D61_6039_UN""","""COC(COCC1=NC2=C(C=C1)C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""899C011CA738C360_AA458B65FEAF41AE_6039_UN""","""COC(COCC1=CC=CC(=C1)C(OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C36A30211D48729E_CAC445BDC07036C9_6039_UN""","""COC(COCC(C1=CC(=C[NH]1)[N](=O)=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""935BBD29B597F407_F5C8133BE35A7A3B_6039_UN""","""COC(COCC1=NN=C(O1)C2=CC=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""E0BD00CDC6DC4652_0EECAF809FE77082_6039_UN""","""COC(COCC(C1=C(C=C(F)C=C1)F)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1349D732602832F7_96590B0FB93504F6_6039_UN""","""COC(COCC(C1=C(C=CC(=C1)C)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""56A3570111851E6E_3EF7D147E96393A4_6039_UN""","""COC(COCCCCOC1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8066E91E18DC948B_CDD220B5C47214EC_6039_UN""","""COC(COCC(=O)C1=CC=C(C=C1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A6CA135224BA4EBB_1514E3817BD0BE70_6039_UN""","""COC(COCC2=C1N=CC=CC1=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""669BEAB8E6BA6993_AB447AD6F61B6C1E_6039_UN""","""COC(COCC1=NC(=N)NC(=N1)N(C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D14283A96F8CB337_7C79E0592066C41A_6039_UN""","""COC(COCC(NC(C)C1=CC=CS1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""0B3BB4D4B34E9FE3_8670BF23BCD5C3EF_6039_UN""","""COC(COCC(C1=CC=C(CC)C=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""52E304D8B0ACF68C_36C02310E9FBDC33_6039_UN""","""COC(COCC(=O)NC(=O)C1=CC=CS1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""154828F5F99F7219_F839C1731EE594FB_6039_UN""","""COC(COCC1=NOC(=N1)C2=CC=CO2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""290D36442A809D4A_477A333B89E176BE_6039_UN""","""COC(COCCC(=O)NC1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EEB26E9F5FBCE851_7B016887183A132A_6039_UN""","""COC(COCC(=O)OCC1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F839CAB3EB0EBCD9_2C6A7B6283F3DD5A_6039_UN""","""COC(COCC(NCCCC(OC)=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""B6F3DB655CA803B9_75CEFCB8868C4ED3_6039_UN""","""COC(COCC1=CC=C(C(C)(C)C)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""326DBA3BADF42F93_A1B29A3EFA2693FE_6039_UN""","""COC(COCC(C1=C(F)C=CC=C1F)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""DF4AEF0DB88E5ABE_B057C7572869EA2C_6039_UN""","""COC(COCC(NC(C(C)C)C(=O)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""4F616D052FEE434C_BC09F5C6A84A5DAD_6039_UN""","""COC(COCC1OCCN(CC(C)C)C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""CBCC69DCDDFD6581_A52E62179F0456DE_6039_UN""","""COC(COCC1=NOC(=C1)C2=CC=CO2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""0D46DE80164EDBC0_6C030D28E1CE3F1F_6039_UN""","""COC(COCC1=CC=CC(=C1)OC(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""AC7C1E8C2B03156C_DD9BC4321B5EA189_6039_UN""","""COC(COCC1=CC=C(C(OCC)=O)O1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""82F522277CBE696C_D3A8791B422D2F4A_6039_UN""","""COC(COCCOC1=C(OC)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""448367EEF61A377A_DE9E9051054621E7_6039_UN""","""COC(COCC(=O)NNC1=NC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9E69E8F534EE5D2B_2752C64447F6F7CE_6039_UN""","""COC(COCC(N=C1N=C(SC)NS1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""288068D917F54494_CF0BB4ABD7F586E1_6039_UN""","""COC(COCC1=CC=CC(=C1C)[N](=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""7E7FB886DA560345_6D5832D89DB0DD28_6039_UN""","""COC(COCC(=O)NC1(CCCC1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""DA1F4A6088A148AC_11EF20BB025C5655_6039_UN""","""COC(COCC1=NC=C(C(=C1C)OC)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""AA0D5E23C9A79D02_251E98839242FC80_6039_UN""","""COC(COCC1=CC(=C(C(OC)=O)O1)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""0ABC1005D0CB697B_5FCC56E23A894365_6039_UN""","""COC(COCCSC1=CC(=C(C)C=C1)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""E8A15ABC146084B0_2DF3B15AB9A03200_6039_UN""","""COC(COCC(=O)NC(=O)C1=CC=CO1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F573083C1F5D342A_D45C955D50F220D0_6039_UN""","""COC(COCC1=CC=CC(=C1)OC(C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F40FC80371E31E62_0E74F2B6E1E8D2AF_6039_UN""","""COC(COCC(NCC1=C(C)C=CS1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""3977E79C02ABAA91_F4FA0F69A0848027_6039_UN""","""COC(COCC(NCC1=CC=C(C)S1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6A4FCDD93F6D4B9F_6D6848FE346F1926_6039_UN""","""COC(COCC(N(CC(C)C)C1CC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B1BB33E27C424A42_5A297AE2EC887D3F_6039_UN""","""COC(COCC(N(CC)CC(C)C#N)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""467469ADC8BA74FC_00187D4C70112A7C_6039_UN""","""COC(COCC(=O)NCCC1=CSC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""FC4CA426A6EEF056_7516F4AA7AFB950C_6039_UN""","""COC(COCC(NC(C)C(=O)N(C)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""184F13C635A6C149_9C083DA8BD83E2C3_6039_UN""","""COC(COCCNC(OCC(F)(F)F)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""55B2B209B79E0C1C_FDB78382202C0995_6039_UN""","""COC(COCC1=C(C(OC)=O)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B3C784E92A0E9C74_A97F105C9A19B800_6039_UN""","""COC(COCC1=CSC(=N1)CCC(C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9CB86146C20F958D_36F1D35221DC696D_6039_UN""","""COC(COCC1=CSC(=N1)N(C)C(=O)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""0ECF909F50DCD99C_FAD266636ADFDECD_6039_UN""","""COC(COCC1=CC2=C(C=C1)OCCO2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""2B5801ACDE57FA04_14D35668E1A207E5_6039_UN""","""COC(COCC1=C(OC(C)C)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""58E2416A8A76E595_6F5760E9D8061E1D_6039_UN""","""COC(COCC1=NC2=C([N]1C)C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""2336C0500B62ED14_88ED179079B400DC_6039_UN""","""COC(COCC1=CC=C(CC(C)C)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1511214141C2F04C_8894959CC6CA379C_6039_UN""","""COC(COCC1=CSC(=N1)C2=CSC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""E3C83402BA00331F_F01F3A70C3ED9CA5_6039_UN""","""COC(COCC2=NC1=C(F)C=CC=C1[NH]2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""9E09638DD5B11452_B971B87C8C751218_6039_UN""","""COC(COCC(C1=CC(=CO1)C(O)=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9145997E87510656_B9CE7AC19960C2D7_6039_UN""","""COC(COCC(C1=CC(=CO1)C(N)=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A596E54EDF06107F_E3BF7910C6331B32_6039_UN""","""COC(COCCCCC[N]1C=C(C)C=N1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D906EB1567E3BEA5_741C9B0AFBBF67B5_6039_UN""","""COC(COCCC(N(CC(OC)=O)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""5558872781B07C64_956731B8769BDC4C_6039_UN""","""COC(COCCC[N]1N=C([N](=O)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F50546C8682A0E83_C2616EDB82801505_6039_UN""","""COC(COCC1=NC(=NO1)C2=COC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""73CC7AAC39FDC6C9_653549B1AA9D89A8_6039_UN""","""COC(COCC1=CSC(=N1)C2=COC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""26EA2CC11B1A56BB_AA2B8ACC5CBCF21B_6039_UN""","""COC(COCC2=C[N]1C(=CC=CC1=N2)C)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""5BD23CDF292DA93A_755D4F5014F663D0_6039_UN""","""COC(COCC(C1=CC(=CS1)C(C)=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6BBA4753023D3ECF_C96BF044C735B138_6039_UN""","""COC(COCC1=NC=C[N]1CC(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""790C4F38594CC678_48A14188D190204C_6039_UN""","""COC(COCCC1=NC=C(C(C)(C)C)O1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""60E33179D39DF40F_4D3519720B27BDF5_6039_UN""","""COC(COCC(N(CC(OCC)=O)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""91A0A7655881D1AD_D1D7F0D657D5F205_6039_UN""","""COC(COCC1=CC(=C(C=C1)SC)OC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""5F76804A4335F458_3DAA657658DB308E_6039_UN""","""COC(COCC1OCCC2=C1C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""2A5832266A62D6B4_870C4313E85C79FC_6039_UN""","""COC(COCC1=CSC(=N1)C(OCC)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""FDED37D675205E78_5E5811A529EC8663_6039_UN""","""COC(COCC1=N[N](C(CC)CC)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""79F7B2D24423940C_BD4B02A9279D63AF_6039_UN""","""COC(COCCCC1=CC=CC(=C1)OC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""3E076E5A6D2EF866_146C935E00703AC8_6039_UN""","""COC(COCCC1=CC2=C(C=C1)OCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""9F28746F1CB1ABB9_6889A404158E350F_6039_UN""","""COC(COCCN1CCN(C(C)C)CC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""FA80E6B8EE82B258_672FC2F1F6544723_6039_UN""","""COC(COCC2=C1C=CC=CC1=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""FE4C954E90A821BC_45D2B47A6E9A6A19_6039_UN""","""COC(COCC2=C1OCCOC1=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""16199824092ED145_411525330C22B7B5_6039_UN""","""COC(COCCOC1=CC=C(SC)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B07F9DC37897899A_F860A9A05763136E_6039_UN""","""COC(COCC1=CC=C(C=C1)OCC#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""157575A5B023B2D3_32F882C403B7E501_6039_UN""","""COC(COCCN(CCCC)CCCC)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""63A85C29F14AF50B_2DE28596DE97509D_6039_UN""","""COC(COCCC1=CC=C(C(O)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6B84B1439900C831_FFE92E1F3916B44F_6039_UN""","""COC(COCC1=NC(=NO1)C[S](C)(=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8201444CA1BC2DE6_46E09A9E3A6E1C7A_6039_UN""","""COC(COCC1=NC(=NO1)C2=N[NH]C=N2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""DA287CB8B627CA5B_5FB3B4FA5DA078C4_6039_UN""","""COC(COCC(C1=CC(=C(C=C1)F)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A58C7315138A1293_1307367D77B59D35_6039_UN""","""COC(COCC2=NC1=C(C=CS1)C(=O)N2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""94513803A8848850_4A893D45315BE53F_6039_UN""","""COC(COCCCNC(=O)C1CCCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""661A18CE08D7711C_8BCF430830EDAF64_6039_UN""","""COC(COCCN[S](CCCOC)(=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""5082535543DF0964_BEF9168FD28C80A9_6039_UN""","""COC(COCC1=CC=C(OC(C)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A48B22CFCC2723AE_4717154D178551BC_6039_UN""","""COC(COCC(C1=CC(=CS1)C(O)=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""94B2FBFDBCEDE33A_60C5F2F6A036C8EA_6039_UN""","""COC(COCC1=NOC(=N1)C2=COC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""BB834E55701CB7BA_2671F024E22F53F5_6039_UN""","""COC(COCC(C1=CC(=CS1)C(N)=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2240ACF9C65F8C51_B49485E684461D67_6039_UN""","""COC(COCC1=NC=C(O1)C2=CC=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""8A963E487961762C_F1A9428825AE143A_6039_UN""","""COC(COCC(=O)NCC1=CN=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""AEFA82FB39CBF25A_6CD8089DA061A91F_6039_UN""","""COC(COCC2=CC1=C([N](C)N=N1)C=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""2D80216FD77EBB2A_E433F79BDAD6ED29_6039_UN""","""COC(COCCNC(=O)C1=NC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9FD327C6F2F96860_8906D77CE5EBC8F6_6039_UN""","""COC(COCC1=C([N](C)N=C1)C(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8C4BD6FB9CE45BDE_8861A702B0CDF019_6039_UN""","""COC(COCC1=NC(=NO1)CCC(C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""3AC74214F6A30F9A_BA9D5AC79F36E846_6039_UN""","""COC(COCC1=NC(=NO1)C(SCC)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1D50A58D4DA935DF_6ED79EACE41119A6_6039_UN""","""COC(COCC1=C[NH]C(=N1)C2=CC=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""40767E94436D0525_FE91F0009FBD5B08_6039_UN""","""COC(COCC1=C(OC)C=CC(=C1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""CA898D9D53FE857F_7FE50109C19E2F26_6039_UN""","""COC(COCC1=CC2=C(C=C1)NC(=O)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""D9733A127751B5A7_553FA1CFA2915C36_6039_UN""","""COC(COCCOC1=CC=CC(=C1)OC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9BFEE4E8F511B183_0991F23245262B0B_6039_UN""","""COC(COCC1=CC=C(C(OC)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2797491ED847A401_BDBECA935E1037C6_6039_UN""","""COC(COCC(NC(NCC(C)C)=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""2B85034B60D9154C_1F383FCD75C53E78_6039_UN""","""COC(COCC(NC1CCC(C)CC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""16C4411ADD282748_FD2796070A4C7192_6039_UN""","""COC(COCC1=NC(=NO1)C2=CC=CO2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""10449238B164C757_9FDCCD94AC55A44F_6039_UN""","""COC(COCCOC1=C(C)C=CC=C1C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""076042A6FE1815CF_8C536C8C36247CB1_6039_UN""","""COC(COCC1=CSC(=N1)C2CCCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""7E82FE08BCB2EF15_0B0EDCC809F0ADC3_6039_UN""","""COC(COCC1=NC(=NO1)C2CCCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""884B1C626799D49F_9A1A03C7BDA89F41_6039_UN""","""COC(COCC(N(CC(C)C)C(C)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""1EB4D4DAB7E89E88_A23E31D729E54AAE_6039_UN""","""COC(COCC1=CC=C(CC(O)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1789151D032F1463_394969C8799FCE27_6039_UN""","""COC(COCC(NCCOCCCC)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""6E4F6F411D2089F5_C1AFF9EA2978CA39_6039_UN""","""COC(COCC1=CSC(=N1)C(OCC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""74FD2035AB2272D3_B7356F3445EE041F_6039_UN""","""COC(COCC1=NC(=NO1)C2=CC=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""DB4E3776772C677F_16B79A50B7B7F234_6039_UN""","""COC(COCC(=O)NC(C1CC1)C2CC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""418505207E5D8217_D3703DC3901E012B_6039_UN""","""COC(COCC2=NC1=C(SC=C1)C(=O)N2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""1276C15B8C598FBD_E24CA1041BC2D36A_6039_UN""","""COC(COCC(=O)NCCC1=CC=CS1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""329E9147CCCBA3D6_3E93AD6467BB857C_6039_UN""","""COC(COCCN1C(NC(C)(C)C1=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""503729973E899C00_A5BD77BEFEBEA8A8_6039_UN""","""COC(COCC(NC(C)(C#N)C1CC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""46F57849702999A6_0090F4E0F2D8E542_6039_UN""","""COC(COCC2=NC1=C(C=CC(=C1)F)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""AC80F883CC8A6064_6336D17FCE228345_6039_UN""","""COC(COCC(NC(C(C)C)(C)C#N)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""D067232E1027AACA_1E833C7B90DE075A_6039_UN""","""COC(COCC1=C([N](=O)=O)C=CC(=C1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C081F5909F60062C_9FF32B34BD3DBA8A_6039_UN""","""COC(COCC1=CSC(=N1)CC(NC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B72B10BB7A5B1172_473AB1908085C1AF_6039_UN""","""COC(COCC1=CC=C(N(CC)C)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6DFC76BAADA7C3FF_FC23F4C8011AEF05_6039_UN""","""COC(COCC1=CSC(=N1)N(C)C2CC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""44EE9E0A0FC31708_B5DD9CF5FA7057EB_6039_UN""","""COC(COCC1=NC(=N[NH]1)C2=CC=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""6EB8528C18C60994_1F0848B481ABA36C_6039_UN""","""COC(COCC1=C(C)SC(=C1)C(OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""80D1003028B96179_A6BD6833AF4E22E6_6039_UN""","""COC(COCC(=O)NNC(=O)C1CCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""CD209DDACCEB50A2_8086E832F4BBE3F0_6039_UN""","""COC(COCCCOCC1CCCCO1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""466AE7D6BF1FCFB6_9E7E7F54494FD04D_6039_UN""","""COC(COCC1=C(C=C([N](=O)=O)C=C1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1DBBC0E7901AA768_8952782D638D210F_6039_UN""","""COC(COCC1=C(OC)C=C(C=C1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6C48DB7DA558A912_03AFE11D91251996_6039_UN""","""COC(COCC1=CSC(=N1)C2CCCO2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""3A31FB31ABC37044_5E4F39E9CB813413_6039_UN""","""COC(COCC(=O)NCC1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""527532FE9DA96DAA_FA4D0366016040D7_6039_UN""","""COC(COCCCCCN1CCCCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""0ECBAC963F3FCC2E_477DD143A2375AB0_6039_UN""","""COC(COCC1OC(=C(C(OC)=O)C1)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""AC0FCD2971841F96_8196EBE76FD2F61D_6039_UN""","""COC(COCC1=C(ON=C1)C2=CC=CO2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""3B1E5E4535007EE1_D289218388C197FC_6039_UN""","""COC(COCC1=C2C(=CN=C1)C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""C3A1686B5B67BA87_A732F982486D49AF_6039_UN""","""COC(COCC(N(C)C1=CC=CC=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""AE43A21B5E90CA38_741A1E53298E702F_6039_UN""","""COC(COCC(NC1=CC=C(C)C=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""63C70898E2C929D8_84AF5EA455B8FF0F_6039_UN""","""COC(COCC(NC1=C(F)C=CC=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C0EB1F80E35225B0_58FDE115AF00B8EF_6039_UN""","""COC(COCC(NC1=CC=C(F)C=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""94C9F17F1BE4A90C_71FF6041E575FA29_6039_UN""","""COC(COCCC(C1=CC=C(C)C=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""68ED22DE31206283_61D96308E3D8F21A_6039_UN""","""COC(COCCCOCC1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EEF0CC0706ED03E4_EDFB065E9F9FFBFD_6039_UN""","""COC(COCC(N1CC(C)OC(C1)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C9D414F655E313A8_19D7CD1F34CEE33E_6039_UN""","""COC(COCC(NC1=CC=CC(=C1)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""648EC36057C39FD1_8F5031580F1A6192_6039_UN""","""COC(COCC1=CC=C(SC(C)C)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D0341C6F34A349C7_624174122BB193DF_6039_UN""","""COC(COCC(C1=C(C=CC(=C1)F)F)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""5BE6B4A03F37C643_4122412C5DBA53D3_6039_UN""","""COC(COCC1=NN=C([N]1C)C2CCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""5CCFB98CB39954B0_FE0765A8175BAAB1_6039_UN""","""COC(COCC(NC1=C(C)C=CC=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8186A5C4533E7287_0EC1C6054421B997_6039_UN""","""COC(COCC(NC(C(C)C)C(=O)O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""C722FB6A0E2A4D4A_EC182DFB2645446F_6039_UN""","""COC(COCC2=NC1=C(C)C=CN=C1[NH]2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""48ABBBB3FA52FF45_F7403F1FEE97394D_6039_UN""","""COC(COCC1=C(N=C(C)S1)C(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A4721AD050E08E1E_C945586B27AFC382_6039_UN""","""COC(COCC1=CC2=C(C=C1)[NH]C(=N2)C)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""EE97B025EB46F901_1ED4A0268AB10FF5_6039_UN""","""COC(COCC[N]1C=C(C(OC)=O)N=N1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F40E9D79D8A72F7A_A66B4C237A062545_6039_UN""","""COC(COCC(NC1=CC=CC(=C1)F)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B9EAE9A8968C2A0D_C4FB9BCA318DF6B4_6039_UN""","""COC(COCC(C1=CC=CC(=C1)OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""DB7DF7D363B11BB8_1A3A56A6379A5169_6039_UN""","""COC(COCC(NC1CCCCC1C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8F36626FD0389C5C_7426CB3F722B76CB_6039_UN""","""COC(COCC1=CC2=C(C=C1)N=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""25CD96B6FE6C73E5_6C98929CBF5A7AF4_6039_UN""","""COC(COCC(N1C(CCCC1C)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""17B4450A005E4629_B7F898C1A7D83D43_6039_UN""","""COC(COCCC2COC1(CCCC1)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""47BA4612C91B765C_8DC777001822934A_6039_UN""","""COC(COCC1=CC(=C([N](=O)=O)C=C1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""AFD9187BC903939A_47FAD9407F2BFD2F_6039_UN""","""COC(COCC1=CC=C(C(NC)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""5BCAB5A68330DFF6_353EC2B4DB571779_6039_UN""","""COC(COCC[N]1C(=CN=C1C)[N](=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A03397A9D6F3871B_B9B5F0FE4074296E_6039_UN""","""COC(COCC1=NC=CC(=C1OC)OC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""5D8C8818E8A26837_90DEA2AB04FCFC72_6039_UN""","""COC(COCC1=CC(=C(OC)C(=C1)F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""40BA523318518205_09006D9DA9631682_6039_UN""","""COC(COCC2CCC1(CCCCC1)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""65DE3FE671826051_1B6C3219A1394DCF_6039_UN""","""COC(COCC(C1CCC(F)(F)CC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""393E30269A6DF995_A865A914C5142EBF_6039_UN""","""COC(COCC1=NC=C(C(F)(F)F)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""0D29D7F19C1CFE24_713CDF3D13D0861E_6039_UN""","""COC(COCC1=CC=C([Si](C)(C)C)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EB327286AFF785D1_76AD77C12D3F2EBD_6039_UN""","""COC(COCC1=NN=N[N]1CC(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""5968A2AC2EDF681D_3D2232B58DA9178D_6039_UN""","""COC(COCC1=N[N](CC(F)(F)F)N=N1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C36760B7252DDD77_8FB90AF5D0E97B51_6039_UN""","""COC(COCC1=CC=C(C=C1)C2CCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""C281CB3DCAE69BD4_07C0FDA4DE022DDE_6039_UN""","""COC(COCC1=NN=C2[N]1CCCCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""AD60EF0BB4D87A6C_2AB0A99AF2E27F72_6039_UN""","""COC(COCC1=CC=CC(=N1)C(OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""7B0E28C38274D6F7_D9C75B7B94E93F69_6039_UN""","""COC(COCC1=C([S](N)(=O)=O)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B8A2C3A9BC62213A_13C8EE806C775C3A_6039_UN""","""COC(COCC(C(C(OCC)=O)(C)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""730B027A380ED9CF_6403F9CC87AEA900_6039_UN""","""COC(COCC1=CC=C([S](Cl)(=O)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""02680D3E054FC026_984882825C18486E_6039_UN""","""COC(COCC1=CC2=C(N=C1)C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""5F5256A2D87D1C16_0C6FD68BD11E15A2_6039_UN""","""COC(COCC1=CC=C([S](C)(=O)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2A48384F855C7788_B4A1F47ED465B655_6039_UN""","""COC(COCC1=C(C=CC=C1)[S](=O)(=O)Cl)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2A668D004DACFEDD_84AAD32C1288CA3F_6039_UN""","""COC(COCCCC1(CCOCC1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""626A3979092F8711_CDCF178E1B82BD1B_6039_UN""","""COC(COCC1=C(OC)N=C(C=C1C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F4AB9F7A866E6164_DFDC72851E8A8120_6039_UN""","""COC(COCC1=CC(=CC=C1)[S](=O)(=O)Cl)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1531E167E57A1AA2_504FAEB2533EBDAF_6039_UN""","""COC(COCC1=C(C(F)(F)F)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6C7C57EB02A0A256_988AAA9A3796D739_6039_UN""","""COC(COCC(=O)COC1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""70D38D6A231694A3_8C9CB8ECBF7420E1_6039_UN""","""COC(COCCC(CC(OCC)=O)(C)C)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""A4D63B1D567E6270_BC9711008EAEAB36_6039_UN""","""COC(COCC1=CC=C(NC(C)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""506CFE473D436085_C476F3D613753DC6_6039_UN""","""COC(COCC(C1=CC(=NC=C1)OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F4AB9F7A866E6164_F623EF201B1CE549_6039_UN""","""COC(COCC1=CC=CC(=C1)[S](Cl)(=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""242AC479A5025948_8CA778D13BAB3039_6039_UN""","""COC(COCC1=CC=C([S](F)(=O)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2A49C42B48365EE4_0DF8AEC414638BF7_6039_UN""","""COC(COCC(C1=CC=CC(=N1)OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1F7CD28576552378_097AE26C2C728532_6039_UN""","""COC(COCCN1C2=C(CC1)C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""C8B9E4A9C21E4272_DAA6105734261189_6039_UN""","""COC(COCC1=C(N=C(C(C)C)C=C1)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A41DCF427146B90C_DF39B0C9E268C161_6039_UN""","""COC(COCC1=NC(=CS1)C(OCC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""4E6F87F7185C929B_41D088BC917E3382_6039_UN""","""COC(COCC1=N[N](CC(F)(F)F)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""666B17B9F4007DDD_7BC261A067E1FAD4_6039_UN""","""COC(COCCN(C)CC1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6CC0670435D8D340_C6F0982CE5668F9A_6039_UN""","""COC(COCC1=CC=CC(=C1)[S](C)(=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6A27AC3E2DE95FF2_82A177B588097288_6039_UN""","""COC(COCC1=C[N](CC(OC)=O)N=N1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""02B6A99A305C5BD8_8EE067986A6B52A3_6039_UN""","""COC(COCC(N1CC(CC(C)C1)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D6DC9013D62C69FE_AA0C8589CF778A41_6039_UN""","""COC(COCC(N1CCCCC1CC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""5A4B57DA72C48B28_91F23070156B65D1_6039_UN""","""COC(COCC1=CC=N[N]1C2CCCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""F465F1FB848D0DD7_D40EADAFDC416EDD_6039_UN""","""COC(COCC1=CC=N[N]1CC(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B8787399F209D7BD_23C8363331DF987E_6039_UN""","""COC(COCC2COC1=C(C=CC=C1)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""835C3A9ECD5B8DFD_4BBD04438894F2BC_6039_UN""","""COC(COCC(N(C)CC1=CC=CO1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A72A417EA527DDB5_7D43B0B329911E92_6039_UN""","""COC(COCC(=O)CCC1CCCCO1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""298C0960EF6890F8_B3E347E889D4A745_6039_UN""","""COC(COCCC(NC1=NOC(=C1)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""FDE752DBBCC86C12_A01EE2C07C4B19AF_6039_UN""","""COC(COCC(=O)NC1=C(C=CS1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C13C63C2ACA109CA_3F079244035DEA0D_6039_UN""","""COC(COCC1=NOC(=C1)C2=CC=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""503DC3CC5C235748_CA1F6711BCCE1779_6039_UN""","""COC(COCC(OC)CC1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""76896F5033B19491_BE86254EE25A66B0_6039_UN""","""COC(COCCOC1=C(C=CC=C1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""214F6721B266842F_46A6C85BA69C8E54_6039_UN""","""COC(COCC(NC(NCCCC)=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""905D712A179A980B_6BB3DEFAC458754E_6039_UN""","""COC(COCC2=NC1=C(C=C(F)C=C1)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""96FC25D25E96305B_188260443C92858E_6039_UN""","""COC(COCC1=C(ON=C1)C2=CC=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""453E463E064297AC_285F00274EA3C4FB_6039_UN""","""COC(COCC1=CSC(=N1)C[S](C)(=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""275387A22AA3D9F5_37A20FB8F8D42383_6039_UN""","""COC(COCCC(CC)(CC)C(=O)OC)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""6D429C1F1B8A7A49_A7D54C89192D0F6E_6039_UN""","""COC(COCC(C1=C(OC)N=CC=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""09991589C25EF5A5_97CD5B2C6FB6A61A_6039_UN""","""COC(COCC(C1=C(C=C(C)C=C1)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B16580FDAFD9F1A9_48E0F47851501579_6039_UN""","""COC(COCC1=CC(=C(N(C)C)C=C1)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""CB10FFEBA42816F6_F09A752693C68CD7_6039_DP""","""COC(COCC(NCC1CCCNC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""91219EAE27BC0CA2_7E9A46A998B49472_6039_UN""","""COC(COCC1=CC(=N[N]1C)C(OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D04056221E8A78A5_4390994A45FE3C46_6039_UN""","""COC(COCCOCC(C(F)(F)F)(F)F)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""19077DF1E365E8EF_55DBE1B1B2BFA4B9_6039_UN""","""COC(COCCCC1=C(OC)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2DFD45ABC543E3EA_214DE4A33BA7DAEC_6039_UN""","""COC(COCC1=C(C(OC)=O)C=CC=N1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""E610E3E630BD7EA0_BC4934B1EB02650E_6039_UN""","""COC(COCC1=NC(=CC(=N1)N(C)C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""81032ED1FDC16182_623EC0D56688A997_6039_UN""","""COC(COCC(N(C)CC1=CC=CS1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C6756E73CCF720C5_5947BB617851ED5D_6039_UN""","""COC(COCC1=NC(=NO1)C(OCC)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""29CB251AF72534D8_C72FAE57C266D1EE_6039_UN""","""COC(COCC1=NC(=NO1)CC(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9C3ACC0D5559950D_66A63D4512B3F1F3_6039_UN""","""COC(COCC(=O)C1=CC(=CC=C1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1D4523B3B1793CAF_50F6F8C29F4BD3F6_6039_UN""","""COC(COCC1=N[N](C=C1)C2CCCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""DE81C5DE1C6E4E37_0CB6700BB0EC6D04_6039_UN""","""COC(COCCCSCC1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""7600AA8FFBE9ACB3_FD302FEA02AE4110_6039_UN""","""COC(COCC1=C(OC(F)F)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""DA951BC9333FAB42_C80F3F31DFF86C1C_6039_UN""","""COC(COCCCCOC1CCCCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B7FB8B91DBABF27B_44135F7623A5975B_6039_UN""","""COC(COCC1=CC(=C(OC)C=C1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F6DB89AF8D86DE38_792DCF33C87D8F14_6039_UN""","""COC(COCC1=CC=CC(=C1)NC(C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1529ACDB3547642F_5141C653212480E1_6039_UN""","""COC(COCC1=CC=C(OC(F)F)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""135A396DC62D2ACC_64B2455DFF809BE6_6039_UN""","""COC(COCC(C1=NC=C[N]1C(C)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""FA51DB060EACE3AD_D174B7B422B814E1_6039_UN""","""COC(COCC1=N[N](C)C(=C1)C(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""19C037EE2121ABA7_A5ACE62112D115D4_6039_UN""","""COC(COCC1=CC(=N[N]1C)C(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F594D08717364343_28D51A368F0543F6_6039_UN""","""COC(COCC(NC(CCCCC)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""3B7C68C06C0B517A_1941E75CE92D5062_6039_UN""","""COC(COCC1=C(C=CC=C1)OC2CC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""9E384EECEF6E5390_32AEFA2D2556AE7A_6039_UN""","""COC(COCC(NC1=CC(=N[N]1C)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""20F79D036721BE2D_5D085F4E9B0B4B1A_6039_UN""","""COC(COCC(=O)CCC1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""4C258EB49B986F1D_AE9DB02E9E8D2B0A_6039_UN""","""COC(COCC(C1=N[N](CC)N=C1C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B061195612B31D92_FAC96DD1CD0B2A9E_6039_UN""","""COC(COCC1=NC(=NO1)CC(NC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1ABAEA16B2C465D9_820DE64EB944189D_6039_UN""","""COC(COCC1CN1CC2=CC=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""A9C4939FEB4FDD9F_48C200BF06E5A42B_6039_UN""","""COC(COCCO[S](C[S](C)(=O)=O)(=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""C67BE13ACD5DD057_94B4E8055BC87093_6039_DP""","""COC(COCC2=CC1=C(CCNC1)C=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""0D461A3995CB80BF_762E95734A3657A7_6039_DP""","""COC(COCC(N[C@@H](C(C)C)C(=O)O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""B694F9A4CC1A2EFA_F8F2A2F72EBCBD96_6039_UN""","""COC(COCC1=NC(=NO1)C(OCC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A63BCD54F80A41A5_5A4F7B841341C63E_6039_DP""","""COC(COCC(N[C@H](C(C)C)C(=O)O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""B07CEA42313D4262_751A41C13CE8057A_6039_UN""","""COC(COCC1=CN=C(C(F)(F)F)N=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""FB2F57ADFDA65EB9_724BB25B4053A266_6039_UN""","""COC(COCCC2=NC1=C(C=CC=C1)[NH]2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""16806A9500F353CE_B713F91B9EC87DC7_6039_UN""","""COC(COCC1=CC=CC(=C1)C(C)(C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EB85DDBE83192AA5_54DEDE5F88910C59_6039_UN""","""COC(COCC1=NC=CC(=C1)OC(C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B1EC9CC91451E537_F19BDD94CA8FA141_6039_UN""","""COC(COCC1=C(C=C(C(O)=O)C=C1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""06193316BA3BD9D1_EA18044A12992C31_6039_UN""","""COC(COCCCN(C)C1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""CC6983EB345E5ADE_705700B4A1B14CDB_6039_UN""","""COC(COCC1=C(F)C=C(C(=C1)F)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D135DB03491AFE9F_3C79E9D75006F2E7_6039_UN""","""COC(COCCSC1=CC=CC(=C1)OC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D4E826057075CDB9_EF45C14FFF86D5DD_6039_UN""","""COC(COCCC1=NSC2=C1C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""A79DB3970B2D9883_D2FCE91D25272420_6039_UN""","""COC(COCCC1=NOC2=C1C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""5C263AAC8632776B_6112F7617CDCE0C6_6039_UN""","""COC(COCC1=NC2=C(N=C1)C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""AE5BA84C5661C5DE_2149202EC7BA915B_6039_UN""","""COC(COCCO[P](OCC)(=O)OCC)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""A7022268A285DA08_52B3A13509883841_6039_UN""","""COC(COCCSC1=C(C=C(F)C=C1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""26F2F2E26AF9F6AA_8D5FAC69DFD53DB7_6039_UN""","""COC(COCCCOCCOCCOC)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""AB55B31DAD4956A5_0817ABB7B70D1CD5_6039_UN""","""COC(COCC1=C([N](=O)=O)C=C(C=C1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""09C53F5EBF2AC908_D6A3D05C133B54B0_6039_UN""","""COC(COCCC1=N[N](C(C)(C)C)N=N1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9EF7A8445D136987_DDEA1793997C4D97_6039_UN""","""COC(COCCC1CCC2=C1C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""3EA7AA550A6700FD_91E0E31579A91F1E_6039_UN""","""COC(COCCCC(CC(OCC)=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""59E8E4FF18654612_E5AF60FCB20DEC9E_6039_DP""","""COC(COCC1=CC=CC2=C1CCNC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""80EB65B901034FB8_450EF6DE3519EA99_6039_UN""","""COC(COCC(OC)C1=CC=C(C=C1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""60A36D1383C3B1B3_55BD6D1C0B187E00_6039_UN""","""COC(COCC2=NC1=C(C=CC(=C1)C)S2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""944EDB92330032AF_0B4DD76F5DDD7D4C_6039_UN""","""COC(COCC1=C(C(F)(F)F)N=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EE7216073D910189_47C3F90C1B3081F7_6039_UN""","""COC(COCC(N(CC)CC(F)(F)F)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""D9BFC1614A1C26C7_5205405CEE6C30D8_6039_UN""","""COC(COCC(NC1=C(C)C=CC=N1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D27923DC9531C50D_F15B2EF44398C675_6039_UN""","""COC(COCC1=CC=CC(=C1F)[N](=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""4A8C87E0E5CB85D5_3CCCF58412B7794E_6039_UN""","""COC(COCC1=CC(=NO1)C(OCC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""3CACF7D35E491419_FAEA857007563104_6039_UN""","""COC(COCC1=CC2=C(C=C1)C=CN=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""F7ABDBA504BD67D5_205FB2C84358D306_6039_UN""","""COC(COCC2=C1CCOCC1=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""F2D54052645B726F_81949C200E2A911C_6039_UN""","""COC(COCC(NC1CCN(C)CC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""7A9381E541FBAFBD_CE86C12339C89767_6039_UN""","""COC(COCC1=CC(=C(C)C=C1)[N](=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C243FC11964C8ED0_423B30389C4383B9_6039_UN""","""COC(COCC1CC2(CO1)CCCCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""1D3C0F8FB4738116_C956ED7C727A2D4E_6039_UN""","""COC(COCC1CC2(CO1)CCOCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""030C764E04E67CFA_491D5E680BC11948_6039_UN""","""COC(COCC1=CC2=C(C=C1)N=CC=N2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""02444ACB3AB51AFC_FD432C0515EFC71F_6039_UN""","""COC(COCC1=CN=C(C(OCC)=O)S1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""988DC49E9605EB6D_6945729099B194A4_6039_UN""","""COC(COCC2CCC1(CCOCC1)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""F56C37CAB17120D6_2442837CD6B4A158_6039_DP""","""COC(COCC2OCC1(CCNCC1)C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""AAE5A418E1EA8688_C76BBCB2F1ADEF95_6039_UN""","""COC(COCC2COC1(CCCCC1)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""DE2181674763F1E6_89CAF681D8BA7FC4_6039_UN""","""COC(COCC(N1CC(C)(C)OCC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""752D5A1CA98D33F1_3379757FE52738F2_6039_UN""","""COC(COCC(C1=CC=C(OC)C=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""BBD7AA4DE4BC57D5_024A0F4F4A9FD995_6039_UN""","""COC(COCC(=O)N1CC2CCC(C1)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""8871C38560516121_19D931E4310A5581_6039_UN""","""COC(COCC(C1=CC=C(F)C=C1)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B8903632ED0B479E_37EF2EB33899A314_6039_UN""","""COC(COCC(=O)NC1CCCCCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""657F2CE09B88850E_6C462186E2CC881A_6039_UN""","""COC(COCCCOC1=CC=C(F)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F785B28321099C50_9D19FDE3D3686BB9_6039_UN""","""COC(COCCOC(=O)C1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8CAF88F072CE8C7C_D0B8FCDEDF6E1CC5_6039_UN""","""COC(COCCC[S](NC(C)(C)C)(=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""3C927A1F435F60B8_76F214EC0E89FC0B_6039_UN""","""COC(COCC(C1=C(OC)C=CC=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2F24F7B3A582418C_1A973A0CE6FDF084_6039_UN""","""COC(COCC1=CC=CC(=C1)C(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""02759F0560470F93_BAF1E8BA40331435_6039_UN""","""COC(COCC1=C(F)C=C(C(=C1)C#N)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""25736ECB44E5FD26_FCD360A67A31EAC6_6039_UN""","""COC(COCC1=C(CC(C)C)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""0BB989833574BE00_0082494BF6627DA3_6039_UN""","""COC(COCC(=O)NCC1CCCCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""882B0D67678384AE_509BB78EEA0111AC_6039_UN""","""COC(COCC(N(C)C1CCCCC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""89199F94F0005751_3546813AB3FD780F_6039_UN""","""COC(COCC1=NC(=NO1)COC(C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""944E057A99256900_690CAF6B973F4F6A_6039_UN""","""COC(COCC2COC1(CCOCC1)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""98D47EEBBAE951EC_0DAB57421B85EAEB_6039_UN""","""COC(COCC1CCCC(C(F)(F)F)O1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EB442C3A96BB854D_F9BC4F3EF0304E10_6039_UN""","""COC(COCC1=NSC(=N1)C(OCC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9B7D29E01E5325EC_9DD4714FFF43BA63_6039_UN""","""COC(COCCCCCCCCCCC)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""B2D9E2CFD3D78DD7_A781D27FD5011882_6039_UN""","""COC(COCC1=NN=C2C(=O)NC=C[N]12)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""D75FA3228C8F364D_2A05C6D05840CDF3_6039_UN""","""COC(COCC1=NC(=C(S1)C(C)(C)C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8E55E13A9407C8DB_D83C1CD3AA9D7A02_6039_UN""","""COC(COCC1=CC2=C(C=C1)C=NC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""8342EED612FBC64A_653742C3A5479B61_6039_UN""","""COC(COCC1=C(C)C=C(C=C1C)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C880E3967958BF56_C56AD2A4237BB6C5_6039_UN""","""COC(COCC1=CN=CC(=C1)C(OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""40CCC31F7591F3BA_BC6BE7FF60F78191_6039_UN""","""COC(COCC1=CC=CC(=C1)[S](F)(=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""4F12FF9802D39BC7_4131C43847505BA1_6039_UN""","""COC(COCC1=C(CC(C)=O)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""30CEB3F20999913E_2705005525B4681C_6039_UN""","""COC(COCC1=CC(=NN=C1C2CC2)C)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""9E0321945D213856_389AEDC8F8E818DE_6039_UN""","""COC(COCC1=CC=CC(=N1)C(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""76CC7A628E62B53E_0E7354E81DF857D9_6039_UN""","""COC(COCCCN1CCC(F)(CC1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2607590EEC1D1FA9_068290F8CB9CC99F_6039_UN""","""COC(COCC1=C(C)C=CC(=C1)[N](=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9526CDDD33BF2323_F93CDBE92FC532CA_6039_UN""","""COC(COCC1=C(C=CC(=C1)C(O)=O)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""26CEAE5C590C6DCE_50CB280D70F0572B_6039_UN""","""COC(COCCNC(=O)C1CCOCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2CCC1F93B2B0D119_FFE88774D7B7698D_6039_UN""","""COC(COCC1=NC=CC(=C1)C(OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""77C4A06E2E067971_39CA4C2AA9908066_6039_UN""","""COC(COCC1=CC2=C(C=C1)COCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""A0B7653B22B81668_A23F230CBF1695B4_6039_UN""","""COC(COCCOC1CC[S](=O)(=O)CC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""032AD24B4A860567_F8D011A3D0339F9F_6039_UN""","""COC(COCC1=NSC2=C1C=CC(=C2)F)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""91C307618400579A_5410B5630F2F0160_6039_UN""","""COC(COCCCNC(C(CC)CC)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""940F304679216098_65AC37A8675BC863_6039_UN""","""COC(COCC1=C(F)C=C(C=C1F)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""3BC421E7E5A9D65D_84D18AA9BF916A5E_6039_UN""","""COC(COCC1(F)OC(=O)CC12CCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""4D495F0CBE1DBFC3_AD46C5EE6F17D798_6039_UN""","""COC(COCC1=C([N](C)N=N1)C(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2F5FBA08A69E4F27_13403C9FB44DAA57_6039_UN""","""COC(COCC1=C[N](C)N=C1C(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8DE0DB93A2CC29BD_4512C0187D2CAAF4_6039_UN""","""COC(COCC1=CC(=C(OCC)C=C1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6A00E57ECF2A7BCA_A34D3E77202D9B25_6039_UN""","""COC(COCC2=NC1=C(F)C=CC=C1O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""9EB0E95F75283D6E_52C46277AE043699_6039_DP""","""COC(COCC1OCCC12CCNCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""D19A1727567EA8D0_BAD454B242C07F39_6039_UN""","""COC(COCC1=CC=C([S](N)(=O)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""7BFDB711FE867431_C2491910D38FE992_6039_UN""","""COC(COCC(C1=CC=C([N](=O)=O)O1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EE795A874653ECC0_59B8883CE44167BB_6039_UN""","""COC(COCC1=C([S](C)(=O)=O)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""76A7EA1D980EA955_409475CD94C5F280_6039_UN""","""COC(COCC1=NC(=NO1)C(OC)(C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""148D5A273DF86BC0_E6A049F48DA10544_6039_UN""","""COC(COCC(NCCCOC(C)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""0202DF33F5D8A132_5CB9FF3D3DA89635_6039_UN""","""COC(COCC1=NCCC2=C1C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""DAAB215B0F0D1D58_A8E75E20D883B808_6039_UN""","""COC(COCC1=CC=C(SC(F)F)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C4CE313B9E361BF3_103E6C443A6EFD07_6039_UN""","""COC(COCCC(=O)NC1=NC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""E2A957C0E2492D86_1A38BAB925DAA6DA_6039_UN""","""COC(COCC1=C(C)OC(=C1)C(OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""730B027A380ED9CF_A084D0ADA33E5A90_6039_UN""","""COC(COCC1=CC=C(C=C1)[S](=O)(=O)Cl)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""839804701247B820_5BF06980BE73F19C_6039_UN""","""COC(COCC1=CC=CC(=C1[N](=O)=O)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""DC4587827CD6F84D_AF08667A35336DC2_6039_UN""","""COC(COCC1=CC2=C(C=C1)C=CC=N2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""AA535CD2C56B0E9C_8F76CEF797CA6874_6039_UN""","""COC(COCCCOC1=C(F)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""3D9389A3BD3E01C3_D129F9AEB9A98027_6039_UN""","""COC(COCC1=C(C=CC(=C1)[N](=O)=O)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""3B3AE3867EC9A39F_B457DA94EB80B5DD_6039_UN""","""COC(COCCCNC(CC(C)(C)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""3ED2307A9BC7C925_432CD4EC2A31F509_6039_UN""","""COC(COCCC(=O)N1CCCCCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""9D0A5A7371060F66_A5F78CB946A68481_6039_UN""","""COC(COCC2=NC1=C(CCCCC1)S2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""F6038116C5011BB1_F1DD31777406770D_6039_UN""","""COC(COCC1=CN=CC(=C1)C(C)(C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B5FA443037274B63_332CC20F1294861F_6039_UN""","""COC(COCC2CCCC1(CCOC1)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""9B9308D7948FD638_A0CB81C150B23D59_6039_UN""","""COC(COCC(N(C)CC1=CSC=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""82FA54BA544A4CC9_5E4D0CF9DE9E6C37_6039_UN""","""COC(COCC1CCCC(F)(F)C(N1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""333B9AB5C32FD1A3_F5830EEE4198C19F_6039_UN""","""COC(COCC1=NOC(=N1)N2CCCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""D8A6D49207FDAC63_4E6E5FFB1B05D9D9_6039_UN""","""COC(COCC1=C(C)OC=C1C(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""94B87155F6C8D940_C32371ED1AD3E1AB_6039_UN""","""COC(COCC2=CC1=C(CN(C)C1)C=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""5919CE444CCA9B0F_0179750ACFA575F8_6039_UN""","""COC(COCC1=C(C(OCC)=O)[NH]N=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D6E0E29C7C41E846_9EB9E0EA973F4189_6039_UN""","""COC(COCC1=CC(=C(C)O1)[S](=O)(=O)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D9522162656E76F3_7A3287F4199FCB7C_6039_UN""","""COC(COCC1=CC=CC2=C1N=C(C)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""A9E4608F3DC242C3_E7937014D4269998_6039_UN""","""COC(COCC(C1=CC=CC(=C1)OC)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""AC395056779A7B59_7317D06505AF6861_6039_UN""","""COC(COCC1=NN=C2[N]1CCOCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""8326F3D5D4572C56_FC1C3E0DE04E0093_6039_UN""","""COC(COCC1=CC2=C(C=C1)CCOC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""AFD05079BF538509_A888F6EE49807E1A_6039_DP""","""COC(COCC1(OC(CC12CNC2)=O)F)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""CB6DB9E6447C1636_507C3D4900FAB5E7_6039_UN""","""COC(COCC2=NC1=C(CC(C)CC1)S2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""4C876A8F7F23F66D_AD5452CD4A1232D9_6039_UN""","""COC(COCC(C1=CC=C(SC)C=C1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""48116EAFC511575F_78DBDF917DB473CB_6039_UN""","""COC(COCC1=CN=C(C(OC)=O)C=N1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""438DFF5ADEBD8256_C1AA06D3A6AD11A7_6039_UN""","""COC(COCCC(N1CCN(C)CC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""62F3E5EDCCE80D28_1F4A6B5449A60DBA_6039_UN""","""COC(COCC1=C(C(F)(F)F)C=CC=N1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D5283DBEFE5B6B3B_4535460C1F674DC7_6039_UN""","""COC(COCC1=C(C(OCC)=O)SN=N1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""01295F33DD475CE5_5BE0703111C657A8_6039_UN""","""COC(COCC1=CN=C2[N]1C=C(F)C=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""33FF40BBF9C76931_3C1F2F6FE3C880BC_6039_UN""","""COC(COCCCC(=O)N1CCCCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D904C72A11369D5C_7236D6404E1109A9_6039_UN""","""COC(COCC1=C(C(C)(C)C)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EE1DD9DC9A12033C_F0CCD7F7CBFE28E2_6039_UN""","""COC(COCCC1=CC(=C(C(=C1)F)F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""37ADF035686C4A0B_41B056959683E7DA_6039_UN""","""COC(COCC1=NC=CC(=C1)[S](F)(=O)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""DA603DD4ADB12D61_16BADAEF9DB0CA5D_6039_UN""","""COC(COCC1=CN=C(C(F)(F)F)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EB543887BDE72EAF_E4A90F0F326300F2_6039_UN""","""COC(COCC1=CC(=NC=C1)C(F)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B8782FAF2CAD5C4A_5ABF82C4B4F6BE6F_6039_UN""","""COC(COCC(=O)C1=CC=C(C=C1)C#C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""5D4D3A22B10B959B_6ADAA8AB7D5B025B_6039_UN""","""COC(COCC1=CC=C(OC(C)C)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""61066D990CB1478A_D56C888E31AA4646_6039_UN""","""COC(COCC1=CC(=C(C(O)=O)C=C1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""91B50F5379BDC29B_665EC26B89E04179_6039_UN""","""COC(COCC1=C(NC(C)=O)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8A0376C458D61D44_8E3E6BB12C88DB51_6039_UN""","""COC(COCC2CN1CC(CCC1=O)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""128632E41544BB45_C7C9711ED6E9E199_6039_UN""","""COC(COCC1=NN=C(O1)N2CCCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""7E4DDDE9546DEA4E_8B8BF742989AC219_6039_UN""","""COC(COCC1=NOC2=C1CCCCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""C608DAC16335BEBC_D5DB1504F5B6AE5A_6039_UN""","""COC(COCC1=NOC=C1C(OCC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2E5D4508A4864FE9_760E4AC0DD0E272C_6039_UN""","""COC(COCC1=NOC(=C1)C(OCC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C86956F8ADF84B40_BAC4E83553304461_6039_UN""","""COC(COC[C@@H](C(C)(C)C)N[S](=O)(=O)C)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""140F83756FD0E1C5_051758732E160FF2_6039_UN""","""COC(COCC(=O)C1=CN=C2[N]1C=CS2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""7B77A307BAFEF89C_444660B28CB9F204_6039_UN""","""COC(COCCCOC1=CC(=O)CCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""3E1FC7F44D9B274A_F53F848669A72424_6039_UN""","""COC(COCC1=CC=CC(=C1)SCCC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""160B98884C393016_6F4A396AA33480EF_6039_UN""","""COC(COCCCC1=C(F)C=CC=C1F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""003E3E596B046B2E_A388E6D12A3221CF_6039_UN""","""COC(COCC1=NOC(=C1)C2CCCC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""C2AE287F4377EA59_325B372CA0C31ED6_6039_UN""","""COC(COCC1=CC=CC(=N1)C(C)(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6F53AEDF45A0A6EE_B908CF3FCD049124_6039_UN""","""COC(COCC(C1=CC(=CC(=C1)F)F)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""4D6B00E1071ED4DB_04321B877F2EB5C9_6039_UN""","""COC(COCC1=CC=C(C(CC)C)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""903415F4179836A1_08F3A6D1AD817086_6039_UN""","""COC(COCC1=CC=CC2=C1OC(=N2)C)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""4C68E6259AA6B780_D24D30181F2199F0_6039_UN""","""COC(COCC(NC(N=[S](C)(=O)C)=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""0B558BAE878FA0E4_ECE6CB04B65E7252_6039_UN""","""COC(COCC1=C(C(F)(F)F)N=CC=N1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""93354B849628A94C_B712AC648F82C6EF_6039_UN""","""COC(COCC1=CC=CC(=C1)[S](C)(=N)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""A39184150827CE06_5B7B799BA1B31E9F_6039_UN""","""COC(COCC1=NOC(=N1)C(OCC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""F7FD631BDB160613_4A457F577FB3446B_6039_UN""","""COC(COCC1=N[N](C)C=C1[S](=O)(=O)Cl)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""DAD4D956BEAE5756_752573BD126D8435_6039_UN""","""COC(COCC1=CC(=N[NH]1)C(OCC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""89FA50B49C69C877_74CAE9F4EF3C1D5E_6039_UN""","""COC(COCC2CC1(CCCC1)C(=O)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""F9FF2DF0980ECD43_102D113F76A63644_6039_UN""","""COC(COCC1=N[N](C)C=C1[S](=O)(=O)N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""69682578F9AC7867_1500308D035E9B72_6039_DP""","""COC(COCC2CCC1(CCNCC1)O2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""657FB0A58ECF40E8_7474BFBD4EE7A9A1_6039_UN""","""COC(COCC(OC1CN(C)CCC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""25CCA38825511DEE_4BFBEBF64EE3766C_6039_UN""","""COC(COCC1=CC(=NC(=C1)OC)OC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""74F9B6AB2F349D55_86C809720CEC444A_6039_UN""","""COC(COCCC1(C(O)=O)CCOCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""FE0834E8C2B957FC_DCD3BF1DDB5A1538_6039_UN""","""COC(COCC1=C(C(OCC)=O)C=NO1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""22B7C6589274BFB7_ECAE51EABF4E6D0D_6039_UN""","""COC(COCC1=CC(=NC(=N1)C2CC2)C)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""1807FEE21A908CBF_1FA358793E2812A4_6039_UN""","""COC(COCC1=CC(=NC(=N1)OC)OC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""20FC45BAE04BAA4C_713723098EE33C55_6039_UN""","""COC(COCC1=C(C(C)(C)F)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""E94E2476A5A81852_7DD3FC3DC4170996_6039_UN""","""COC(COCC1=C(C(OCC)=O)C=N[NH]1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""42BE0C73C7EDBBA6_C9BB1C1186573D59_6039_UN""","""COC(COCCOC1(CCOCC1)C#N)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""46AB2A7C7229C9B3_5B8ED0B1ED70D174_6039_UN""","""COC(COCC#CC1=CC=CC(=C1)OC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""13666F0747B4A8BC_310B818AE7CC28C3_6039_UN""","""COC(COCCCO[S](C(F)(F)F)(=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""3CB6C10BA775CF03_A035764217241C66_6039_UN""","""COC(COCC[S](=O)(=O)C1=CC=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""ED64D8EE7060935A_ABD96DF621B4D750_6039_UN""","""COC(COCC1=CN=C(OC)C=C1OC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""981635BE4567336E_204080DB99128170_6039_UN""","""COC(COCC1=CN=C(C(OC)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2FEE412A06EDC7D5_86CFC37F49EDF44E_6039_UN""","""COC(COCC1=C([S](F)(=O)=O)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""28090BA1FCD9AB61_5E3F1FAF544816C7_6039_UN""","""COC(COCC1=NC=C(C(C)(F)F)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""4720A32C3285486C_FB6A853BDB81F484_6039_UN""","""COC(COCC1CN1CC2=C[N](C)N=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""B064CF99A0CA1037_6F28881F5FDA928F_6039_UN""","""COC(COCC1=NC(=C(C=C1)[N](=O)=O)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""1A1DC780EC187BE3_1194D7990BAEAA32_6039_UN""","""COC(COCC1=CC=CC(=N1)OC(F)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""DCA845EB679C5D12_56811C9EF3CE970D_6039_UN""","""COC(COCC2=C[N]1C=CC=C(F)C1=N2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""54A5D6BD3D97A434_03915050B5B084EC_6039_UN""","""COC(COCC1=NN=C(O1)C2=CC=CO2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""97DF92E3E5458F31_6B375E17CA7E3D6B_6039_UN""","""COC(COCC(=O)C1CC2=C1C=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""150C89ED267B16C7_43E58B6ED14D54A6_6039_UN""","""COC(COCCN1CCN(CC1)C2CC2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""15109EE537F8A58C_652AC8B93C387CA4_6039_UN""","""COC(COCC(=O)N1CCCCCCC1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EF1B2A4E42F55130_2E065D7B742467BE_6039_UN""","""COC(COCC(NNC(C(C)(C)C)=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""A316125FA6418061_88793E29761C13C5_6039_UN""","""COC(COCC(C1=C(C)[N](C(=C1)C)C)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C1B97086E7D7873E_45CC4CD7A467EAA9_6039_UN""","""COC(COCC1=C(SC(F)F)C=CC=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""46A05D848D9E5565_2D1EB326A5B844ED_6039_UN""","""COC(COCC1=CC(=C(O1)C)C(OC)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""CFFF235FA2D02060_86094A4165B454B7_6039_UN""","""COC(COCCC1=CC=C([N](=O)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""C921A11D4FB9B0B6_E4A7A91485D69DFF_6039_UN""","""COC(COCCCCC(N[S](C)(=O)=O)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""E7AAF8A7957DE249_117F08A4A4EA4352_6039_UN""","""COC(COCC(=O)NC(=O)C1=CC=C[NH]1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""696D0070F255AB91_0CBCB61EC573EC0A_6039_UN""","""COC(COCCOC1=C(C=CC(=C1)C)C)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""4EBCC6589DBC360C_6266D45D602F72C9_6039_UN""","""COC(COCC1=CC=CC(=C1)OCCC)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""CCD1EFBBECB0561A_517BF6D54621F01A_6039_UN""","""COC(COCC1=C([N](=O)=O)C=CC=C1F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8F04E7880F31D4AB_136B053CF54666F1_6039_UN""","""COC(COCCCN(CC)CC(F)(F)F)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""0E2BAF928CE3059B_632560093B4EFA64_6039_UN""","""COC(COCC1=CN=C(C(C)(C)C)N=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""EE2A828E19E6F4B6_6B7BF94C5CF14526_6039_UN""","""COC(COCC1=NC=C(C(OC)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""8CFB906837B52512_09B19804F026C787_6039_UN""","""COC(COCC(N(C(CC(C)C)C)C)=O)C1CCCC1""",21,"""2862BB61C8E79137"""
-"""6DCCD34AF3A5FAA5_FA9D74806014FDAC_6039_UN""","""COC(COCC(N1CC(CC)OCC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""2E648148DD074663_14F5268162F5836C_6039_UN""","""COC(COCCC1=CC=C(C(N)=O)C=C1)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""41485C832CF729DE_B7E99EA977F4B0FA_6039_UN""","""COC(COCC(C12CC(C)(C1)OCC2)=O)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""2EC4345691ED4995_79D14919C1AEBC87_6039_UN""","""COC(COCC1=C2C(=CC=C1)N=CC=C2)C3CCCC3""",21,"""2862BB61C8E79137"""
-"""8BFC6327D6A4524C_935B98246552D554_6039_UN""","""COC(COCC(C1CCC(C)(C)CC1)=O)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""B5C2D226DD831B84_5E18509ECF042AFA_6039_UN""","""COC(COCC1=C(C=C(C(N)=O)C=C1)F)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""6E163061AFA99C1D_7DF2466511561EED_6039_UN""","""COC(COCC1=C(C=N[N]1C)[S](=O)(=O)Cl)C2CCCC2""",21,"""2862BB61C8E79137"""
-"""D9508A0C562D876F_B8D877B2821C479E_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NN=C(C)O3""",21,"""04D56EC84B8DDF50"""
-"""44A0CD86E9C0365C_7E71CF4FB3B86615_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCCCCC""",21,"""04D56EC84B8DDF50"""
-"""08AF1C7EAB99A685_F436F5660013DDF8_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(N(OC)C)=O""",21,"""04D56EC84B8DDF50"""
-"""E8E8C8004920D173_042D2D707A678F74_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NC=C[N]3C""",21,"""04D56EC84B8DDF50"""
-"""3C7362001971F203_3799A4B0FEC9E0C4_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCOCCCC""",21,"""04D56EC84B8DDF50"""
-"""49F5C9A533BBE33A_9D0D8C4E37E8EE17_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=CSC(=N3)C""",21,"""04D56EC84B8DDF50"""
-"""FD2A38CB09609349_A0776043970E9DF7_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCC(OC)=O""",21,"""04D56EC84B8DDF50"""
-"""774C95380F2AD648_0448A6BC0BDA5350_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=CC=NC=C3""",21,"""04D56EC84B8DDF50"""
-"""52C50FE29992FFC0_6E9F89B2539D6851_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC(OCC)=O""",21,"""04D56EC84B8DDF50"""
-"""DCF08EF4458B2468_D882DD26AD7AC9A7_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCCC(O)=O""",21,"""04D56EC84B8DDF50"""
-"""AED639C9BAAC1C9B_E807C5FA4CDAFBD6_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NC(=NO3)C""",21,"""04D56EC84B8DDF50"""
-"""97AF8570C5009D6A_CD75637CE1427BBA_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(=O)NCC#C""",21,"""04D56EC84B8DDF50"""
-"""9EECB2EA2D558E8E_7393186C658312B7_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(=O)NCC#N""",21,"""04D56EC84B8DDF50"""
-"""3F8AA3C921FDA7FA_02E2DDD497BD7A01_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC#C[Si](C)(C)C""",21,"""04D56EC84B8DDF50"""
-"""F21AAD63E1B40B42_822BF7F904C0715A_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCC(NC)=O""",21,"""04D56EC84B8DDF50"""
-"""6D3FA4804AD997E3_C7A70CCA08A4B509_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC(NCC)=O""",21,"""04D56EC84B8DDF50"""
-"""0293CADC197AEC0D_0F2A06411113DF87_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=CC(=NO3)C""",21,"""04D56EC84B8DDF50"""
-"""69DE5E4918489E1D_168651B563EF1955_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCCC(N)=O""",21,"""04D56EC84B8DDF50"""
-"""E4D83445A9516FE4_D1301102F11FCCCF_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=C[N](C)N=C3""",21,"""04D56EC84B8DDF50"""
-"""580CD5E7A5864E97_387D3D3E1E3B88F0_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC3=CC=CS3""",21,"""04D56EC84B8DDF50"""
-"""4FFAE7265396E4C1_9C7FAC28699AC089_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NON=C3C""",21,"""04D56EC84B8DDF50"""
-"""2BFA25F781EA5AAC_58E984607161D481_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCCCOC""",21,"""04D56EC84B8DDF50"""
-"""384A19617C42F107_058DF6203FD9001B_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC[S](F)(=O)=O""",21,"""04D56EC84B8DDF50"""
-"""98AB405924F86A10_A70C2AEE09A26CD8_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCOCC=C""",21,"""04D56EC84B8DDF50"""
-"""FBCD2DDC555AECC5_F0A157249CA02592_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC[S](N)(=O)=O""",21,"""04D56EC84B8DDF50"""
-"""4167B52399929880_F118A72410D0C648_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NC(=CS3)C""",21,"""04D56EC84B8DDF50"""
-"""31CBEADFF772406B_C84B1D679B4BD364_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC(C)(C)C#N""",21,"""04D56EC84B8DDF50"""
-"""128633CE5B404189_9B9D4E278EABF591_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCSCC#N""",21,"""04D56EC84B8DDF50"""
-"""74226D6412EE9121_3821661F5CE6A366_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NC=C(C)O3""",21,"""04D56EC84B8DDF50"""
-"""5C779F920B8AE319_1FD1EEB99904F7ED_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC[S](Cl)(=O)=O""",21,"""04D56EC84B8DDF50"""
-"""78CC848C7505D622_35998669B2CE2C14_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCOCC3CC3""",21,"""04D56EC84B8DDF50"""
-"""7122A485644ADF1C_748AFAA8D8ABE29F_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(=O)C3CCC3""",21,"""04D56EC84B8DDF50"""
-"""A7B86DC22F267E71_E62E9D665F8C1E67_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(CC(C)C)=O""",21,"""04D56EC84B8DDF50"""
-"""9265EAFD224D2A18_C888594895A45E24_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3COCCO3""",21,"""04D56EC84B8DDF50"""
-"""BB674205F3A98540_CE0EF8392E9D0ED4_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC[S](C)(=O)=O""",21,"""04D56EC84B8DDF50"""
-"""A474C7C461E49848_20008EEF1A15ED3C_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC[N]3N=CC=C3""",21,"""04D56EC84B8DDF50"""
-"""65BD0A429E7A4C29_D683723655A51A24_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(C(CC)C)=O""",21,"""04D56EC84B8DDF50"""
-"""C5B1BFD89B8CCF35_42B972D612D7DC95_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCN[S](C)(=O)=O""",21,"""04D56EC84B8DDF50"""
-"""696A91634BCEFA2A_262D1F3D862F6EF0_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(CCOC)=O""",21,"""04D56EC84B8DDF50"""
-"""828E5490BA1B70AD_9A8FB779A557D8E8_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCNC(=O)C=C""",21,"""04D56EC84B8DDF50"""
-"""3DA12AFB30EA6E7B_FB663AB6B4C3FB83_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3COC(=O)O3""",21,"""04D56EC84B8DDF50"""
-"""429802BE9E1C89FD_1639DC589CDBEEFD_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NN=C[N]3C""",21,"""04D56EC84B8DDF50"""
-"""6138DAC0AC4BBCE3_F75B24670792ECBB_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCNC(C)=O""",21,"""04D56EC84B8DDF50"""
-"""DA852F910DEC9030_535FAB891F4A8E31_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(NC(N)=O)=O""",21,"""04D56EC84B8DDF50"""
-"""BCD7AB3B0DB97780_6C8AD94176B4FF51_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3CCOCO3""",21,"""04D56EC84B8DDF50"""
-"""A64D23B1EB91AA11_A34CD48A31042EDE_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC[N]3C=NC=C3""",21,"""04D56EC84B8DDF50"""
-"""7F13EAE6AF3548C4_E75823A13B7C8A9E_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC(N(C)C)=O""",21,"""04D56EC84B8DDF50"""
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-"""44C5DE878DFDCB6B_A5B0C7F04868B35D_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCCN(C)C""",21,"""04D56EC84B8DDF50"""
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-"""D6019C734DDE0BB3_88DABE4E37EAE9BB_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCOCCOC""",21,"""04D56EC84B8DDF50"""
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-"""64913149F28CF054_2932B5E491771391_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC3=NN=N[NH]3""",21,"""04D56EC84B8DDF50"""
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-"""71ECA5EA314443A7_4E641E61E5271762_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC(OC)OC""",21,"""04D56EC84B8DDF50"""
-"""C177C085B85AC74E_C3B5150FC753CE30_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCN(C)CC=C""",21,"""04D56EC84B8DDF50"""
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-"""7A5CDD631BA21CA3_9E25E46A3BBAD93A_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCC3CCC3""",21,"""04D56EC84B8DDF50"""
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-"""4A926CA1980FAC25_2D3F80B1156F674F_6039_DP""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3OCCNC3""",21,"""04D56EC84B8DDF50"""
-"""BB48542B65706164_7DF0E75519703716_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=C[NH]C(=N3)C""",21,"""04D56EC84B8DDF50"""
-"""EFAA034A30BBB4FB_D48138E45AA3A81C_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCCCC#C""",21,"""04D56EC84B8DDF50"""
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-"""488C52A91240837E_FDA6D489690A89F5_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NOC=C3C""",21,"""04D56EC84B8DDF50"""
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-"""C8F5F6D9448D0767_49FC83CA8CBE7978_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(C(F)(F)F)=O""",21,"""04D56EC84B8DDF50"""
-"""6D63371244A66C3A_8218A4970D0EF2C6_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCC(C)(F)F""",21,"""04D56EC84B8DDF50"""
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-"""B8DF3D58891B566B_50A9B5FDBC2B6BB0_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC3=CC=NS3""",21,"""04D56EC84B8DDF50"""
-"""CBBA05F4DA44FEB5_1C88FB50731DE24A_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3CCCCO3""",21,"""04D56EC84B8DDF50"""
-"""5C779F920B8AE319_58BF5E5A4A3B2748_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC[S](=O)(=O)Cl""",21,"""04D56EC84B8DDF50"""
-"""28978C843E0332E0_736DF5F11D465072_6039_DP""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCNC3CC3""",21,"""04D56EC84B8DDF50"""
-"""BA6036C0E4683BAD_B50E37B9CB42449D_6039_DP""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(NCCN)=O""",21,"""04D56EC84B8DDF50"""
-"""C8E5FC7A7E9CEA3C_19A77F689818EC01_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCC3(C)CC3""",21,"""04D56EC84B8DDF50"""
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-"""2192A7D1EC2BCFF3_5F9FB460C1F61676_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC[S](O)(=O)=O""",21,"""04D56EC84B8DDF50"""
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-"""B4089423EE51B65F_4A225B455A079CB6_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=CN=C(C)O3""",21,"""04D56EC84B8DDF50"""
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-"""EEEBB8A5E2BA5BA8_B0F6DD2D965D0922_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC3CC3(C)C""",21,"""04D56EC84B8DDF50"""
-"""90EC4425C9071C34_6A81365D78691420_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)C[C@H](COC)OC""",21,"""04D56EC84B8DDF50"""
-"""73935DC2195FEAF1_A81C49EC30BDA0C1_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCC3CC3C""",21,"""04D56EC84B8DDF50"""
-"""4A439FB1974EAE68_8F5C44A2358D8009_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=CC(=N[NH]3)C""",21,"""04D56EC84B8DDF50"""
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-"""78F4723C69D03B1B_11FF9CF4DE4200E5_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCOC(F)F""",21,"""04D56EC84B8DDF50"""
-"""FF2EFFF855ED199F_6A5A6D27F976596D_6039_DP""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCCCCO""",21,"""04D56EC84B8DDF50"""
-"""435269E306972126_9483650C677D507E_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NC(=NS3)C""",21,"""04D56EC84B8DDF50"""
-"""223BFAF8FB8410F4_FFDD2FD6FF0B3630_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NN=CC=C3""",21,"""04D56EC84B8DDF50"""
-"""A7359B63BF988EDC_46952B84DAF4B810_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC3(CC3)C#N""",21,"""04D56EC84B8DDF50"""
-"""817AFCEA045B9A2F_D61D60C5B65D563F_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCO[Si](C)(C)C""",21,"""04D56EC84B8DDF50"""
-"""195E49F67A1952EC_8EDE4CB610AF8B3B_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC(C)C(F)F""",21,"""04D56EC84B8DDF50"""
-"""E5245F7F04DA0E93_63ADE7CE74049C06_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC3CN(C)C3""",21,"""04D56EC84B8DDF50"""
-"""ED91329216F18D78_77C022DA1A75BB75_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCOCCC=C""",21,"""04D56EC84B8DDF50"""
-"""C0BDCBABE63866F1_C2F3905B254E99AD_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(SC)C(=O)O""",21,"""04D56EC84B8DDF50"""
-"""871AF8BD5CE6459C_3508774440358A74_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC=C(C)C(=O)O""",21,"""04D56EC84B8DDF50"""
-"""2BD2C698F063338F_F0F75F180521E65E_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCOCC3CO3""",21,"""04D56EC84B8DDF50"""
-"""0BE863CC46880E10_636E7846ED3F3A26_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NC=NC=C3""",21,"""04D56EC84B8DDF50"""
-"""3B88D243E3EDAEB3_4416229D8A629804_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NOC(C)C3""",21,"""04D56EC84B8DDF50"""
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-"""4970030CBD44EDB2_96C907043FCFF5E4_6039_DP""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(C3(N)CC3)=O""",21,"""04D56EC84B8DDF50"""
-"""3D2E3F08BB9F519D_0DF59379ABB2007F_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC[Si](Cl)(Cl)Cl""",21,"""04D56EC84B8DDF50"""
-"""4C4C56550CF20B38_7145746A6B3F5EDA_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC#CCSC#N""",21,"""04D56EC84B8DDF50"""
-"""54C2B89770DFD153_3826F43153B70FFE_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC[N]3C=NC=N3""",21,"""04D56EC84B8DDF50"""
-"""3A7E234EB5C76ED1_BAA8ECAE3FA973CD_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCC(F)(F)F""",21,"""04D56EC84B8DDF50"""
-"""C7E9F58002D47EE0_BF18B58DEB1E8A03_6039_DP""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(C3CNC3)=O""",21,"""04D56EC84B8DDF50"""
-"""C88138A8363FAC0A_55AE10751C974A21_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3OCCC3F""",21,"""04D56EC84B8DDF50"""
-"""E97E6E598729164D_71F23AC8E67A7887_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=C(C)N=NS3""",21,"""04D56EC84B8DDF50"""
-"""5E0225D8E76EEA78_7EF0E90E6FF7FCE3_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NC(=N[NH]3)C""",21,"""04D56EC84B8DDF50"""
-"""BF40AEEC5A50816C_75B6A44A4A84A7C8_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCOCC(C)C""",21,"""04D56EC84B8DDF50"""
-"""675A0C989C391C64_AF2CCC77FF1B6D17_6039_DP""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC3CCNC3""",21,"""04D56EC84B8DDF50"""
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-"""C8DCF2B2024B7903_DF538EAD9BD41F39_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCN(CC)C#N""",21,"""04D56EC84B8DDF50"""
-"""6FABF5CBC238781D_0C4863A0E4DD6FF4_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC(=C(C)C)C""",21,"""04D56EC84B8DDF50"""
-"""C23B4726D10176CE_84C9D7E882A2B1CB_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=C(C)N=CO3""",21,"""04D56EC84B8DDF50"""
-"""F9B393F45854FBD2_1E7ECCD082D88F6F_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC[S](=O)(=O)C=C""",21,"""04D56EC84B8DDF50"""
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-"""E6CD2E034924D91A_07B782E0A81A880A_6039_UN""","""CSC1=CC(=C(C=C1)OCC(NCC(OC)=O)=O)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""52B857E6BF718220_520902AB6B16177C_6039_UN""","""CSC1=CC(=C(C=C1)OCC(=O)N2CCNC2=O)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""31DF403D262C4686_2F51EEACEDBB13DD_6039_UN""","""CSC1=CC(=C(C=C1)OCC2=CC=C(SC)C=C2)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""24B0EB0EB627B1C0_6B1B0AE079E67F51_6039_UN""","""CSC1=CC(=C(C=C1)OCC(NC(NCC)=O)=O)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""79CFC8CE1D8FEC2D_6BF5867BFC71B363_6039_UN""","""CSC1=CC(=C(C=C1)OCC(NC(C(C)C)=O)=O)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""CAF0D4682C826166_FF0412E5F94E8326_6039_UN""","""CSC1=CC(=C(C=C1)OCC=NNC(C(C)C)=O)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""794D733DA3530B1F_1AA604F61A6F739E_6039_UN""","""CSC1=CC(=C(C=C1)OCC2=CC(=CC=C2)C#N)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""F8C2E6BA216D4BED_7563C939E27593D2_6039_UN""","""CSC1=CC(=C(C=C1)OCC(NC(C)C2CC2)=O)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""182E96525A9646D2_04B7AB1A11793309_6039_UN""","""CSC1=CC(=C(C=C1)OCC(=O)N2CCOC2=O)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""B3EFB468F135C9FD_C555B0C04448E171_6039_UN""","""CSC1=CC(=C(C=C1)OCC2=CC(=CC(=C2)C)C)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""150D9210B531E745_12A90E37A2364E9B_6039_UN""","""CSC1=CC(=C(C=C1)OCC(=O)NC2=NN=CS2)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""0B5D32C1E908DFFF_5D803FCA78833D97_6039_UN""","""CSC1=CC(=C(C=C1)OCC2=C(C=CC=C2)C#N)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""D344F446DEE4EBCF_4503F651DBAAD3B7_6039_UN""","""CSC1=CC(=C(C=C1)OCC2=CSC(=N2)CCC)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""253AF4E933D55A5C_44BF47AB8FC1CC54_6039_UN""","""CSC1=CC(=C(C=C1)OCC2=NC(=NO2)C3CC3)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""213D65C1CEC30310_22EE628B0DE685B0_6039_UN""","""CSC1=CC(=C(C=C1)OCC2=NN=N[N]2C3CC3)C(=O)O""",21,"""94D8BBDD97AE8345"""
-"""AFD3FAB12899F6AA_7D31F87016F90095_6039_UN""","""CSC1=CC(=C(C=C1)OCC2=NC(=NO2)C(C)C)C(=O)O""",21,"""94D8BBDD97AE8345"""
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-"""377580A368F629AB_EEC13574281BE052_6039_DP""","""CSC1=CC(=C(C=C1)OCC3OCC2(CNC2)C3)C(=O)O""",21,"""94D8BBDD97AE8345"""
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-"""949E2D02BCB399C7_7FC188AE7006629D_6039_UN""","""CSC1=CC(=C(C=C1)OCCCC#C[Si](C)(C)C)C(=O)O""",21,"""94D8BBDD97AE8345"""
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-"""CB3CC57D481417CB_4391AB7746D92D69_6039_UN""","""CSC1=CC(=C(C=C1)OCCCC2=CC=NC=C2)C(=O)O""",21,"""94D8BBDD97AE8345"""
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-"""F2350B1CF3666F21_152EF70990542682_6039_UN""","""CSC1=CC(=C(C=C1)OCCOCCOCC#C)C(=O)O""",21,"""94D8BBDD97AE8345"""
+"""193C537362CDFA99_17B9BF360307BC22_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](C)(=O)=O)CCCN""",21,"""6926837ACE541B03"""
+"""F4037EA85DC25A15_BD4C8B9003FBF38C_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](CC)(=O)=O)CCBr""",21,"""6926837ACE541B03"""
+"""F5B1128C4F9DAE3E_B3C07DBF16B06D6D_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N(CCNC)[S](=O)(=O)C""",21,"""6926837ACE541B03"""
+"""75EA236D8770C29D_4FBA41FB1DC1A067_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](CCCC)(=O)=O)C""",21,"""6926837ACE541B03"""
+"""65AE07269E9161A3_7BA9A3A6CF61DB38_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""6926837ACE541B03"""
+"""692248A5F5602158_6B4FB2147E5382F5_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](C)(=O)=O)CCC#C""",21,"""6926837ACE541B03"""
+"""18576D798ECA3C97_620DBCA1906CAF51_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N(C)[S](=O)(=O)CCCCl""",21,"""6926837ACE541B03"""
+"""25A833C78EEB28A2_23F1F6A5967C369A_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](CC)(=O)=O)CC#C""",21,"""6926837ACE541B03"""
+"""E66E77664A669B77_7A221AF3F5BFCFFA_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3[S](CCCC3=O)(=O)=O""",21,"""6926837ACE541B03"""
+"""BE4E615BD69887FA_A8DC866B0A46F1AC_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""6926837ACE541B03"""
+"""0523224736DE4D8F_8D15E1E854A96C78_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](C)(=O)=O)C3CNC3""",21,"""6926837ACE541B03"""
+"""465A46DFBD621477_57C20E1B364FC357_6036_DP""","""C(CC1CCC2(CC1)OCCO2)N[S](=O)(=O)C3(CC3)C#N""",21,"""6926837ACE541B03"""
+"""646EC140CE4E1AC8_40CE5737E9DE555F_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N(C)[S](=O)(=O)CCCN""",21,"""6926837ACE541B03"""
+"""A525C7F1BEE44946_E9D774D3549AA160_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N(C)[S](=O)(=O)C3COC3""",21,"""6926837ACE541B03"""
+"""FD3FFCB11DB02DA1_89F2A531883711FF_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N(C)[S](=O)(=O)CCOC""",21,"""6926837ACE541B03"""
+"""268599925B63F3BF_272C38D35C07C3EA_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N(C)[S](=O)(=O)CC(=O)C""",21,"""6926837ACE541B03"""
+"""5BF0DB029442F475_AF045E679A89F0A7_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3CCCC(C)[S]3(=O)=O""",21,"""6926837ACE541B03"""
+"""4B0C9226CB1DD51A_A2EB788023B0CB02_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3CCC(C)(C)[S]3(=O)=O""",21,"""6926837ACE541B03"""
+"""5E3A805E808AA839_9943D9412287395D_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](CC)(=O)=O)CCN""",21,"""6926837ACE541B03"""
+"""77BD232DD0BA6467_D8EE45FB1CC13FE9_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N(CC)[S](=O)(=O)CCN""",21,"""6926837ACE541B03"""
+"""8E1DCED3F031CE58_627DEE0E1DD7CAA4_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""6926837ACE541B03"""
+"""791FCF0807D9223B_EA45DD64DF7ADF98_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""6926837ACE541B03"""
+"""7249C3377D3C0672_85634B594AFC97C6_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](CCNC)(=O)=O)C""",21,"""6926837ACE541B03"""
+"""7249C3377D3C0672_5993B1CFB3639CE0_6036_DP""","""C(CC1CCC2(CC1)OCCO2)N(C)[S](=O)(=O)CCNC""",21,"""6926837ACE541B03"""
+"""F580DEEFA4809EE1_482E3523C8595B3B_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3[S](CCC3CI)(=O)=O""",21,"""6926837ACE541B03"""
+"""69B008251567D0C1_D4289EEBB25755F6_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3C(CN)CC[S]3(=O)=O""",21,"""6926837ACE541B03"""
+"""D7DA85E61AC0881A_477F4111CA9DF88E_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N(CC(C)C)[S](=O)(=O)C""",21,"""6926837ACE541B03"""
+"""DEA42095C90FC082_DB76D4BBB3979559_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3[S](=O)(CCNCC3)=O""",21,"""6926837ACE541B03"""
+"""B62AAFD881721765_6991CFE5980655F2_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](C=C)(=O)=O)C3CC3""",21,"""6926837ACE541B03"""
+"""2B20EB3892F2D7AA_C9964FE64E035C0D_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3CC4(C[S]3(=O)=O)CC4""",21,"""6926837ACE541B03"""
+"""2F4E1D8668B62C18_05DD3CD7465C4D4F_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](C)(=O)=O)C(=O)CN""",21,"""6926837ACE541B03"""
+"""B1EEC5A59D56D838_E75E72E196297281_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N3CCCCC[S]3(=O)=O""",21,"""6926837ACE541B03"""
+"""1BB3905A97A21A25_F5F5EE079461BCDD_6036_UN""","""C(CC1CCC2(CC1)OCCO2)N([S](C)(=O)=O)CCCBr""",21,"""6926837ACE541B03"""
+"""37BE306907457D53_A5F6EF5A2D05B80F_6003_UN""","""O(CCC1CCC2(CC1)OCCO2)C3=CC=C(C=C3)C#N""",21,"""6926837ACE541B03"""
+"""7AD8806DF5601323_9AD615526C9D052E_6003_UN""","""O(CCC1CCC2(CC1)OCCO2)C3=CC=CC=C3[N+]#[C-]""",21,"""6926837ACE541B03"""
+"""65C37B13BE402207_9D81E0200DD0388C_6003_UN""","""O(CCC1CCC2(CC1)OCCO2)C3=CC=CC=C3C#N""",21,"""6926837ACE541B03"""
+"""CF73D21330680AFA_75014244932E11F0_6003_UN""","""O(CCC1CCC2(CC1)OCCO2)C3=CC=C(C=C3)[N+]#[C-]""",21,"""6926837ACE541B03"""
+"""3B11C83D3840380D_FB3AC7A62C03C68E_6003_UN""","""O(CCC1CCC2(CC1)OCCO2)C3=CC=CC(=C3)[N+]#[C-]""",21,"""6926837ACE541B03"""
+"""74F0FA4036946B95_17223CDA77A5D603_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](C)(=O)=O)CCCN""",21,"""69BD0096BAF67122"""
+"""D22696FA00F9312B_BDD7087C775999AD_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](CC)(=O)=O)CCBr""",21,"""69BD0096BAF67122"""
+"""5808C096FB0EA836_B35BFE536212074C_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N(CCNC)[S](=O)(=O)C""",21,"""69BD0096BAF67122"""
+"""50D1CAE24076BFE2_4F21C2176963CA46_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](CCCC)(=O)=O)C""",21,"""69BD0096BAF67122"""
+"""85D1BF3818281DF1_7B32204ABBC3B119_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""69BD0096BAF67122"""
+"""334118B6C077AB02_6BD431F80AF1E8D4_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](C)(=O)=O)CCC#C""",21,"""69BD0096BAF67122"""
+"""6058C7387D20B3D5_62963F4DE4CEC570_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N(C)[S](=O)(=O)CCCCl""",21,"""69BD0096BAF67122"""
+"""0D722F0CED4100FE_236A7549E2DE5CBB_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](CC)(=O)=O)CC#C""",21,"""69BD0096BAF67122"""
+"""2CDF1FAEE271EDE3_7AB9991F811DA5DB_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3[S](CCCC3=O)(=O)=O""",21,"""69BD0096BAF67122"""
+"""D6731D37792DE27B_A84705877EE49B8D_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""69BD0096BAF67122"""
+"""A6650BF926250B83_8D8E6204200B0659_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](C)(=O)=O)C3CNC3""",21,"""69BD0096BAF67122"""
+"""1AD3555F08EDA956_57598DF742EDA976_6036_DP""","""C(CC1=CC2=C(C=C1)OCCO2)N[S](=O)(=O)C3(CC3)C#N""",21,"""69BD0096BAF67122"""
+"""3D6E59E908346B96_4055D4DB9D7C3F7E_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N(C)[S](=O)(=O)CCCN""",21,"""69BD0096BAF67122"""
+"""8ECD394EA4E3861B_E94CF73F2038CB41_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N(C)[S](=O)(=O)C3COC3""",21,"""69BD0096BAF67122"""
+"""9187A12F0D0A3BBF_896926DDFC957BDE_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N(C)[S](=O)(=O)CCOC""",21,"""69BD0096BAF67122"""
+"""1C45229509E7405C_27B7BB3F28A5A9CB_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N(C)[S](=O)(=O)CC(=O)C""",21,"""69BD0096BAF67122"""
+"""D17E666D3A7D4C65_AF9FDD8BEE2B9A86_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3CCCC(C)[S]3(=O)=O""",21,"""69BD0096BAF67122"""
+"""68A66CA4A5285F97_A270FB6C5712A123_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3CCC(C)(C)[S]3(=O)=O""",21,"""69BD0096BAF67122"""
+"""44EBF86D5D4DA230_99D85AAD5625537C_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](CC)(=O)=O)CCN""",21,"""69BD0096BAF67122"""
+"""83A2C822D7647D5C_D875C617686355C8_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N(CC)[S](=O)(=O)CCN""",21,"""69BD0096BAF67122"""
+"""019D47C7F785CA8A_62E66DE26975A085_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""69BD0096BAF67122"""
+"""48D7104D2360CA1D_EADE5E88ABD8B5B9_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""69BD0096BAF67122"""
+"""3A96BBE40DE65C3C_85F8C8B53E5EFDE7_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](CCNC)(=O)=O)C""",21,"""69BD0096BAF67122"""
+"""3A96BBE40DE65C3C_59083223C7C1F6C1_6036_DP""","""C(CC1=CC2=C(C=C1)OCCO2)N(C)[S](=O)(=O)CCNC""",21,"""69BD0096BAF67122"""
+"""B1BCF838A01A31D9_48B5B6CFBCFB311A_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3[S](CCC3CI)(=O)=O""",21,"""69BD0096BAF67122"""
+"""A3428228FD2A3A9B_D4B31D07C6F53FD7_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3C(CN)CC[S]3(=O)=O""",21,"""69BD0096BAF67122"""
+"""C718D8FE20E153D9_47E4C2FDBE3F92AF_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N(CC(C)C)[S](=O)(=O)C""",21,"""69BD0096BAF67122"""
+"""0DE356310E6F95FA_DBED5757C735FF78_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3[S](=O)(CCNCC3)=O""",21,"""69BD0096BAF67122"""
+"""28FBD167FF3E2B68_690A4C09ECA43FD3_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](C=C)(=O)=O)C3CC3""",21,"""69BD0096BAF67122"""
+"""C67AABB4B7539090_C90DCC0A3AA1362C_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3CC4(C[S]3(=O)=O)CC4""",21,"""69BD0096BAF67122"""
+"""82131A8EC285FC19_0546BF3B32FE276E_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](C)(=O)=O)C(=O)CN""",21,"""69BD0096BAF67122"""
+"""3F5E04B17FD65352_E7C5F10DE28B18A0_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N3CCCCC[S]3(=O)=O""",21,"""69BD0096BAF67122"""
+"""FAD4DE54C0EBEA39_F56E6DEBE0C3D6FC_6036_UN""","""C(CC1=CC2=C(C=C1)OCCO2)N([S](C)(=O)=O)CCCBr""",21,"""69BD0096BAF67122"""
+"""2913393965EE02AD_A56D6CB659A7D22E_6003_UN""","""O(CCC1=CC2=C(C=C1)OCCO2)C3=CC=C(C=C3)C#N""",21,"""69BD0096BAF67122"""
+"""61BD623E31F2746E_9A4D96BE183F6F0F_6003_UN""","""O(CCC1=CC2=C(C=C1)OCCO2)C3=CC=CC=C3[N+]#[C-]""",21,"""69BD0096BAF67122"""
+"""AC80386D86B04D0F_9D1A63CC797252AD_6003_UN""","""O(CCC1=CC2=C(C=C1)OCCO2)C3=CC=CC=C3C#N""",21,"""69BD0096BAF67122"""
+"""F939C0D0B2CFFBBD_759AC1A8E78C7BD1_6003_UN""","""O(CCC1=CC2=C(C=C1)OCCO2)C3=CC=C(C=C3)[N+]#[C-]""",21,"""69BD0096BAF67122"""
+"""1B324AA2DDDD8975_FBA1444A58A1ACAF_6003_UN""","""O(CCC1=CC2=C(C=C1)OCCO2)C3=CC=CC(=C3)[N+]#[C-]""",21,"""69BD0096BAF67122"""
+"""AC6862F8463B3626_149DF6D90C96F30E_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](C)(=O)=O)CCCN""",21,"""6A02CA95C1C5542F"""
+"""958F7573DD0A99AA_BE68C27F0C6ABCA0_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](CC)(=O)=O)CCBr""",21,"""6A02CA95C1C5542F"""
+"""8CAC2987B80119DC_B0E4345019212241_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N(CCNC)[S](=O)(=O)C""",21,"""6A02CA95C1C5542F"""
+"""882F6585D9240841_4C9E08141250EF4B_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](CCCC)(=O)=O)C""",21,"""6A02CA95C1C5542F"""
+"""032B3A0B3AF0CFDE_788DEA49C0F09414_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""6A02CA95C1C5542F"""
+"""DA3681FC676A5738_686BFBFB71C2CDD9_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](C)(=O)=O)CCC#C""",21,"""6A02CA95C1C5542F"""
+"""C373E257782A9B2C_6129F54E9FFDE07D_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N(C)[S](=O)(=O)CCCCl""",21,"""6A02CA95C1C5542F"""
+"""D789CC63EEE0E6A8_20D5BF4A99ED79B6_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](CC)(=O)=O)CC#C""",21,"""6A02CA95C1C5542F"""
+"""767DA2E05571ABB8_7906531CFA2E80D6_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3[S](CCCC3=O)(=O)=O""",21,"""6A02CA95C1C5542F"""
+"""9D45CC455FAA3CA0_ABF8CF8405D7BE80_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""6A02CA95C1C5542F"""
+"""948B419D46BEE817_8E31A8075B382354_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](C)(=O)=O)C3CNC3""",21,"""6A02CA95C1C5542F"""
+"""FC8391C082C6B1DF_54E647F439DE8C7B_6036_DP""","""CC(C)N1C2CCCC1CC(C2)N[S](=O)(=O)C3(CC3)C#N""",21,"""6A02CA95C1C5542F"""
+"""EB8633F2F8F50980_43EA1ED8E64F1A73_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N(C)[S](=O)(=O)CCCN""",21,"""6A02CA95C1C5542F"""
+"""14B299A8E4708C2F_EAF33D3C5B0BEE4C_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N(C)[S](=O)(=O)C3COC3""",21,"""6A02CA95C1C5542F"""
+"""4B5EEFF14D22F842_8AD6ECDE87A65ED3_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N(C)[S](=O)(=O)CCOC""",21,"""6A02CA95C1C5542F"""
+"""7AA6FF383F35708C_2408713C53968CC6_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N(C)[S](=O)(=O)CC(=O)C""",21,"""6A02CA95C1C5542F"""
+"""E726043B1842D176_AC2017889518BF8B_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3CCCC(C)[S]3(=O)=O""",21,"""6A02CA95C1C5542F"""
+"""15944174CA6F30C9_A1CF316F2C21842E_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3CCC(C)(C)[S]3(=O)=O""",21,"""6A02CA95C1C5542F"""
+"""B651AD3AA6E2336E_9A6790AE2D167671_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](CC)(=O)=O)CCN""",21,"""6A02CA95C1C5542F"""
+"""F52D05837CEC0B11_DBCA0C14135070C5_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N(CC)[S](=O)(=O)CCN""",21,"""6A02CA95C1C5542F"""
+"""EE3B36013AD9B4A6_6159A7E112468588_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""6A02CA95C1C5542F"""
+"""3FAB8D553800CC04_E961948BD0EB90B4_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""6A02CA95C1C5542F"""
+"""C38417E43E94175D_864702B6456DD8EA_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](CCNC)(=O)=O)C""",21,"""6A02CA95C1C5542F"""
+"""C38417E43E94175D_5AB7F820BCF2D3CC_6036_DP""","""CC(C)N1C2CCCC1CC(C2)N(C)[S](=O)(=O)CCNC""",21,"""6A02CA95C1C5542F"""
+"""22796CB48BF1481E_4B0A7CCCC7C81417_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3[S](CCC3CI)(=O)=O""",21,"""6A02CA95C1C5542F"""
+"""D4938E76730430A2_D70CD704BDC61ADA_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3C(CN)CC[S]3(=O)=O""",21,"""6A02CA95C1C5542F"""
+"""B53A7AC901D95524_445B08FEC50CB7A2_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N(CC(C)C)[S](=O)(=O)C""",21,"""6A02CA95C1C5542F"""
+"""F0B13F0490FE85BF_D8529D54BC06DA75_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3[S](=O)(CCNCC3)=O""",21,"""6A02CA95C1C5542F"""
+"""858CDEF7EA307CD7_6AB5860A97971ADE_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](C=C)(=O)=O)C3CC3""",21,"""6A02CA95C1C5542F"""
+"""C520B01D0662691E_CAB2060941921321_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3CC4(C[S]3(=O)=O)CC4""",21,"""6A02CA95C1C5542F"""
+"""0560BC42ED2A6C6A_06F9753849CD0263_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](C)(=O)=O)C(=O)CN""",21,"""6A02CA95C1C5542F"""
+"""F6C2923104F5D708_E47A3B0E99B83DAD_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N3CCCCC[S]3(=O)=O""",21,"""6A02CA95C1C5542F"""
+"""D3F97AA51E248460_F6D1A7E89BF0F3F1_6036_UN""","""CC(C)N1C2CCCC1CC(C2)N([S](C)(=O)=O)CCCBr""",21,"""6A02CA95C1C5542F"""
+"""016F5000F1B639E5_A6D2A6B52294F723_6003_UN""","""CC(C)N1C3CCCC1CC(OC2=CC=C(C=C2)C#N)C3""",21,"""6A02CA95C1C5542F"""
+"""D20A351D5B32AF23_99F25CBD630C4A02_6003_UN""","""CC(C)N1C3CCCC1CC(OC2=CC=CC=C2[N+]#[C-])C3""",21,"""6A02CA95C1C5542F"""
+"""D05C353C7B24AF61_9EA5A9CF024177A0_6003_UN""","""CC(C)N1C3CCCC1CC(OC2=CC=CC=C2C#N)C3""",21,"""6A02CA95C1C5542F"""
+"""AB48A5C2902C93BA_76250BAB9CBF5EDC_6003_UN""","""CC(C)N1C3CCCC1CC(OC2=CC=C(C=C2)[N+]#[C-])C3""",21,"""6A02CA95C1C5542F"""
+"""EB5A83BA670EFD36_F81E8E49239289A2_6003_UN""","""CC(C)N1C3CCCC1CC(OC2=CC=CC(=C2)[N+]#[C-])C3""",21,"""6A02CA95C1C5542F"""
+"""152074D72EFABB33_1487351A599238FD_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](C)(=O)=O)CCCN""",21,"""6A18095694C19FDC"""
+"""078AF460FC373324_BE7201BC596E7753_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](CC)(=O)=O)CCBr""",21,"""6A18095694C19FDC"""
+"""9AD7D9349ADD7FF1_B0FEF7934C25E9B2_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N(CCNC)[S](=O)(=O)C""",21,"""6A18095694C19FDC"""
+"""A16118273C34E3F7_4C84CBD7475424B8_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](CCCC)(=O)=O)C""",21,"""6A18095694C19FDC"""
+"""3474D506309C03EA_7897298A95F45FE7_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1C(C(C)(C)[S]1(=O)=O)=O""",21,"""6A18095694C19FDC"""
+"""B642AC33F9B55DDA_6871383824C6062A_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](C)(=O)=O)CCC#C""",21,"""6A18095694C19FDC"""
+"""0F3713E8D4C53DBF_6133368DCAF92B8E_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N(C)[S](=O)(=O)CCCCl""",21,"""6A18095694C19FDC"""
+"""78B05DDF2A128119_20CF7C89CCE9B245_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](CC)(=O)=O)CC#C""",21,"""6A18095694C19FDC"""
+"""DB6F9C6601AF6980_791C90DFAF2A4B25_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1[S](CCCC1=O)(=O)=O""",21,"""6A18095694C19FDC"""
+"""5B007D73240DFCA2_ABE20C4750D37573_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1C(C(N)C[S]1(=O)=O)=O""",21,"""6A18095694C19FDC"""
+"""6BB42A2668168D62_8E2B6BC40E3CE8A7_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](C)(=O)=O)C1CNC1""",21,"""6A18095694C19FDC"""
+"""D8B54F9211A71C6B_54FC84376CDA4788_6036_DP""","""C(COCCNC(=O)C(F)(F)F)N[S](=O)(=O)C1(CC1)C#N""",21,"""6A18095694C19FDC"""
+"""3174A99FFA1FFB9C_43F0DD1BB34BD180_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N(C)[S](=O)(=O)CCCN""",21,"""6A18095694C19FDC"""
+"""81718B18A6F1B80F_EAE9FEFF0E0F25BF_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N(C)[S](=O)(=O)C1COC1""",21,"""6A18095694C19FDC"""
+"""2D77EE00CF492092_8ACC2F1DD2A29520_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N(C)[S](=O)(=O)CCOC""",21,"""6A18095694C19FDC"""
+"""30A60DF1AA718C08_2412B2FF06924735_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N(C)[S](=O)(=O)CC(=O)C""",21,"""6A18095694C19FDC"""
+"""3F233FA497147E72_AC3AD44BC01C7478_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1CCCC(C)[S]1(=O)=O""",21,"""6A18095694C19FDC"""
+"""5B1F9BDE9C2AA5A6_A1D5F2AC79254FDD_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1CCC(C)(C)[S]1(=O)=O""",21,"""6A18095694C19FDC"""
+"""70FB9DD91F6A29B5_9A7D536D7812BD82_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](CC)(=O)=O)CCN""",21,"""6A18095694C19FDC"""
+"""A0A090622DD318BE_DBD0CFD74654BB36_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N(CC)[S](=O)(=O)CCN""",21,"""6A18095694C19FDC"""
+"""96333AD46F8EC870_6143642247424E7B_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N(C)[S](=O)(=O)C(C)(C)C""",21,"""6A18095694C19FDC"""
+"""7E1ED3C1EFA1547A_E97B574885EF5B47_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1[S](=O)(=O)C2(CC1)CC2""",21,"""6A18095694C19FDC"""
+"""CD97067D86016111_865DC17510691319_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](CCNC)(=O)=O)C""",21,"""6A18095694C19FDC"""
+"""CD97067D86016111_5AAD3BE3E9F6183F_6036_DP""","""C(COCCNC(=O)C(F)(F)F)N(C)[S](=O)(=O)CCNC""",21,"""6A18095694C19FDC"""
+"""090C56B8DF5C2C09_4B10BF0F92CCDFE4_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1[S](CCC1CI)(=O)=O""",21,"""6A18095694C19FDC"""
+"""C0CA0C4CD492D18F_D71614C7E8C2D129_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1C(CN)CC[S]1(=O)=O""",21,"""6A18095694C19FDC"""
+"""34DB1B48628782AE_4441CB3D90087C51_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N(CC(C)C)[S](=O)(=O)C""",21,"""6A18095694C19FDC"""
+"""BD3453D55F62373C_D8485E97E9021186_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1[S](=O)(CCNCC1)=O""",21,"""6A18095694C19FDC"""
+"""B236DEE711663F52_6AAF45C9C293D12D_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](C=C)(=O)=O)C1CC1""",21,"""6A18095694C19FDC"""
+"""79E3AB428EDE5543_CAA8C5CA1496D8D2_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1CC2(C[S]1(=O)=O)CC2""",21,"""6A18095694C19FDC"""
+"""A54826E407852E41_06E3B6FB1CC9C990_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](C)(=O)=O)C(=O)CN""",21,"""6A18095694C19FDC"""
+"""C8D8119E0A01E07B_E460F8CDCCBCF65E_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N1CCCCC[S]1(=O)=O""",21,"""6A18095694C19FDC"""
+"""EB07F312BC8FE6CA_F6CB642BCEF43802_6036_UN""","""C(COCCNC(=O)C(F)(F)F)N([S](C)(=O)=O)CCCBr""",21,"""6A18095694C19FDC"""
+"""C4FFC5D0C3F697E7_A6C8657677903CD0_6003_UN""","""O(CCOCCNC(=O)C(F)(F)F)C1=CC=C(C=C1)C#N""",21,"""6A18095694C19FDC"""
+"""6D21F174C12BEC71_99E89F7E360881F1_6003_UN""","""O(CCOCCNC(=O)C(F)(F)F)C1=CC=CC=C1[N+]#[C-]""",21,"""6A18095694C19FDC"""
+"""859CEBD2D340EDDD_9EBF6A0C5745BC53_6003_UN""","""O(CCOCCNC(=O)C(F)(F)F)C1=CC=CC=C1C#N""",21,"""6A18095694C19FDC"""
+"""5D080A304A1FF1C3_763FC868C9BB952F_6003_UN""","""O(CCOCCNC(=O)C(F)(F)F)C1=CC=C(C=C1)[N+]#[C-]""",21,"""6A18095694C19FDC"""
+"""67D96059C109D63A_F8044D8A76964251_6003_UN""","""O(CCOCCNC(=O)C(F)(F)F)C1=CC=CC(=C1)[N+]#[C-]""",21,"""6A18095694C19FDC"""
+"""6EF208D1EC512143_14A133002DA9B5DC_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](C)(=O)=O)CCCN""",21,"""6A3E0F4CE0FA12FD"""
+"""3F1F9E5D76F973C3_BE5407A62D55FA72_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](CC)(=O)=O)CCBr""",21,"""6A3E0F4CE0FA12FD"""
+"""89D7A167E186D68B_B0D8F189381E6493_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N(CCNC)[S](=O)(=O)C""",21,"""6A3E0F4CE0FA12FD"""
+"""086EEBB6E69B9D48_4CA2CDCD336FA999_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](CCCC)(=O)=O)C""",21,"""6A3E0F4CE0FA12FD"""
+"""23741C589057AC67_78B12F90E1CFD2C6_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""6A3E0F4CE0FA12FD"""
+"""73F1F273A886198F_68573E2250FD8B0B_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](C)(=O)=O)CCC#C""",21,"""6A3E0F4CE0FA12FD"""
+"""0F8C2552BD73C9C7_61153097BEC2A6AF_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)CCCCl""",21,"""6A3E0F4CE0FA12FD"""
+"""E239F62693BC21D5_20E97A93B8D23F64_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](CC)(=O)=O)CC#C""",21,"""6A3E0F4CE0FA12FD"""
+"""0275191CB22C3B33_793A96C5DB11C604_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3[S](CCCC3=O)(=O)=O""",21,"""6A3E0F4CE0FA12FD"""
+"""4C9123CB207F65EF_ABC40A5D24E8F852_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""6A3E0F4CE0FA12FD"""
+"""8E23159C713762DC_8E0D6DDE7A076586_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](C)(=O)=O)C3CNC3""",21,"""6A3E0F4CE0FA12FD"""
+"""1EC33075F4133DA0_54DA822D18E1CAA9_6036_DP""","""C(C1=NN=C[N]1C2=CC=CC=C2)N[S](=O)(=O)C3(CC3)C#N""",21,"""6A3E0F4CE0FA12FD"""
+"""786FC462A37743F3_43D6DB01C7705CA1_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)CCCN""",21,"""6A3E0F4CE0FA12FD"""
+"""A9AE0A6C0DC35F29_EACFF8E57A34A89E_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)C3COC3""",21,"""6A3E0F4CE0FA12FD"""
+"""0CA662A485A4EF2E_8AEA2907A6991801_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)CCOC""",21,"""6A3E0F4CE0FA12FD"""
+"""506B99D7AC969F35_2434B4E572A9CA14_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)CC(=O)C""",21,"""6A3E0F4CE0FA12FD"""
+"""208F3254401F9C1D_AC1CD251B427F959_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3CCCC(C)[S]3(=O)=O""",21,"""6A3E0F4CE0FA12FD"""
+"""EB91C157CC7AAA93_A1F3F4B60D1EC2FC_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3CCC(C)(C)[S]3(=O)=O""",21,"""6A3E0F4CE0FA12FD"""
+"""CBF7FA6ACDAB9D0B_9A5B55770C2930A3_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](CC)(=O)=O)CCN""",21,"""6A3E0F4CE0FA12FD"""
+"""93BDF98E948EECEE_DBF6C9CD326F3617_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N(CC)[S](=O)(=O)CCN""",21,"""6A3E0F4CE0FA12FD"""
+"""74588CC4C899CC49_616562383379C35A_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""6A3E0F4CE0FA12FD"""
+"""A6D95DDF9169B817_E95D5152F1D4D666_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""6A3E0F4CE0FA12FD"""
+"""2E9F6BC830982E85_867BC76F64529E38_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](CCNC)(=O)=O)C""",21,"""6A3E0F4CE0FA12FD"""
+"""2E9F6BC830982E85_5A8B3DF99DCD951E_6036_DP""","""C(C1=NN=C[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)CCNC""",21,"""6A3E0F4CE0FA12FD"""
+"""584BAF56886056BC_4B36B915E6F752C5_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3[S](CCC3CI)(=O)=O""",21,"""6A3E0F4CE0FA12FD"""
+"""162405BFBB460B71_D73012DD9CF95C08_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3C(CN)CC[S]3(=O)=O""",21,"""6A3E0F4CE0FA12FD"""
+"""6B9A49B073B78C5A_4467CD27E433F170_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N(CC(C)C)[S](=O)(=O)C""",21,"""6A3E0F4CE0FA12FD"""
+"""36B8329FB2DCD8AE_D86E588D9D399CA7_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3[S](=O)(CCNCC3)=O""",21,"""6A3E0F4CE0FA12FD"""
+"""F4772FD149D43F9C_6A8943D3B6A85C0C_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](C=C)(=O)=O)C3CC3""",21,"""6A3E0F4CE0FA12FD"""
+"""6A8F33D1DE2AC59F_CA8EC3D060AD55F3_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3CC4(C[S]3(=O)=O)CC4""",21,"""6A3E0F4CE0FA12FD"""
+"""C4D42DCEF733229B_06C5B0E168F244B1_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](C)(=O)=O)C(=O)CN""",21,"""6A3E0F4CE0FA12FD"""
+"""DA7EDE110140D59B_E446FED7B8877B7F_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N3CCCCC[S]3(=O)=O""",21,"""6A3E0F4CE0FA12FD"""
+"""4CA52DC5BF2B5047_F6ED6231BACFB523_6036_UN""","""C(C1=NN=C[N]1C2=CC=CC=C2)N([S](C)(=O)=O)CCCBr""",21,"""6A3E0F4CE0FA12FD"""
+"""BF70AF43EFF1184F_A6EE636C03ABB1F1_6003_UN""","""O(CC1=NN=C[N]1C2=CC=CC=C2)C3=CC=C(C=C3)C#N""",21,"""6A3E0F4CE0FA12FD"""
+"""BC9AE422771EB563_99CE996442330CD0_6003_UN""","""O(CC1=NN=C[N]1C2=CC=CC=C2)C3=CC=CC=C3[N+]#[C-]""",21,"""6A3E0F4CE0FA12FD"""
+"""19EE29B86323971F_9E996C16237E3172_6003_UN""","""O(CC1=NN=C[N]1C2=CC=CC=C2)C3=CC=CC=C3C#N""",21,"""6A3E0F4CE0FA12FD"""
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+"""907D70D7E970D60A_41179E7E3FE4E80A_6006_UN""","""CC3=CSC1=C(C=C(C=C1)C2=C(C(=CC=C2O)F)F)C3=O""",21,"""6B69F24F92091AC9"""
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+"""9DDC90764997FB9E_0BE3EDCB0AB482BC_6006_UN""","""CC4=CSC1=C(C=C(C=C1)C2=CC3=C(C=C2)CCO3)C4=O""",21,"""6B69F24F92091AC9"""
+"""82B35C1A290A0F50_5D20973F3ECED13F_6006_UN""","""CC3=CSC1=C(C=C(C=C1)C2=CC=C(C=C2)[N](=O)=O)C3=O""",21,"""6B69F24F92091AC9"""
+"""7305CA7BDF5A73BC_A6EE939AF1ED64A4_6006_UN""","""CC4=CSC1=C(C=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3)C4=O""",21,"""6B69F24F92091AC9"""
+"""7B6F84D0BE5D3F8D_025AF01A803436E6_6006_UN""","""CC3=CSC1=C(C=C(C=C1)C2=CC=C(S2)C(F)(F)F)C3=O""",21,"""6B69F24F92091AC9"""
+"""CF175F2FA6414B2C_0E2F2760E4FB34D4_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC(=C(C(=C2)F)F)F""",21,"""6B9BD3ABD111E440"""
+"""777858F911A599DE_232E80F6C30D01E8_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=C(C(C)C)C=C2""",21,"""6B9BD3ABD111E440"""
+"""8DE4BED2C69B3D71_81AD47C713142A2D_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC3=C(C=C2)CCC3""",21,"""6B9BD3ABD111E440"""
+"""DF2431C0B197A5C7_217F070B0C7C508F_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=CC(=C2)C#CC""",21,"""6B9BD3ABD111E440"""
+"""0259FC91A99B6C7E_217B83791D147B10_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=CC(=C2)CSC""",21,"""6B9BD3ABD111E440"""
+"""4947E04E081E1610_A1953357BF035715_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CN=C(C=C2)[N](=O)=O""",21,"""6B9BD3ABD111E440"""
+"""143E062EC6DB6570_F9CE317B199BA53F_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CSC=C2C(F)(F)F""",21,"""6B9BD3ABD111E440"""
+"""3B42E0EABEF185CA_D0C5D411A914A0BE_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC(=CC=C2)C(=O)O""",21,"""6B9BD3ABD111E440"""
+"""771C8341CD833B8D_32C921109C25EF3D_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C3=C2[NH]C=CC2=CC=C3""",21,"""6B9BD3ABD111E440"""
+"""5E0EE776A591D556_F12994403D7C9E2A_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=C(C=C(C)C=C2F)F""",21,"""6B9BD3ABD111E440"""
+"""A4533E0D77764C2F_4592EA488A27BF71_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=CC3=NON=C23""",21,"""6B9BD3ABD111E440"""
+"""ADBCEB6102EABE85_02E8B410E72DEC09_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=C(C(=C(C)C=C2)F)F""",21,"""6B9BD3ABD111E440"""
+"""48D533A687B8FE95_4323FFD1EDB0C18D_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C3=C[N]2C=NN=C2C=C3""",21,"""6B9BD3ABD111E440"""
+"""76D260EFFEEE5AB3_AD151C196F8E1221_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC(=C(C=C2)F)OC""",21,"""6B9BD3ABD111E440"""
+"""2E61A9DE5847F316_BBC85FA8A81B8D5D_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=C(C=C(C)C=C2C)C""",21,"""6B9BD3ABD111E440"""
+"""353BD36ABAC1B4AF_CE0300E7EFCFEBD1_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=C(OC)C=CC=C2F""",21,"""6B9BD3ABD111E440"""
+"""ACDE323CA962947A_1E50A0E4E111DCFD_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=C(C(N)=O)C=C2""",21,"""6B9BD3ABD111E440"""
+"""8EA1CA70737874F9_C42F89D85B063948_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC(=C(OC)C=C2)F""",21,"""6B9BD3ABD111E440"""
+"""A5DE95C3069959B1_9C878A1D0B6BD594_6006_DP""","""COCC1=C(C=CC(=C1)[N](=O)=O)C3=C2[N](CCNC2)N=C3""",21,"""6B9BD3ABD111E440"""
+"""3B42E0EABEF185CA_90D6E845F0CD808F_6006_DP""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=CC(=C2)C(O)=O""",21,"""6B9BD3ABD111E440"""
+"""268642073EF5EC3B_B97D827302BF90F4_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=CC(=C2F)OC""",21,"""6B9BD3ABD111E440"""
+"""0F3FBD747EADAD30_0EE2F50DCA4E529C_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=C(C=CC(=C2)OC)C""",21,"""6B9BD3ABD111E440"""
+"""1FEA8C2704CC5AB8_1FBA59EAAB0A2391_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C3=C2OC=CC2=CC=C3""",21,"""6B9BD3ABD111E440"""
+"""0215AB1B7B1E9410_A64B5D4FAA7417A7_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=C(OC)C=C(C=C2)F""",21,"""6B9BD3ABD111E440"""
+"""78FBC58D2649994C_A6164107F4CF816E_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC(=C(OC)C=C2)C""",21,"""6B9BD3ABD111E440"""
+"""9A3C3FCC8BBF4F1E_B6512E4F43C3EEF1_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=C(C(C)O)C=C2""",21,"""6B9BD3ABD111E440"""
+"""9E804B9017E7652B_BE7592F07CE7A9D0_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=COC(=C2)C(F)(F)F""",21,"""6B9BD3ABD111E440"""
+"""CA131D34258EDDD7_A080D475C375FE23_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC(=CS2)C(F)(F)F""",21,"""6B9BD3ABD111E440"""
+"""3C1D087D4C1942F5_2311D6B14294C838_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CN=C(N(C)C)N=C2""",21,"""6B9BD3ABD111E440"""
+"""6AF5E45128CFBF3F_F6903F25748F10FB_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C3=CC2=C(C=CC=N2)S3""",21,"""6B9BD3ABD111E440"""
+"""3C5DDBF03EF483C6_41E5BF9A7CFC1683_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=C(C(=CC=C2O)F)F""",21,"""6B9BD3ABD111E440"""
+"""AF4768009A05A188_A6A685102DBA1599_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CSC3=C2C=CC=C3""",21,"""6B9BD3ABD111E440"""
+"""18A09F6F760D7C19_D9A039A5EA8D670E_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=C[N]3N=CC=C23""",21,"""6B9BD3ABD111E440"""
+"""35F79C1A1F87414C_600A10246BCB8CB9_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CN=C(C=C2)C(F)F""",21,"""6B9BD3ABD111E440"""
+"""685BA4977EC49268_0B11CC2F49AC7C35_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC3=C(C=C2)CCO3""",21,"""6B9BD3ABD111E440"""
+"""61850569DA1D42D7_5DD2B6DB7DD62FB6_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=C(C=C2)[N](=O)=O""",21,"""6B9BD3ABD111E440"""
+"""3D87513A1FCF45BB_A61CB27EB2F59A2D_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC3=C(C=C2)C=N[NH]3""",21,"""6B9BD3ABD111E440"""
+"""D0AD442BAA5E8193_02A8D1FEC32CC86F_6006_UN""","""COCC1=C(C=CC(=C1)[N](=O)=O)C2=CC=C(S2)C(F)(F)F""",21,"""6B9BD3ABD111E440"""
+"""98B166DE9D872F5D_1524E4B1E913A2FF_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](C)(=O)=O)CCCN""",21,"""6BBBD8FD244005DE"""
+"""41C2898371104418_BFD1D017E9EFED51_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](CC)(=O)=O)CCBr""",21,"""6BBBD8FD244005DE"""
+"""5557F367AF49DD68_B15D2638FCA473B0_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N(CCNC)[S](=O)(=O)C""",21,"""6BBBD8FD244005DE"""
+"""AC6EF2FBD19ED3BF_4D271A7CF7D5BEBA_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](CCCC)(=O)=O)C""",21,"""6BBBD8FD244005DE"""
+"""28D9470F53C1D3DC_7934F8212575C5E5_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4C(C(C)(C)[S]4(=O)=O)=O""",21,"""6BBBD8FD244005DE"""
+"""2779ED4FDCF763DA_69D2E99394479C28_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](C)(=O)=O)CCC#C""",21,"""6BBBD8FD244005DE"""
+"""5C6F5258B1FDBE6E_6090E7267A78B18C_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N(C)[S](=O)(=O)CCCCl""",21,"""6BBBD8FD244005DE"""
+"""C0321DCF9C1D7A38_216CAD227C682847_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](CC)(=O)=O)CC#C""",21,"""6BBBD8FD244005DE"""
+"""4B9FDA6D9A267110_78BF41741FABD127_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4[S](CCCC4=O)(=O)=O""",21,"""6BBBD8FD244005DE"""
+"""AB111A2C5C58B5D1_AA41DDECE052EF71_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4C(C(N)C[S]4(=O)=O)=O""",21,"""6BBBD8FD244005DE"""
+"""20BCAD11159C6E79_8F88BA6FBEBD72A5_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](C)(=O)=O)C4CNC4""",21,"""6BBBD8FD244005DE"""
+"""C2F3613388E29F26_555F559CDC5BDD8A_6036_DP""","""C1(CC2CCC(C1)N2CC3CC3)N[S](=O)(=O)C4(CC4)C#N""",21,"""6BBBD8FD244005DE"""
+"""46193E24867E55F0_42530CB003CA4B82_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N(C)[S](=O)(=O)CCCN""",21,"""6BBBD8FD244005DE"""
+"""5CAF31A317C542EA_EB4A2F54BE8EBFBD_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N(C)[S](=O)(=O)C4COC4""",21,"""6BBBD8FD244005DE"""
+"""C053CFC740543AFA_8B6FFEB662230F22_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N(C)[S](=O)(=O)CCOC""",21,"""6BBBD8FD244005DE"""
+"""47FE8E4C3D51604C_25B16354B613DD37_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N(C)[S](=O)(=O)CC(=O)C""",21,"""6BBBD8FD244005DE"""
+"""26C594004CEA5750_AD9905E0709DEE7A_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4CCCC(C)[S]4(=O)=O""",21,"""6BBBD8FD244005DE"""
+"""A44F609AE4CBEF8F_A0762307C9A4D5DF_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4CCC(C)(C)[S]4(=O)=O""",21,"""6BBBD8FD244005DE"""
+"""2EAE1D153711B524_9BDE82C6C8932780_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](CC)(=O)=O)CCN""",21,"""6BBBD8FD244005DE"""
+"""963867B3AC0B2AED_DA731E7CF6D52134_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N(CC)[S](=O)(=O)CCN""",21,"""6BBBD8FD244005DE"""
+"""B404F09FE06C87C1_60E0B589F7C3D479_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N(C)[S](=O)(=O)C(C)(C)C""",21,"""6BBBD8FD244005DE"""
+"""05920589A83E4BAC_E8D886E3356EC145_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4[S](=O)(=O)C5(CC4)CC5""",21,"""6BBBD8FD244005DE"""
+"""61DD626DC303CB82_87FE10DEA0E8891B_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](CCNC)(=O)=O)C""",21,"""6BBBD8FD244005DE"""
+"""61DD626DC303CB82_5B0EEA485977823D_6036_DP""","""C1(CC2CCC(C1)N2CC3CC3)N(C)[S](=O)(=O)CCNC""",21,"""6BBBD8FD244005DE"""
+"""E1CDF4903C4CEDC7_4AB36EA4224D45E6_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4[S](CCC4CI)(=O)=O""",21,"""6BBBD8FD244005DE"""
+"""93874E629F269793_D6B5C56C58434B2B_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4C(CN)CC[S]4(=O)=O""",21,"""6BBBD8FD244005DE"""
+"""E68BF94DEC5C5C64_45E21A962089E653_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N(CC(C)C)[S](=O)(=O)C""",21,"""6BBBD8FD244005DE"""
+"""76404FEDF7C57ECB_D9EB8F3C59838B84_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4[S](=O)(CCNCC4)=O""",21,"""6BBBD8FD244005DE"""
+"""F2C02EE84DE0E53E_6B0C946272124B2F_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](C=C)(=O)=O)C4CC4""",21,"""6BBBD8FD244005DE"""
+"""6E8731CA87E6BA1F_CB0B1461A41742D0_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4CC5(C[S]4(=O)=O)CC5""",21,"""6BBBD8FD244005DE"""
+"""4A617CDCC1DEF66B_07406750AC485392_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](C)(=O)=O)C(=O)CN""",21,"""6BBBD8FD244005DE"""
+"""88059E2C59D06E6E_E5C329667C3D6C5C_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N4CCCCC[S]4(=O)=O""",21,"""6BBBD8FD244005DE"""
+"""63D64831E809F65D_F768B5807E75A200_6036_UN""","""C1(CC2CCC(C1)N2CC3CC3)N([S](C)(=O)=O)CCCBr""",21,"""6BBBD8FD244005DE"""
+"""15831E63657822B0_A76BB4DDC711A6D2_6003_UN""","""O(C1CC2CCC(C1)N2CC3CC3)C4=CC=C(C=C4)C#N""",21,"""6BBBD8FD244005DE"""
+"""5C8CCCBD6253CC0C_984B4ED586891BF3_6003_UN""","""O(C1CC2CCC(C1)N2CC3CC3)C4=CC=CC=C4[N+]#[C-]""",21,"""6BBBD8FD244005DE"""
+"""C159F0E974442A65_9F1CBBA7E7C42651_6003_UN""","""O(C1CC2CCC(C1)N2CC3CC3)C4=CC=CC=C4C#N""",21,"""6BBBD8FD244005DE"""
+"""314DF549055BC2F3_779C19C3793A0F2D_6003_UN""","""O(C1CC2CCC(C1)N2CC3CC3)C4=CC=C(C=C4)[N+]#[C-]""",21,"""6BBBD8FD244005DE"""
+"""0CEB989F9D73C396_F9A79C21C617D853_6003_UN""","""O(C1CC2CCC(C1)N2CC3CC3)C4=CC=CC(=C4)[N+]#[C-]""",21,"""6BBBD8FD244005DE"""
+"""F0FFFC2F011C33D1_0E7E864CA6EA6AC7_6006_UN""","""C1(=NN=C(C=C1)N2CCCCC2)C3=CC(=C(C(=C3)F)F)F""",21,"""6BCA72879300BA53"""
+"""78D54C5BEB0B45BB_237F21DA811C5FFB_6006_UN""","""C1(=NN=C(C=C1)N2CCCCC2)C3=CC=C(C(C)C)C=C3""",21,"""6BCA72879300BA53"""
+"""81D6EF37D1BAD946_81FCE6EB5105743E_6006_UN""","""C1(=NN=C(C=C1)N2CCCCC2)C3=CC4=C(C=C3)CCC4""",21,"""6BCA72879300BA53"""
+"""D6F89E6C0221C12D_212EA6274E6D0E9C_6006_UN""","""C1(=NN=C(C=C1)N2CCCCC2)C3=CC=CC(=C3)C#CC""",21,"""6BCA72879300BA53"""
+"""9EDA5ACC34FB2EA1_212A22555F052503_6006_UN""","""C1(=NN=C(C=C1)N2CCCCC2)C3=CC=CC(=C3)CSC""",21,"""6BCA72879300BA53"""
+"""A9F27D8F5F057361_A1C4927BFD120906_6006_UN""","""C1(=NN=C(C=C1)N2CCCCC2)C3=CN=C(C=C3)[N](=O)=O""",21,"""6BCA72879300BA53"""
+"""F3D4EB0C9F3B7DF5_F99F90575B8AFB2C_6006_UN""","""C1(=NN=C(C=C1)N2CCCCC2)C3=CSC=C3C(F)(F)F""",21,"""6BCA72879300BA53"""
+"""AEE075319840C802_D094753DEB05FEAD_6006_UN""","""C1(=NN=C(C=C1)N2CCCCC2)C3=CC(=CC=C3)C(=O)O""",21,"""6BCA72879300BA53"""
+"""FFB544BE3F727C2C_3298803CDE34B12E_6006_UN""","""C1(=NN=C(C=C1)N2CCCCC2)C4=C3[NH]C=CC3=CC=C4""",21,"""6BCA72879300BA53"""
+"""01C25E53C51954FA_F178356C7F6DC039_6006_UN""","""C1(=NN=C(C=C1)N2CCCCC2)C3=C(C=C(C)C=C3F)F""",21,"""6BCA72879300BA53"""
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+"""814BA115E5F1064B_0593CB3327918F20_6006_UN""","""COC(=O)C1=C(C(=CC=C1F)N)C2=CC=C(S2)C(F)(F)F""",21,"""6CA0C96635ACA30F"""
+"""76CD0AD7CEE7B50A_122D1979A61130F8_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N([S](C)(=O)=O)CCCN""",21,"""6CB225356B4297D9"""
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+"""D863FDA2C3C3121B_67991AEE357A238B_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N(C)[S](=O)(=O)CCCCl""",21,"""6CB225356B4297D9"""
+"""803A9935E6B9F281_266550EA336ABA40_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N([S](CC)(=O)=O)CC#C""",21,"""6CB225356B4297D9"""
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+"""5768B895AA86C862_888147A7F1BFE0A2_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N([S](C)(=O)=O)C2CNC2""",21,"""6CB225356B4297D9"""
+"""5D3E0C2E0C13398B_5256A85493594F8D_6036_DP""","""C(CC1=CC=NC=C1)(C(F)(F)F)N[S](=O)(=O)C2(CC2)C#N""",21,"""6CB225356B4297D9"""
+"""8EF4D5166B7C32CA_455AF1784CC8D985_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N(C)[S](=O)(=O)CCCN""",21,"""6CB225356B4297D9"""
+"""558A8E13EBDE2A53_EC43D29CF18C2DBA_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N(C)[S](=O)(=O)C2COC2""",21,"""6CB225356B4297D9"""
+"""441D6D7969F621FB_8C66037E2D219D25_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N(C)[S](=O)(=O)CCOC""",21,"""6CB225356B4297D9"""
+"""5DF544D8E29B6B39_22B89E9CF9114F30_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N(C)[S](=O)(=O)CC(=O)C""",21,"""6CB225356B4297D9"""
+"""3ECC71C51AF578D5_AA90F8283F9F7C7D_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N2CCCC(C)[S]2(=O)=O""",21,"""6CB225356B4297D9"""
+"""7CD84F4BABBA7F85_A77FDECF86A647D8_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N2CCC(C)(C)[S]2(=O)=O""",21,"""6CB225356B4297D9"""
+"""532F243765BBA5AD_9CD77F0E8791B587_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N([S](CC)(=O)=O)CCN""",21,"""6CB225356B4297D9"""
+"""4062D68D54198520_DD7AE3B4B9D7B333_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N(CC)[S](=O)(=O)CCN""",21,"""6CB225356B4297D9"""
+"""021552CC6B696472_67E94841B8C1467E_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N(C)[S](=O)(=O)C(C)(C)C""",21,"""6CB225356B4297D9"""
+"""F0AC948ACE1E0CA4_EFD17B2B7A6C5342_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N2[S](=O)(=O)C3(CC2)CC3""",21,"""6CB225356B4297D9"""
+"""87FB084083E3C15B_80F7ED16EFEA1B1C_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N([S](CCNC)(=O)=O)C""",21,"""6CB225356B4297D9"""
+"""87FB084083E3C15B_5C0717801675103A_6036_DP""","""C(CC1=CC=NC=C1)(C(F)(F)F)N(C)[S](=O)(=O)CCNC""",21,"""6CB225356B4297D9"""
+"""923AB04B49BFBB64_4DBA936C6D4FD7E1_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N2[S](CCC2CI)(=O)=O""",21,"""6CB225356B4297D9"""
+"""5277A7581F6912CB_D1BC38A41741D92C_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N2C(CN)CC[S]2(=O)=O""",21,"""6CB225356B4297D9"""
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+"""319C9CDE4CCC9352_DEE272F416811983_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N2[S](=O)(CCNCC2)=O""",21,"""6CB225356B4297D9"""
+"""703DA814867D6B1C_6C0569AA3D10D928_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N([S](C=C)(=O)=O)C2CC2""",21,"""6CB225356B4297D9"""
+"""856BD3C7365426DF_CC02E9A9EB15D0D7_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N2CC3(C[S]2(=O)=O)CC3""",21,"""6CB225356B4297D9"""
+"""9E09FF382197F33A_00499A98E34AC195_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N([S](C)(=O)=O)C(=O)CN""",21,"""6CB225356B4297D9"""
+"""2121D909CD3454D3_E2CAD4AE333FFE5B_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N2CCCCC[S]2(=O)=O""",21,"""6CB225356B4297D9"""
+"""3D9552D651988117_F061484831773007_6036_UN""","""C(CC1=CC=NC=C1)(C(F)(F)F)N([S](C)(=O)=O)CCCBr""",21,"""6CB225356B4297D9"""
+"""55AB729AB907FD21_A0624915881334D5_6003_UN""","""O(C(CC1=CC=NC=C1)C(F)(F)F)C2=CC=C(C=C2)C#N""",21,"""6CB225356B4297D9"""
+"""052D26CD012321B3_9F42B31DC98B89F4_6003_UN""","""O(C(CC1=CC=NC=C1)C(F)(F)F)C2=CC=CC=C2[N+]#[C-]""",21,"""6CB225356B4297D9"""
+"""80983DE07041BD23_9815466FA8C6B456_6003_UN""","""O(C(CC1=CC=NC=C1)C(F)(F)F)C2=CC=CC=C2C#N""",21,"""6CB225356B4297D9"""
+"""DCD101826A354A2C_7095E40B36389D2A_6003_UN""","""O(C(CC1=CC=NC=C1)C(F)(F)F)C2=CC=C(C=C2)[N+]#[C-]""",21,"""6CB225356B4297D9"""
+"""16977B2CEAB6DA42_FEAE61E989154A54_6003_UN""","""O(C(CC1=CC=NC=C1)C(F)(F)F)C2=CC=CC(=C2)[N+]#[C-]""",21,"""6CB225356B4297D9"""
+"""0E8A7795BE7E8B51_1270A1C8F1D5728D_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](C)(=O)=O)CCCN""",21,"""6CEF9D843C86D5AC"""
+"""04A5C707BB055AD2_B885956EF1293D23_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](CC)(=O)=O)CCBr""",21,"""6CEF9D843C86D5AC"""
+"""6169B3FB6E5DB450_B6096341E462A3C2_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N(CCNC)[S](=O)(=O)C""",21,"""6CEF9D843C86D5AC"""
+"""775B9930F72ACF91_4A735F05EF136EC8_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](CCCC)(=O)=O)C""",21,"""6CEF9D843C86D5AC"""
+"""12046A54298C026B_7E60BD583DB31597_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""6CEF9D843C86D5AC"""
+"""8C7AF25090EB8286_6E86ACEA8C814C5A_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](C)(=O)=O)CCC#C""",21,"""6CEF9D843C86D5AC"""
+"""D2DA77C4952A5B94_67C4A25F62BE61FE_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N(C)[S](=O)(=O)CCCCl""",21,"""6CEF9D843C86D5AC"""
+"""92AE55054C63D591_2638E85B64AEF835_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](CC)(=O)=O)CC#C""",21,"""6CEF9D843C86D5AC"""
+"""E22E32120B37D515_7FEB040D076D0155_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3[S](CCCC3=O)(=O)=O""",21,"""6CEF9D843C86D5AC"""
+"""88AFECD177A39CD1_AD159895F8943F03_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""6CEF9D843C86D5AC"""
+"""4256C4382F724FA3_88DCFF16A67BA2D7_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](C)(=O)=O)C3CNC3""",21,"""6CEF9D843C86D5AC"""
+"""0D13550DF67741B1_520B10E5C49D0DF8_6036_DP""","""CC(C1=CC2=C(C=C1)CCCC2)N[S](=O)(=O)C3(CC3)C#N""",21,"""6CEF9D843C86D5AC"""
+"""8FA9E88E04F2E6C5_450749C91B0C9BF0_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N(C)[S](=O)(=O)CCCN""",21,"""6CEF9D843C86D5AC"""
+"""4E7D33B3B114EA51_EC1E6A2DA6486FCF_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N(C)[S](=O)(=O)C3COC3""",21,"""6CEF9D843C86D5AC"""
+"""D2142C075AE5EA7F_8C3BBBCF7AE5DF50_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N(C)[S](=O)(=O)CCOC""",21,"""6CEF9D843C86D5AC"""
+"""402ECB99C34C7B32_22E5262DAED50D45_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N(C)[S](=O)(=O)CC(=O)C""",21,"""6CEF9D843C86D5AC"""
+"""1D4E12DEEB10BD76_AACD4099685B3E08_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3CCCC(C)[S]3(=O)=O""",21,"""6CEF9D843C86D5AC"""
+"""F4DBE2DD5E7F95A1_A722667ED16205AD_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3CCC(C)(C)[S]3(=O)=O""",21,"""6CEF9D843C86D5AC"""
+"""6DF5357B81C7C8C9_9C8AC7BFD055F7F2_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](CC)(=O)=O)CCN""",21,"""6CEF9D843C86D5AC"""
+"""7844ECEAB4673B01_DD275B05EE13F146_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N(CC)[S](=O)(=O)CCN""",21,"""6CEF9D843C86D5AC"""
+"""1468169CA7A8CD75_67B4F0F0EF05040B_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""6CEF9D843C86D5AC"""
+"""D9773F982202E921_EF8CC39A2DA81137_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""6CEF9D843C86D5AC"""
+"""5CBAE6EE38C9DCC7_80AA55A7B82E5969_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](CCNC)(=O)=O)C""",21,"""6CEF9D843C86D5AC"""
+"""5CBAE6EE38C9DCC7_5C5AAF3141B1524F_6036_DP""","""CC(C1=CC2=C(C=C1)CCCC2)N(C)[S](=O)(=O)CCNC""",21,"""6CEF9D843C86D5AC"""
+"""87EB8236A2B9636A_4DE72BDD3A8B9594_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3[S](CCC3CI)(=O)=O""",21,"""6CEF9D843C86D5AC"""
+"""63978F4652F869FC_D1E1801540859B59_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3C(CN)CC[S]3(=O)=O""",21,"""6CEF9D843C86D5AC"""
+"""DB867A3E020B9306_42B65FEF384F3621_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N(CC(C)C)[S](=O)(=O)C""",21,"""6CEF9D843C86D5AC"""
+"""706DCB08F5D2C9DB_DEBFCA4541455BF6_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3[S](=O)(CCNCC3)=O""",21,"""6CEF9D843C86D5AC"""
+"""2BB0D4BAD4282AD5_6C58D11B6AD49B5D_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](C=C)(=O)=O)C3CC3""",21,"""6CEF9D843C86D5AC"""
+"""CAC9C8B66B9FE475_CC5F5118BCD192A2_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3CC4(C[S]3(=O)=O)CC4""",21,"""6CEF9D843C86D5AC"""
+"""80767F1FE3F34365_00142229B48E83E0_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](C)(=O)=O)C(=O)CN""",21,"""6CEF9D843C86D5AC"""
+"""0506289CA8AF5D5E_E2976C1F64FBBC2E_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N3CCCCC[S]3(=O)=O""",21,"""6CEF9D843C86D5AC"""
+"""9DB1A78895DD8FC0_F03CF0F966B37272_6036_UN""","""CC(C1=CC2=C(C=C1)CCCC2)N([S](C)(=O)=O)CCCBr""",21,"""6CEF9D843C86D5AC"""
+"""3BC5CE8115059F68_A03FF1A4DFD776A0_6003_UN""","""CC(OC1=CC=C(C=C1)C#N)C2=CC3=C(C=C2)CCCC3""",21,"""6CEF9D843C86D5AC"""
+"""F0C1E005C48C4614_9F1F0BAC9E4FCB81_6003_UN""","""CC(OC1=CC=CC=C1[N+]#[C-])C2=CC3=C(C=C2)CCCC3""",21,"""6CEF9D843C86D5AC"""
+"""8A41F2F190567C97_9848FEDEFF02F623_6003_UN""","""CC(OC1=CC=CC=C1C#N)C2=CC3=C(C=C2)CCCC3""",21,"""6CEF9D843C86D5AC"""
+"""37992F6F722B0802_70C85CBA61FCDF5F_6003_UN""","""CC(OC1=CC=C(C=C1)[N+]#[C-])C2=CC3=C(C=C2)CCCC3""",21,"""6CEF9D843C86D5AC"""
+"""1B2C6D33ABEA24F5_FEF3D958DED10821_6003_UN""","""CC(OC1=CC=CC(=C1)[N+]#[C-])C2=CC3=C(C=C2)CCCC3""",21,"""6CEF9D843C86D5AC"""
+"""A7BD5828DDAB3B06_08D2CDC4DBB24C10_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""6D66390FEE589C84"""
+"""FA40ECE0C76504D7_25D36A52FC44792C_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC=C(C(C)C)C=C2""",21,"""6D66390FEE589C84"""
+"""231C032450720C21_8750AD632C5D52E9_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC3=C(C=C2)CCC3""",21,"""6D66390FEE589C84"""
+"""86044335B0AE04E1_2782EDAF3335284B_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC=CC(=C2)C#CC""",21,"""6D66390FEE589C84"""
+"""BCC2918D8954A9D7_278669DD225D03D4_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC=CC(=C2)CSC""",21,"""6D66390FEE589C84"""
+"""E0439115FFF2F693_A768D9F3804A2FD1_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""6D66390FEE589C84"""
+"""5F2D40917F09B12C_FF33DBDF26D2DDFB_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CSC=C2C(F)(F)F""",21,"""6D66390FEE589C84"""
+"""74B6ADF7C36BB017_D6383EB5965DD87A_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC(=CC=C2)C(=O)O""",21,"""6D66390FEE589C84"""
+"""C0E424C7391A81D4_3434CBB4A36C97F9_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""6D66390FEE589C84"""
+"""EB3D4B4A46EF36B4_F7D47EE40235E6EE_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=C(C=C(C)C=C2F)F""",21,"""6D66390FEE589C84"""
+"""7AC025C2CCBDC49B_436F00ECB56EC7B5_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC=CC3=NON=C23""",21,"""6D66390FEE589C84"""
+"""0651BD42EAAE2C9B_04155EB4D86494CD_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=C(C(=C(C)C=C2)F)F""",21,"""6D66390FEE589C84"""
+"""C730087978419B27_45DE1575D2F9B949_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C3=C[N]2C=NN=C2C=C3""",21,"""6D66390FEE589C84"""
+"""E2A8DE431199FD78_ABE8F6BD50C76AE5_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC(=C(C=C2)F)OC""",21,"""6D66390FEE589C84"""
+"""82BE72EE8049C2BA_BD35B50C9752F599_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=C(C=C(C)C=C2C)C""",21,"""6D66390FEE589C84"""
+"""36C512B2FE3F136D_C8FEEA43D0869315_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=C(OC)C=CC=C2F""",21,"""6D66390FEE589C84"""
+"""0D2F99B1D4950177_18AD4A40DE58A439_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC=C(C(N)=O)C=C2""",21,"""6D66390FEE589C84"""
+"""456BA142BCD557E0_C2D2637C644F418C_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC(=C(OC)C=C2)F""",21,"""6D66390FEE589C84"""
+"""9E1AC33BD7A6225D_9A7A60B93422AD50_6006_DP""","""CC(C)OC(=O)C1=C(N=CC=C1)C3=C2[N](CCNC2)N=C3""",21,"""6D66390FEE589C84"""
+"""74B6ADF7C36BB017_962B02E1CF84F84B_6006_DP""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC=CC(=C2)C(O)=O""",21,"""6D66390FEE589C84"""
+"""C19618373C8F1D5F_BF8068D73DF6E830_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=CC=CC(=C2F)OC""",21,"""6D66390FEE589C84"""
+"""8843A435591E531C_081F1FA9F5072A58_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=C(C=CC(=C2)OC)C""",21,"""6D66390FEE589C84"""
+"""4C6475862E6DBF59_1947B34E94435B55_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C3=C2OC=CC2=CC=C3""",21,"""6D66390FEE589C84"""
+"""CF350F895CB39FA6_A0B6B7EB953D6F63_6006_UN""","""CC(C)OC(=O)C1=C(N=CC=C1)C2=C(OC)C=C(C=C2)F""",21,"""6D66390FEE589C84"""
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+"""5FCDFD291C118CCC_5901681D76F512DB_6006_UN""","""N[S](=O)(=O)CCC1=C(N=CC=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""6F480D6DDA32D92D"""
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+"""FA14308840AF2DD4_067B0F38C80FF502_6006_UN""","""N[S](=O)(=O)CCC1=C(N=CC=C1)C2=CC=C(S2)C(F)(F)F""",21,"""6F480D6DDA32D92D"""
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+"""360B3C1F1E62B05C_2735D5655E014759_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=CC=C(C(C)C)C=C3""",21,"""6F8086384C1DA2F1"""
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+"""14318368C0BF468C_256452989170163E_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=CC=CC(=C3)C#CC""",21,"""6F8086384C1DA2F1"""
+"""92DAC4084EB5367F_2560D6EA80183DA1_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=CC=CC(=C3)CSC""",21,"""6F8086384C1DA2F1"""
+"""0C76737304AD162E_A58E66C4220F11A4_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=CN=C(C=C3)[N](=O)=O""",21,"""6F8086384C1DA2F1"""
+"""86C63AEA1E800401_FDD564E88497E38E_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=CSC=C3C(F)(F)F""",21,"""6F8086384C1DA2F1"""
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+"""9511B05BAA0DBEF6_36D274830129A98C_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C4=C3[NH]C=CC3=CC=C4""",21,"""6F8086384C1DA2F1"""
+"""494054698DD35265_F532C1D3A070D89B_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=C(C=C(C)C=C3F)F""",21,"""6F8086384C1DA2F1"""
+"""0C8A98B8AB21E8AD_4189BFDB172BF9C0_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=CC=CC4=NON=C34""",21,"""6F8086384C1DA2F1"""
+"""BF2970BDC025A22A_06F3E1837A21AAB8_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=C(C(=C(C)C=C3)F)F""",21,"""6F8086384C1DA2F1"""
+"""160E363CF3E440C8_4738AA4270BC873C_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C4=C[N]3C=NN=C3C=C4""",21,"""6F8086384C1DA2F1"""
+"""47830C7605E1B1EB_A90E498AF2825490_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=CC(=C(C=C3)F)OC""",21,"""6F8086384C1DA2F1"""
+"""6C3CA3661839BD32_BFD30A3B3517CBEC_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=C(C=C(C)C=C3C)C""",21,"""6F8086384C1DA2F1"""
+"""DEBDF56C45E9C5A8_CA18557472C3AD60_6006_UN""","""C1(=NC(=CC=C1)C2=NC=CC=C2)C3=C(OC)C=CC=C3F""",21,"""6F8086384C1DA2F1"""
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+"""B9D6DBCCE5E8BEFC_046F9DEAF9D00E03_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C4=C3OC=CC3=CC=C4""",21,"""704E17AB83CBC9D2"""
+"""AE8F0F85F18B6A77_BD9E994FF8AE3A35_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C3=C(OC)C=C(C=C3)F""",21,"""704E17AB83CBC9D2"""
+"""2E49C6DD15F953F9_BDC38507A615ACFC_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C3=CC(=C(OC)C=C3)C""",21,"""704E17AB83CBC9D2"""
+"""9640C6176136E558_AD84EA4F1119C363_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C3=CC=C(C(C)O)C=C3""",21,"""704E17AB83CBC9D2"""
+"""37F5290B2B82A0D0_A5A056F02E3D8442_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C3=COC(=C3)C(F)(F)F""",21,"""704E17AB83CBC9D2"""
+"""0859C2DA122AE97D_BB55107591AFD3B1_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C3=CC(=CS3)C(F)(F)F""",21,"""704E17AB83CBC9D2"""
+"""3C41C1A35DB447E8_38C412B1104EE5AA_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C3=CN=C(N(C)C)N=C3""",21,"""704E17AB83CBC9D2"""
+"""63E62E448FB7C15B_ED45FB2526553D69_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C4=CC3=C(C=CC=N3)S4""",21,"""704E17AB83CBC9D2"""
+"""89AAEA947CD9B6A9_5A307B9A2E263B11_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C3=C(C(=CC=C3O)F)F""",21,"""704E17AB83CBC9D2"""
+"""6B631C6178C2B49E_BD7341107F60380B_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C3=CSC4=C3C=CC=C4""",21,"""704E17AB83CBC9D2"""
+"""BE863678A3DCC462_C275FDA5B8574A9C_6006_UN""","""CNCC1=CN=C2C=CC(=C[N]12)C3=CC=C[N]4N=CC=C34""",21,"""704E17AB83CBC9D2"""
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+"""C268DC5AE65428BD_A08C4E94FE7FE5A5_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CC=CC(=C3F)OC""",21,"""726A1F4C2DD19111"""
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+"""1D63BBB68B3447E6_BFBA91A856B462F6_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=C(OC)C=C(C=C3)F""",21,"""726A1F4C2DD19111"""
+"""C264A0728773A2F3_BFE78DE0080FF43F_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CC(=C(OC)C=C3)C""",21,"""726A1F4C2DD19111"""
+"""AEA78CE3BB1DAB39_AFA0E2A8BF039BA0_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CC=C(C(C)O)C=C3""",21,"""726A1F4C2DD19111"""
+"""D82E53E96A058C42_A7845E178027DC81_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=COC(=C3)C(F)(F)F""",21,"""726A1F4C2DD19111"""
+"""7141AC29327988B9_B97118923FB58B72_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CC(=CS3)C(F)(F)F""",21,"""726A1F4C2DD19111"""
+"""664844D11F8E2321_3AE01A56BE54BD69_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CN=C(N(C)C)N=C3""",21,"""726A1F4C2DD19111"""
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+"""8E0F4529D4C7294C_BF5749F7D17A60C8_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CSC4=C3C=CC=C4""",21,"""726A1F4C2DD19111"""
+"""580DC56F8A16BCFD_C051F542164D125F_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CC=C[N]4N=CC=C34""",21,"""726A1F4C2DD19111"""
+"""DECCD0717F53E679_79FBDCC3970BF9E8_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CN=C(C=C3)C(F)F""",21,"""726A1F4C2DD19111"""
+"""B6EFA6DBB051659C_12E000C8B56C0964_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CC4=C(C=C3)CCO4""",21,"""726A1F4C2DD19111"""
+"""CDADC975014D2EB2_44237A3C81165AE7_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CC=C(C=C3)[N](=O)=O""",21,"""726A1F4C2DD19111"""
+"""3F1B20CD18EA970B_BFED7E994E35EF7C_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""726A1F4C2DD19111"""
+"""C7752510C21DC611_1B591D193FECBD3E_6006_UN""","""C1(=NC=CC(=C1)C[N]2C=CC=N2)C3=CC=C(S3)C(F)(F)F""",21,"""726A1F4C2DD19111"""
+"""124547A49A6E9284_17C7FE66E97AD6F4_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""72730AADDC900660"""
+"""724C006373BE62B0_3AC659F0CE8CE3C8_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=C(C(C)C)C=C2""",21,"""72730AADDC900660"""
+"""1C57AE23CBFC0064_98459EC11E95C80D_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC3=C(C=C2)CCC3""",21,"""72730AADDC900660"""
+"""91E23528D42CC799_3897DE0D01FDB2AF_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=CC(=C2)C#CC""",21,"""72730AADDC900660"""
+"""39DC0857D51CD9A2_38935A7F10959930_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=CC(=C2)CSC""",21,"""72730AADDC900660"""
+"""B2FF254090E6499A_B87DEA51B282B535_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""72730AADDC900660"""
+"""D0B2EC7278C3D1B1_E026E87D141A471F_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CSC=C2C(F)(F)F""",21,"""72730AADDC900660"""
+"""2A52C3C63B9AA783_C92D0D17A495429E_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC(=CC=C2)C(=O)O""",21,"""72730AADDC900660"""
+"""092FD99BEDAF7C96_2B21F81691A40D1D_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""72730AADDC900660"""
+"""021A73F79D0DEA53_E8C14D4630FD7C0A_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=C(C=C(C)C=C2F)F""",21,"""72730AADDC900660"""
+"""C0AE388F31D65D86_5C7A334E87A65D51_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=CC3=NON=C23""",21,"""72730AADDC900660"""
+"""690324560E797D3F_1B006D16EAAC0E29_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=C(C(=C(C)C=C2)F)F""",21,"""72730AADDC900660"""
+"""2426A201E05295A9_5ACB26D7E03123AD_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C3=C[N]2C=NN=C2C=C3""",21,"""72730AADDC900660"""
+"""70A0A515078F18CA_B4FDC51F620FF001_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC(=C(C=C2)F)OC""",21,"""72730AADDC900660"""
+"""5743516AD45B8697_A22086AEA59A6F7D_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=C(C=C(C)C=C2C)C""",21,"""72730AADDC900660"""
+"""6F4B4236BE96014A_D7EBD9E1E24E09F1_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=C(OC)C=CC=C2F""",21,"""72730AADDC900660"""
+"""7BF7596757BEF912_07B879E2EC903EDD_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=C(C(N)=O)C=C2""",21,"""72730AADDC900660"""
+"""54A1154143231286_DDC750DE5687DB68_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC(=C(OC)C=C2)F""",21,"""72730AADDC900660"""
+"""F01E220D810C0A2E_856F531B06EA37B4_6006_DP""","""FC(F)(F)COC1=NC=C(C=C1)C3=C2[N](CCNC2)N=C3""",21,"""72730AADDC900660"""
+"""2A52C3C63B9AA783_893E3143FD4C62AF_6006_DP""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=CC(=C2)C(O)=O""",21,"""72730AADDC900660"""
+"""707BAAAC2F1BA44A_A0955B750F3E72D4_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=CC(=C2F)OC""",21,"""72730AADDC900660"""
+"""7AD8D8D6485F3016_170A2C0BC7CFB0BC_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=C(C=CC(=C2)OC)C""",21,"""72730AADDC900660"""
+"""06F023BACECBF257_065280ECA68BC1B1_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C3=C2OC=CC2=CC=C3""",21,"""72730AADDC900660"""
+"""8E5E42CF13DB5472_BFA38449A7F5F587_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=C(OC)C=C(C=C2)F""",21,"""72730AADDC900660"""
+"""623372A84ADF280A_BFFE9801F94E634E_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC(=C(OC)C=C2)C""",21,"""72730AADDC900660"""
+"""92B4D496C75C10B5_AFB9F7494E420CD1_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=C(C(C)O)C=C2""",21,"""72730AADDC900660"""
+"""A839CEC5CDD25601_A79D4BF671664BF0_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=COC(=C2)C(F)(F)F""",21,"""72730AADDC900660"""
+"""9C3C6011A2C2BAEE_B9680D73CEF41C03_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC(=CS2)C(F)(F)F""",21,"""72730AADDC900660"""
+"""3952403906F04DD9_3AF90FB74F152A18_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CN=C(N(C)C)N=C2""",21,"""72730AADDC900660"""
+"""82164BA97956C6CD_EF78E623790EF2DB_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C3=CC2=C(C=CC=N2)S3""",21,"""72730AADDC900660"""
+"""1537C3DBD3D047B7_580D669C717DF4A3_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=C(C(=CC=C2O)F)F""",21,"""72730AADDC900660"""
+"""0C7722DE9F86979D_BF4E5C16203BF7B9_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CSC3=C2C=CC=C3""",21,"""72730AADDC900660"""
+"""AAC3626C0F1318A2_C048E0A3E70C852E_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=C[N]3N=CC=C23""",21,"""72730AADDC900660"""
+"""1F7D8CE2F7BDDCBD_79E2C922664A6E99_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CN=C(C=C2)C(F)F""",21,"""72730AADDC900660"""
+"""9E6E937A32B29B35_12F91529442D9E15_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC3=C(C=C2)CCO3""",21,"""72730AADDC900660"""
+"""64A3147D3816E89E_443A6FDD7057CD96_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""72730AADDC900660"""
+"""12CBA43A79F74E43_BFF46B78BF74780D_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""72730AADDC900660"""
+"""9FB16328C260742A_1B4008F8CEAD2A4F_6006_UN""","""FC(F)(F)COC1=NC=C(C=C1)C2=CC=C(S2)C(F)(F)F""",21,"""72730AADDC900660"""
+"""7DC09700DBF223DB_172FF28F8263C9CD_6006_UN""","""NC1=NC(=NC(=N1)C2=CC(=C(C(=C2)F)F)F)C3CCCC3""",21,"""729B0644B7891959"""
+"""A3BBA8D988946AB8_3A2E5519A595FCF1_6006_UN""","""NC1=NC(=NC(=N1)C2=CC=C(C(C)C)C=C2)C3CCCC3""",21,"""729B0644B7891959"""
+"""1B0105B672FEE276_98AD9228758CD734_6006_UN""","""NC1=NC(=NC(=N1)C2=CC3=C(C=C2)CCC3)C4CCCC4""",21,"""729B0644B7891959"""
+"""E2E69BC4B5C6EA03_387FD2E46AE4AD96_6006_UN""","""NC1=NC(=NC(=N1)C2=CC=CC(=C2)C#CC)C3CCCC3""",21,"""729B0644B7891959"""
+"""41B54760C2EDF3D6_387B56967B8C8609_6006_UN""","""NC1=NC(=NC(=N1)C2=CC=CC(=C2)CSC)C3CCCC3""",21,"""729B0644B7891959"""
+"""E708844F3C75F1A6_B895E6B8D99BAA0C_6006_UN""","""NC1=NC(=NC(=N1)C2=CN=C(C=C2)[N](=O)=O)C3CCCC3""",21,"""729B0644B7891959"""
+"""A2D3AEF26B6FF7CD_E0CEE4947F035826_6006_UN""","""NC1=NC(=NC(=N1)C2=CSC=C2C(F)(F)F)C3CCCC3""",21,"""729B0644B7891959"""
+"""45BDF40EC3BF8242_C9C501FECF8C5DA7_6006_UN""","""NC1=NC(=NC(=N1)C2=CC(=CC=C2)C(=O)O)C3CCCC3""",21,"""729B0644B7891959"""
+"""7DF6B0002AF158E0_2BC9F4FFFABD1224_6006_UN""","""NC1=NC(=NC(=N1)C3=C2[NH]C=CC2=CC=C3)C4CCCC4""",21,"""729B0644B7891959"""
+"""85EA4DE71438FE70_E82941AF5BE46333_6006_UN""","""NC1=NC(=NC(=N1)C2=C(C=C(C)C=C2F)F)C3CCCC3""",21,"""729B0644B7891959"""
+"""B15861FFF3799667_5C923FA7ECBF4268_6006_UN""","""NC1=NC(=NC(=N1)C2=CC=CC3=NON=C23)C4CCCC4""",21,"""729B0644B7891959"""
+"""1F88B29CA4FB7C0B_1BE861FF81B51110_6006_UN""","""NC1=NC(=NC(=N1)C2=C(C(=C(C)C=C2)F)F)C3CCCC3""",21,"""729B0644B7891959"""
+"""832D406555EDBE49_5A232A3E8B283C94_6006_UN""","""NC1=NC(=NC(=N1)C3=C[N]2C=NN=C2C=C3)C4CCCC4""",21,"""729B0644B7891959"""
+"""52712493BA965CC2_B415C9F60916EF38_6006_UN""","""NC1=NC(=NC(=N1)C2=CC(=C(C=C2)F)OC)C3CCCC3""",21,"""729B0644B7891959"""
+"""4F241137BCF4A086_A2C88A47CE837044_6006_UN""","""NC1=NC(=NC(=N1)C2=C(C=C(C)C=C2C)C)C3CCCC3""",21,"""729B0644B7891959"""
+"""1A29B5AE8DA03551_D703D508895716C8_6006_UN""","""NC1=NC(=NC(=N1)C2=C(OC)C=CC=C2F)C3CCCC3""",21,"""729B0644B7891959"""
+"""FB6354469F784EED_0750750B878921E4_6006_UN""","""NC1=NC(=NC(=N1)C2=CC=C(C(N)=O)C=C2)C3CCCC3""",21,"""729B0644B7891959"""
+"""E24CB1B641AD02E6_DD2F5C373D9EC451_6006_UN""","""NC1=NC(=NC(=N1)C2=CC(=C(OC)C=C2)F)C3CCCC3""",21,"""729B0644B7891959"""
+"""87748F5AA0DAEC2C_85875FF26DF3288D_6006_DP""","""NC1=NC(=NC(=N1)C3=C2[N](CCNC2)N=C3)C4CCCC4""",21,"""729B0644B7891959"""
+"""45BDF40EC3BF8242_89D63DAA96557D96_6006_DP""","""NC1=NC(=NC(=N1)C2=CC=CC(=C2)C(O)=O)C3CCCC3""",21,"""729B0644B7891959"""
+"""9BB200E98AF0DD2D_A07D579C64276DED_6006_UN""","""NC1=NC(=NC(=N1)C2=CC=CC(=C2F)OC)C3CCCC3""",21,"""729B0644B7891959"""
+"""0F8FA0B7945415DB_17E220E2ACD6AF85_6006_UN""","""NC1=NC(=NC(=N1)C2=C(C=CC(=C2)OC)C)C3CCCC3""",21,"""729B0644B7891959"""
+"""47A6F229EEB482A8_06BA8C05CD92DE88_6006_UN""","""NC1=NC(=NC(=N1)C3=C2OC=CC2=CC=C3)C4CCCC4""",21,"""729B0644B7891959"""
+"""4EED31BD62388307_BF4B88A0CCECEABE_6006_UN""","""NC1=NC(=NC(=N1)C2=C(OC)C=C(C=C2)F)C3CCCC3""",21,"""729B0644B7891959"""
+"""8DC5F6399DFE395F_BF1694E892577C77_6006_UN""","""NC1=NC(=NC(=N1)C2=CC(=C(OC)C=C2)C)C3CCCC3""",21,"""729B0644B7891959"""
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+"""F3FCB4FB36764F3D_1BE67CFE92C70284_6006_UN""","""CCOC(=O)CC1=C(C=NC=C1)C2=CC=C(S2)C(F)(F)F""",21,"""72D57EAB80FA2EAB"""
+"""36AEA35A7DC27697_163105383691F1D0_6006_UN""","""C2(=C(C=C1CCOCC1=N2)C#N)C3=CC(=C(C(=C3)F)F)F""",21,"""7385F1F3037B2144"""
+"""B7600A88CC4E0891_3B30A2AE1167C4EC_6006_UN""","""C2(=C(C=C1CCOCC1=N2)C#N)C3=CC=C(C(C)C)C=C3""",21,"""7385F1F3037B2144"""
+"""4031D17016AA5138_99B3659FC17EEF29_6006_UN""","""C2(=C(C=C1CCOCC1=N2)C#N)C3=CC4=C(C=C3)CCC4""",21,"""7385F1F3037B2144"""
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+"""B74CD09F174853DB_EF36BF1FD0368103_6006_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)C2=C(C=C(C)C=C2F)F""",21,"""7584F8F43C5BFB69"""
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+"""D07903E27A32E0A7_D01C2BB80285F4F8_6006_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)C2=C(OC)C=CC=C2F""",21,"""7584F8F43C5BFB69"""
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+"""F6CA5982334201BE_3E5D34FBC04469A4_6006_UN""","""CN(C)[S](=O)(=O)C1=CN=C(C=C1)C2=CN=C(N(C)C)N=C2""",21,"""76D731E153C145DC"""
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+"""1F4436A382A2474E_C4ECDBEF685DC692_6006_UN""","""CN(C)[S](=O)(=O)C1=CN=C(C=C1)C2=CC=C[N]3N=CC=C23""",21,"""76D731E153C145DC"""
+"""924AD7CBB72FBD37_7D46F26EE91B2D25_6006_UN""","""CN(C)[S](=O)(=O)C1=CN=C(C=C1)C2=CN=C(C=C2)C(F)F""",21,"""76D731E153C145DC"""
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+"""B5C83C016FDA52E1_409E5491FF068E2A_6006_UN""","""CN(C)[S](=O)(=O)C1=CN=C(C=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""76D731E153C145DC"""
+"""8C6365F4C064162C_BB50503430253BB1_6006_UN""","""CN(C)[S](=O)(=O)C1=CN=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""76D731E153C145DC"""
+"""5ED67333E7C42088_1FE433B441FC69F3_6006_UN""","""CN(C)[S](=O)(=O)C1=CN=C(C=C1)C2=CC=C(S2)C(F)(F)F""",21,"""76D731E153C145DC"""
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+"""963369E355DCC576_EC4CF096B620266F_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=C(C=C(C)C=C2F)F)S3""",21,"""76FEB77D5A4D5C05"""
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+"""06F9E740CE2A4EF4_1F8DD0C66C71544C_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=C(C(=C(C)C=C2)F)F)S3""",21,"""76FEB77D5A4D5C05"""
+"""5C9770B1E2D0FFC0_5E469B0766EC79C8_6006_UN""","""OC(=O)C4=CC1=C(C(=NC=C1)C3=C[N]2C=NN=C2C=C3)S4""",21,"""76FEB77D5A4D5C05"""
+"""1E35EE14A59A36AB_B07078CFE4D2AA64_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=CC(=C(C=C2)F)OC)S3""",21,"""76FEB77D5A4D5C05"""
+"""A96B621386457600_A6AD3B7E23473518_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=C(C=C(C)C=C2C)C)S3""",21,"""76FEB77D5A4D5C05"""
+"""B330F2735C093A33_D366643164935394_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=C(OC)C=CC=C2F)S3""",21,"""76FEB77D5A4D5C05"""
+"""FD2AB94289A4D888_0335C4326A4D64B8_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=CC=C(C(N)=O)C=C2)S3""",21,"""76FEB77D5A4D5C05"""
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+"""DD907C84444139A6_81E2EECB80376DD1_6006_DP""","""OC(=O)C4=CC1=C(C(=NC=C1)C3=C2[N](CCNC2)N=C3)S4""",21,"""76FEB77D5A4D5C05"""
+"""2DE732268F84F051_8DB38C937B9138CA_6006_DP""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=CC=CC(=C2)C(O)=O)S3""",21,"""76FEB77D5A4D5C05"""
+"""C1F4B59F4E96B2A2_A418E6A589E328B1_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=CC=CC(=C2F)OC)S3""",21,"""76FEB77D5A4D5C05"""
+"""87B9D6323DEB3A5F_138791DB4112EAD9_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=C(C=CC(=C2)OC)C)S3""",21,"""76FEB77D5A4D5C05"""
+"""920625F3BBBE30DC_02DF3D3C20569BD4_6006_UN""","""OC(=O)C4=CC1=C(C(=NC=C1)C3=C2OC=CC2=CC=C3)S4""",21,"""76FEB77D5A4D5C05"""
+"""095BBF93B9FCCC04_BB2E39992128AFE2_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=C(OC)C=C(C=C2)F)S3""",21,"""76FEB77D5A4D5C05"""
+"""1BCC888399F37391_BB7325D17F93392B_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=CC(=C(OC)C=C2)C)S3""",21,"""76FEB77D5A4D5C05"""
+"""CBC50CAE4424D025_AB344A99C89F56B4_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=CC=C(C(C)O)C=C2)S3""",21,"""76FEB77D5A4D5C05"""
+"""E70B6DCF60FE390A_A310F626F7BB1195_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=COC(=C2)C(F)(F)F)S3""",21,"""76FEB77D5A4D5C05"""
+"""B7C458F1632A40EF_BDE5B0A348294666_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=CC(=CS2)C(F)(F)F)S3""",21,"""76FEB77D5A4D5C05"""
+"""10224715C015295D_3E74B267C9C8707D_6006_UN""","""OC(=O)C3=CC1=C(C(=NC=C1)C2=CN=C(N(C)C)N=C2)S3""",21,"""76FEB77D5A4D5C05"""
+"""A65263B17B8DCCD3_EBF55BF3FFD3A8BE_6006_UN""","""OC(=O)C4=CC1=C(C(=NC=C1)C3=CC2=C(C=CC=N2)S3)S4""",21,"""76FEB77D5A4D5C05"""
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+"""82107F5F54C806AB_9D4C44449C7D4795_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C2=CC3=C(C=C2)CCC3""",21,"""777AD0285E7889F8"""
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+"""B1A4D1DC3C2F57A1_035B5A6924634E29_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C3=C2OC=CC2=CC=C3""",21,"""777AD0285E7889F8"""
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+"""CE57CF8EA3784140_A2949173F38EC468_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C2=COC(=C2)C(F)(F)F""",21,"""777AD0285E7889F8"""
+"""9089557309796D38_BC61D7F64C1C939B_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C2=CC(=CS2)C(F)(F)F""",21,"""777AD0285E7889F8"""
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+"""B0833209750FA290_EA713CA6FBE67D43_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C3=CC2=C(C=CC=N2)S3""",21,"""777AD0285E7889F8"""
+"""52498A802F588807_5D04BC19F3957B3B_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C2=C(C(=CC=C2O)F)F""",21,"""777AD0285E7889F8"""
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+"""C9BCF278DB1C8F6E_C5413A2665E40AB6_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C2=CC=C[N]3N=CC=C23""",21,"""777AD0285E7889F8"""
+"""CEDF90A72452650E_7CEB13A7E4A2E101_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C2=CN=C(C=C2)C(F)F""",21,"""777AD0285E7889F8"""
+"""E6DB7B96B7CD88A7_17F0CFACC6C5118D_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C2=CC3=C(C=C2)CCO3""",21,"""777AD0285E7889F8"""
+"""23FBBDFBC2DC7185_4133B558F2BF420E_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C2=CC=C(C=C2)[N](=O)=O""",21,"""777AD0285E7889F8"""
+"""39E585E28CA1AE87_BAFDB1FD3D9CF795_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C2=CC3=C(C=C2)C=N[NH]3""",21,"""777AD0285E7889F8"""
+"""2896F2DC5E38871B_1E49D27D4C45A5D7_6006_UN""","""CC(C)C1=N[N](C)C(=C1C(=O)O)C2=CC=C(S2)C(F)(F)F""",21,"""777AD0285E7889F8"""
+"""F253235ADA854868_12C9F3E7C56E4F8C_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC(=C(C(=C3)F)F)F""",21,"""777D072CF0849F18"""
+"""C72BD44C1B9A4392_3FC85471E2987AB0_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=C(C(C)C)C=C3""",21,"""777D072CF0849F18"""
+"""CDC25DA7A8FE4545_9D4B934032815175_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC4=C(C=C3)CCC4""",21,"""777D072CF0849F18"""
+"""7F5E1F89F158EB41_3D99D38C2DE92BD7_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=CC(=C3)C#CC""",21,"""777D072CF0849F18"""
+"""94F7A1DD5B0C57A1_3D9D57FE3C810048_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=CC(=C3)CSC""",21,"""777D072CF0849F18"""
+"""6B9847B38BBC4A8C_BD73E7D09E962C4D_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CN=C(C=C3)[N](=O)=O""",21,"""777D072CF0849F18"""
+"""8A9114A461A9F8BC_E528E5FC380EDE67_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CSC=C3C(F)(F)F""",21,"""777D072CF0849F18"""
+"""599B8B4CEC2AC341_CC2300968881DBE6_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC(=CC=C3)C(=O)O""",21,"""777D072CF0849F18"""
+"""C9ACB290B1E9897D_2E2FF597BDB09465_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C4=C3[NH]C=CC3=CC=C4""",21,"""777D072CF0849F18"""
+"""5795B393021D26C9_EDCF40C71CE9E572_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=C(C=C(C)C=C3F)F""",21,"""777D072CF0849F18"""
+"""435D0B245928278C_59743ECFABB2C429_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=CC4=NON=C34""",21,"""777D072CF0849F18"""
+"""43628AFC2E838FBA_1E0E6097C6B89751_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=C(C(=C(C)C=C3)F)F""",21,"""777D072CF0849F18"""
+"""19D3B0F5FB03C0EC_5FC52B56CC25BAD5_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C4=C[N]3C=NN=C3C=C4""",21,"""777D072CF0849F18"""
+"""9ECCB4DB13002085_B1F3C89E4E1B6979_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC(=C(C=C3)F)OC""",21,"""777D072CF0849F18"""
+"""2F490E74985BE7E0_A72E8B2F898EF605_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=C(C=C(C)C=C3C)C""",21,"""777D072CF0849F18"""
+"""0F7B9B4FB3A331E2_D2E5D460CE5A9089_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=C(OC)C=CC=C3F""",21,"""777D072CF0849F18"""
+"""30E9F19C6284BC9B_02B67463C084A7A5_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=C(C(N)=O)C=C3""",21,"""777D072CF0849F18"""
+"""C884F011BDBB3862_D8C95D5F7A934210_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC(=C(OC)C=C3)F""",21,"""777D072CF0849F18"""
+"""3DEC3D0960C179D3_80615E9A2AFEAECC_6006_DP""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C4=C3[N](CCNC3)N=C4""",21,"""777D072CF0849F18"""
+"""599B8B4CEC2AC341_8C303CC2D158FBD7_6006_DP""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=CC(=C3)C(O)=O""",21,"""777D072CF0849F18"""
+"""533C94AA3A004E8A_A59B56F4232AEBAC_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=CC(=C3F)OC""",21,"""777D072CF0849F18"""
+"""AEBD6AB8E55F98E2_1204218AEBDB29C4_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=C(C=CC(=C3)OC)C""",21,"""777D072CF0849F18"""
+"""FB86C7CD4D0537D1_035C8D6D8A9F58C9_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C4=C3OC=CC3=CC=C4""",21,"""777D072CF0849F18"""
+"""53F8A894100E1225_BAAD89C88BE16CFF_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=C(OC)C=C(C=C3)F""",21,"""777D072CF0849F18"""
+"""CED5627BC8BD1191_BAF09580D55AFA36_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC(=C(OC)C=C3)C""",21,"""777D072CF0849F18"""
+"""1E7B919C3F5578F9_AAB7FAC8625695A9_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=C(C(C)O)C=C3""",21,"""777D072CF0849F18"""
+"""25765FD933FF9D68_A29346775D72D288_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=COC(=C3)C(F)(F)F""",21,"""777D072CF0849F18"""
+"""C1785FA9D27B67B0_BC6600F2E2E0857B_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC(=CS3)C(F)(F)F""",21,"""777D072CF0849F18"""
+"""E385608A0B67D8D7_3FF702366301B360_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CN=C(N(C)C)N=C3""",21,"""777D072CF0849F18"""
+"""0E9C5BF087AC1E27_EA76EBA2551A6BA3_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C4=CC3=C(C=CC=N3)S4""",21,"""777D072CF0849F18"""
+"""F86953873369C63F_5D036B1D5D696DDB_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=C(C(=CC=C3O)F)F""",21,"""777D072CF0849F18"""
+"""EA63EE46EFF162F9_BA4051970C2F6EC1_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CSC4=C3C=CC=C4""",21,"""777D072CF0849F18"""
+"""6BC8C3233001F551_C546ED22CB181C56_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=C[N]4N=CC=C34""",21,"""777D072CF0849F18"""
+"""1941B2D455F2F2A3_7CECC4A34A5EF7E1_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CN=C(C=C3)C(F)F""",21,"""777D072CF0849F18"""
+"""38C260CFC4F946B7_17F718A86839076D_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC4=C(C=C3)CCO4""",21,"""777D072CF0849F18"""
+"""D301D63FB54E49A6_4134625C5C4354EE_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)[N](=O)=O""",21,"""777D072CF0849F18"""
+"""6E6160E2C798C55B_BAFA66F99360E175_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""777D072CF0849F18"""
+"""129350E60DBEDAFE_1E4E0579E2B9B337_6006_UN""","""C1(=NN=CC(=C1)C2=CC=CC=C2)C3=CC=C(S3)C(F)(F)F""",21,"""777D072CF0849F18"""
+"""3BFDC4A964AB6B15_1D3F38881630198C_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC(=C(C(=C2)F)F)F""",21,"""788BCC4323DAC918"""
+"""992B507B620B00FF_303E9F1E31C62CB0_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC=C(C(C)C)C=C2""",21,"""788BCC4323DAC918"""
+"""7E9DC3899F6408E1_92BD582FE1DF0775_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC3=C(C=C2)CCC3""",21,"""788BCC4323DAC918"""
+"""31A4F726F3D1D242_326F18E3FEB77DD7_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC=CC(=C2)C#CC""",21,"""788BCC4323DAC918"""
+"""B613D779985E9C04_326B9C91EFDF5648_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC=CC(=C2)CSC""",21,"""788BCC4323DAC918"""
+"""A554DEAA7BB1E16A_B2852CBF4DC87A4D_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CN=C(C=C2)[N](=O)=O""",21,"""788BCC4323DAC918"""
+"""F8EB2C152359E6C4_EADE2E93EB508867_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CSC=C2C(F)(F)F""",21,"""788BCC4323DAC918"""
+"""3EF68F0CB3124096_C3D5CBF95BDF8DE6_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC(=CC=C2)C(=O)O""",21,"""788BCC4323DAC918"""
+"""968B14333C55D0AD_21D93EF86EEEC265_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C3=C2[NH]C=CC2=CC=C3""",21,"""788BCC4323DAC918"""
+"""85F0830E7D839E11_E2398BA8CFB7B372_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=C(C=C(C)C=C2F)F""",21,"""788BCC4323DAC918"""
+"""1BA1FD5D432213E7_5682F5A078EC9229_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC=CC3=NON=C23""",21,"""788BCC4323DAC918"""
+"""365D6B254A19F135_11F8ABF815E6C151_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=C(C(=C(C)C=C2)F)F""",21,"""788BCC4323DAC918"""
+"""D68FE130D6E42264_5033E0391F7BECD5_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C3=C[N]2C=NN=C2C=C3""",21,"""788BCC4323DAC918"""
+"""594EEE04EECD12D7_BE0503F19D453F79_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC(=C(C=C2)F)OC""",21,"""788BCC4323DAC918"""
+"""E9DB8BA0A8C52C3C_A8D840405AD0A005_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=C(C=C(C)C=C2C)C""",21,"""788BCC4323DAC918"""
+"""7F5719064CBC1562_DD131F0F1D04C689_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=C(OC)C=CC=C2F""",21,"""788BCC4323DAC918"""
+"""1413F523BFEE9D4E_0D40BF0C13DAF1A5_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC=C(C(N)=O)C=C2""",21,"""788BCC4323DAC918"""
+"""B52C94FA2581C9E8_D73F9630A9CD1410_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC(=C(OC)C=C2)F""",21,"""788BCC4323DAC918"""
+"""A0EB8756AB7A2C18_8F9795F5F9A0F8CC_6006_DP""","""CC(C)N(C)C1=NC(=NC(=C1)C)C3=C2[N](CCNC2)N=C3""",21,"""788BCC4323DAC918"""
+"""3EF68F0CB3124096_83C6F7AD0206ADD7_6006_DP""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC=CC(=C2)C(O)=O""",21,"""788BCC4323DAC918"""
+"""E8AF482476DA600F_AA6D9D9BF074BDAC_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC=CC(=C2F)OC""",21,"""788BCC4323DAC918"""
+"""F0BC0C0191ED67E8_1DF2EAE538857FC4_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=C(C=CC(=C2)OC)C""",21,"""788BCC4323DAC918"""
+"""DE0A46C3A5812F38_0CAA460259C10EC9_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C3=C2OC=CC2=CC=C3""",21,"""788BCC4323DAC918"""
+"""E0B7E915071E3185_B55B42A758BF3AFF_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=C(OC)C=C(C=C2)F""",21,"""788BCC4323DAC918"""
+"""C34046909B01D4B4_B5065EEF0604AC36_6006_UN""","""CC(C)N(C)C1=NC(=NC(=C1)C)C2=CC(=C(OC)C=C2)C""",21,"""788BCC4323DAC918"""
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+"""F0DEF4ABF43EF8E5_AD2012423ED419C7_6006_UN""","""CC2=C1C=CC(=CC1=NC(=C2)C3=COC(=C3)C(F)(F)F)O""",21,"""78CE531993225457"""
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+"""3F63600E54C19E12_4E8736693FE59FA1_6006_UN""","""CC2=C1C=CC(=CC1=NC(=C2)C3=CC=C(C=C3)[N](=O)=O)O""",21,"""78CE531993225457"""
+"""790D0381BA4A3CBE_B54932CCF0C62A3A_6006_UN""","""CC2=C1C=CC(=CC1=NC(=C2)C3=CC4=C(C=C3)C=N[NH]4)O""",21,"""78CE531993225457"""
+"""BE6F46FFA38F4F6C_11FD514C811F7878_6006_UN""","""CC2=C1C=CC(=CC1=NC(=C2)C3=CC=C(S3)C(F)(F)F)O""",21,"""78CE531993225457"""
+"""98D9F6AB46B38068_1D5C51F6BF9F7DD3_6006_UN""","""OC(=O)C3=NC1=C(N=CN=C1C2=CC(=C(C(=C2)F)F)F)[NH]3""",21,"""78E8A53D8A75AD47"""
+"""05D6F26A900E204B_305DF660986948EF_6006_UN""","""OC(=O)C3=NC1=C(N=CN=C1C2=CC=C(C(C)C)C=C2)[NH]3""",21,"""78E8A53D8A75AD47"""
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+"""CF401374B28972A1_1C3353018C1E83CE_6006_UN""","""COC1=C(C=C(C(=C1)C)[N](=O)=O)C2=CC(=C(C(=C2)F)F)F""",21,"""7987A7CAB9F4535A"""
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+"""EF25D38483DF4345_578E9E29E2C2086B_6006_UN""","""COC1=C(C=C(C(=C1)C)[N](=O)=O)C2=CC=CC3=NON=C23""",21,"""7987A7CAB9F4535A"""
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+"""AB320C9E0E8AA1CD_513F8BB085557697_6006_UN""","""COC1=C(C=C(C(=C1)C)[N](=O)=O)C3=C[N]2C=NN=C2C=C3""",21,"""7987A7CAB9F4535A"""
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+"""A0156EC2E32A4AA3_DC1F7486872A5CCB_6006_UN""","""COC1=C(C=C(C(=C1)C)[N](=O)=O)C2=C(OC)C=CC=C2F""",21,"""7987A7CAB9F4535A"""
+"""296AB0D450ED6D89_0C4CD48589F46BE7_6006_UN""","""COC1=C(C=C(C(=C1)C)[N](=O)=O)C2=CC=C(C(N)=O)C=C2""",21,"""7987A7CAB9F4535A"""
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+"""27854814A2EC147F_B41114535598E9D8_6006_UN""","""OC(=O)C1=C(C(=NC=C1)C2=CC(=C(OC)C=C2)C)[N](=O)=O""",21,"""799C86FF70468CF6"""
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+"""5A211F0793225B51_AC72C7A4DDB0C166_6006_UN""","""OC(=O)C1=C(C(=NC=C1)C2=COC(=C2)C(F)(F)F)[N](=O)=O""",21,"""799C86FF70468CF6"""
+"""F7DED36BA168AFD7_B287812162229695_6006_UN""","""OC(=O)C1=C(C(=NC=C1)C2=CC(=CS2)C(F)(F)F)[N](=O)=O""",21,"""799C86FF70468CF6"""
+"""E7EEB19D9D4FB9FB_311683E5E3C3A08E_6006_UN""","""OC(=O)C1=C(C(=NC=C1)C2=CN=C(N(C)C)N=C2)[N](=O)=O""",21,"""799C86FF70468CF6"""
+"""54A9B73E93DACD79_E4976A71D5D8784D_6006_UN""","""OC(=O)C1=C(C(=NC=C1)C3=CC2=C(C=CC=N2)S3)[N](=O)=O""",21,"""799C86FF70468CF6"""
+"""504A2F8E57AD8739_53E2EACEDDAB7E35_6006_UN""","""OC(=O)C1=C(C(=NC=C1)C2=C(C(=CC=C2O)F)F)[N](=O)=O""",21,"""799C86FF70468CF6"""
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+"""81948C3F80CDC8E1_A629DA92B1EECFBF_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=CC=C(C(C)O)C=C3""",21,"""7BE32776233CC50E"""
+"""AD9AD6C496E22D84_AE0D662D8ECA889E_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=COC(=C3)C(F)(F)F""",21,"""7BE32776233CC50E"""
+"""B6F218BDDCC2C561_B0F820A83158DF6D_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=CC(=CS3)C(F)(F)F""",21,"""7BE32776233CC50E"""
+"""3BBAC13F5D8F5D0A_3369226CB0B9E976_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=CN=C(N(C)C)N=C3""",21,"""7BE32776233CC50E"""
+"""7180E5D0003E5434_E6E8CBF886A231B5_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C4=CC3=C(C=CC=N3)S4""",21,"""7BE32776233CC50E"""
+"""1D4AEE61A58C0E3A_519D4B478ED137CD_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=C(C(=CC=C3O)F)F""",21,"""7BE32776233CC50E"""
+"""CF0740A9B234A666_B6DE71CDDF9734D7_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=CSC4=C3C=CC=C4""",21,"""7BE32776233CC50E"""
+"""C8C9813B8E3A70EC_C9D8CD7818A04640_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=CC=C[N]4N=CC=C34""",21,"""7BE32776233CC50E"""
+"""00142452239FC2A2_7072E4F999E6ADF7_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=CN=C(C=C3)C(F)F""",21,"""7BE32776233CC50E"""
+"""8C8E8D12D4ABAAD7_1B6938F2BB815D7B_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=CC4=C(C=C3)CCO4""",21,"""7BE32776233CC50E"""
+"""74BEF9F7005D60AE_4DAA42068FFB0EF8_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=CC=C(C=C3)[N](=O)=O""",21,"""7BE32776233CC50E"""
+"""AB38293F61D4ABD8_B66446A340D8BB63_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""7BE32776233CC50E"""
+"""FA87A97011A1B07F_12D025233101E921_6006_DP""","""N1CCC(C1)NC2=NC(=NC=C2)C3=CC=C(S3)C(F)(F)F""",21,"""7BE32776233CC50E"""
+"""FEBBE0D08D30432E_19AC48D7CC0988F2_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC(=C(C(=C3)F)F)F)O""",21,"""7C18BC1CF9E35866"""
+"""A14C1222DEEE8541_34ADEF41EBFFBDCE_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=C(C(C)C)C=C3)O""",21,"""7C18BC1CF9E35866"""
+"""E13DD599FD33959A_962E28703BE6960B_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC4=C(C=C3)CCC4)O""",21,"""7C18BC1CF9E35866"""
+"""1A3D0EA933F39A61_36FC68BC248EECA9_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=CC(=C3)C#CC)O""",21,"""7C18BC1CF9E35866"""
+"""CB59F42596B6E1A3_36F8ECCE35E6C736_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=CC(=C3)CSC)O""",21,"""7C18BC1CF9E35866"""
+"""2856502ED39ADA8D_B6165CE097F1EB33_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CN=C(C=C3)[N](=O)=O)O""",21,"""7C18BC1CF9E35866"""
+"""E0D1E6025328EA04_EE4D5ECC31691919_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CSC=C3C(F)(F)F)O""",21,"""7C18BC1CF9E35866"""
+"""AF76900CB0871844_C746BBA681E61C98_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC(=CC=C3)C(=O)O)O""",21,"""7C18BC1CF9E35866"""
+"""DE88BEB957F2F157_254A4EA7B4D7531B_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C4=C3[NH]C=CC3=CC=C4)O""",21,"""7C18BC1CF9E35866"""
+"""29723B104053B995_E6AAFBF7158E220C_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=C(C=C(C)C=C3F)F)O""",21,"""7C18BC1CF9E35866"""
+"""A9C2193187CA762C_521185FFA2D50357_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=CC4=NON=C34)O""",21,"""7C18BC1CF9E35866"""
+"""34631AC72B7AEA13_156BDBA7CFDF502F_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=C(C(=C(C)C=C3)F)F)O""",21,"""7C18BC1CF9E35866"""
+"""15EADB63142A86C2_54A09066C5427DAB_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C4=C[N]3C=NN=C3C=C4)O""",21,"""7C18BC1CF9E35866"""
+"""47BB839ED5BE216B_BA9673AE477CAE07_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC(=C(C=C3)F)OC)O""",21,"""7C18BC1CF9E35866"""
+"""EC2439E25FF0E5A4_AC4B301F80E9317B_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=C(C=C(C)C=C3C)C)O""",21,"""7C18BC1CF9E35866"""
+"""51742CB5F78D566B_D9806F50C73D57F7_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=C(OC)C=CC=C3F)O""",21,"""7C18BC1CF9E35866"""
+"""B498AF7FD594A2DE_09D3CF53C9E360DB_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=C(C(N)=O)C=C3)O""",21,"""7C18BC1CF9E35866"""
+"""0FCCEC7B93EF094B_D3ACE66F73F4856E_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC(=C(OC)C=C3)F)O""",21,"""7C18BC1CF9E35866"""
+"""C73ECE41D86BA97C_8B04E5AA239969B2_6006_DP""","""CC1=N[N](C)C2=C1C(=CC(=N2)C4=C3[N](CCNC3)N=C4)O""",21,"""7C18BC1CF9E35866"""
+"""AF76900CB0871844_875587F2D83F3CA9_6006_DP""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=CC(=C3)C(O)=O)O""",21,"""7C18BC1CF9E35866"""
+"""7A8CFA9A92D3FF35_AEFEEDC42A4D2CD2_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=CC(=C3F)OC)O""",21,"""7C18BC1CF9E35866"""
+"""14D4AFF371F5316A_19619ABAE2BCEEBA_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=C(C=CC(=C3)OC)C)O""",21,"""7C18BC1CF9E35866"""
+"""27B789F00BD82144_0839365D83F89FB7_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C4=C3OC=CC3=CC=C4)O""",21,"""7C18BC1CF9E35866"""
+"""4ED6727EF9BBFB57_B1C832F88286AB81_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=C(OC)C=C(C=C3)F)O""",21,"""7C18BC1CF9E35866"""
+"""AB7C9E1FAD88AA51_B1952EB0DC3D3D48_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC(=C(OC)C=C3)C)O""",21,"""7C18BC1CF9E35866"""
+"""CC77C6580937C798_A1D241F86B3152D7_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=C(C(C)O)C=C3)O""",21,"""7C18BC1CF9E35866"""
+"""7A99084AEFD4BBC7_A9F6FD47541515F6_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=COC(=C3)C(F)(F)F)O""",21,"""7C18BC1CF9E35866"""
+"""8F46C52CB92C4187_B703BBC2EB874205_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC(=CS3)C(F)(F)F)O""",21,"""7C18BC1CF9E35866"""
+"""1E69F1557F7C6F19_3492B9066A66741E_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CN=C(N(C)C)N=C3)O""",21,"""7C18BC1CF9E35866"""
+"""117CEA6EBB61DD7E_E11350925C7DACDD_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C4=CC3=C(C=CC=N3)S4)O""",21,"""7C18BC1CF9E35866"""
+"""3B11236082DA6213_5666D02D540EAAA5_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=C(C(=CC=C3O)F)F)O""",21,"""7C18BC1CF9E35866"""
+"""4E05676CCDBD3F4E_B125EAA70548A9BF_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CSC4=C3C=CC=C4)O""",21,"""7C18BC1CF9E35866"""
+"""A31D9C35FFD1373A_CE235612C27FDB28_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=C[N]4N=CC=C34)O""",21,"""7C18BC1CF9E35866"""
+"""DA25296A1FB9E517_77897F934339309F_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CN=C(C=C3)C(F)F)O""",21,"""7C18BC1CF9E35866"""
+"""3C076F6A2714EBD7_1C92A398615EC013_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC4=C(C=C3)CCO4)O""",21,"""7C18BC1CF9E35866"""
+"""80176F41B3CAB569_4A51D96C55249390_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=C(C=C3)[N](=O)=O)O""",21,"""7C18BC1CF9E35866"""
+"""F0E8B9F44A011D8A_B19FDDC99A07260B_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC4=C(C=C3)C=N[NH]4)O""",21,"""7C18BC1CF9E35866"""
+"""6949175892131F1F_152BBE49EBDE7449_6006_UN""","""CC1=N[N](C)C2=C1C(=CC(=N2)C3=CC=C(S3)C(F)(F)F)O""",21,"""7C18BC1CF9E35866"""
+"""4899BA623F002F9E_02A69BE3111E1F18_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)CCCN""",21,"""7C39A7AFDC4DB839"""
+"""1E61657922834204_A853AF4511E250B6_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](CC)(=O)=O)CCBr""",21,"""7C39A7AFDC4DB839"""
+"""ABDD49F40F5545A3_A6DF596A04A9CE57_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N(CCNC)[S](=O)(=O)C""",21,"""7C39A7AFDC4DB839"""
+"""252B5745583EBED4_5AA5652E0FD8035D_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](CCCC)(=O)=O)C""",21,"""7C39A7AFDC4DB839"""
+"""C10E9EC180FBF5C8_6EB68773DD787802_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""7C39A7AFDC4DB839"""
+"""685D4C79BB1CE673_7E5096C16C4A21CF_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)CCC#C""",21,"""7C39A7AFDC4DB839"""
+"""EE71C69705311511_7712987482750C6B_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)CCCCl""",21,"""7C39A7AFDC4DB839"""
+"""CBB638AE6CE5682E_36EED270846595A0_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](CC)(=O)=O)CC#C""",21,"""7C39A7AFDC4DB839"""
+"""3600EDD3C311E4ED_6F3D3E26E7A66CC0_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2[S](CCCC2=O)(=O)=O""",21,"""7C39A7AFDC4DB839"""
+"""D6C3D36E3BFB164E_BDC3A2BE185F5296_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2C(C(N)C[S]2(=O)=O)=O""",21,"""7C39A7AFDC4DB839"""
+"""91C16916BE613F88_980AC53D46B0CF42_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)C2CNC2""",21,"""7C39A7AFDC4DB839"""
+"""1B5B073AD09C329F_42DD2ACE2456606D_6036_DP""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N[S](=O)(=O)C2(CC2)C#N""",21,"""7C39A7AFDC4DB839"""
+"""A62D6626D2FDD980_55D173E2FBC7F665_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)CCCN""",21,"""7C39A7AFDC4DB839"""
+"""4B3D89DDD76458B9_FCC850064683025A_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)C2COC2""",21,"""7C39A7AFDC4DB839"""
+"""9EB236ECF9BB400B_9CED81E49A2EB2C5_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)CCOC""",21,"""7C39A7AFDC4DB839"""
+"""389FE1F44C4971FE_32331C064E1E60D0_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)CC(=O)C""",21,"""7C39A7AFDC4DB839"""
+"""9527EA8DB68C36E8_BA1B7AB28890539D_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2CCCC(C)[S]2(=O)=O""",21,"""7C39A7AFDC4DB839"""
+"""613DCEA2CCA07C92_B7F45C5531A96838_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2CCC(C)(C)[S]2(=O)=O""",21,"""7C39A7AFDC4DB839"""
+"""2166F3F34950C7AE_8C5CFD94309E9A67_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](CC)(=O)=O)CCN""",21,"""7C39A7AFDC4DB839"""
+"""C698508CF6631CBE_CDF1612E0ED89CD3_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N(CC)[S](=O)(=O)CCN""",21,"""7C39A7AFDC4DB839"""
+"""01338DE4650811F7_7762CADB0FCE699E_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)C(C)(C)C""",21,"""7C39A7AFDC4DB839"""
+"""B5D507A972A5F188_FF5AF9B1CD637CA2_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2[S](=O)(=O)C3(CC2)CC3""",21,"""7C39A7AFDC4DB839"""
+"""27EFC82A3E1EBA52_907C6F8C58E534FC_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](CCNC)(=O)=O)C""",21,"""7C39A7AFDC4DB839"""
+"""27EFC82A3E1EBA52_4C8C951AA17A3FDA_6036_DP""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)CCNC""",21,"""7C39A7AFDC4DB839"""
+"""197CB209E6441488_5D3111F6DA40F801_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2[S](CCC2CI)(=O)=O""",21,"""7C39A7AFDC4DB839"""
+"""5E610133740AA68D_C137BA3EA04EF6CC_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2C(CN)CC[S]2(=O)=O""",21,"""7C39A7AFDC4DB839"""
+"""9F2C60B1DF128CD7_526065C4D8845BB4_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N(CC(C)C)[S](=O)(=O)C""",21,"""7C39A7AFDC4DB839"""
+"""C29568D879BDDD9A_CE69F06EA18E3663_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2[S](=O)(CCNCC2)=O""",21,"""7C39A7AFDC4DB839"""
+"""D9881A19945D33BE_7C8EEB308A1FF6C8_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](C=C)(=O)=O)C2CC2""",21,"""7C39A7AFDC4DB839"""
+"""63246D09B9B5263A_DC896B335C1AFF37_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2CC3(C[S]2(=O)=O)CC3""",21,"""7C39A7AFDC4DB839"""
+"""4B6AB43A4DE8065E_10C218025445EE75_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)C(=O)CN""",21,"""7C39A7AFDC4DB839"""
+"""9679133C23CC5D71_F24156348430D1BB_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N2CCCCC[S]2(=O)=O""",21,"""7C39A7AFDC4DB839"""
+"""0458A428B0EDED4F_E0EACAD286781FE7_6036_UN""","""CC(C)C(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)CCCBr""",21,"""7C39A7AFDC4DB839"""
+"""D6C449FE0FF99169_B0E9CB8F3F1C1B35_6003_UN""","""CC(C)C(OC1=CC=C(C=C1)C#N)C2=CC(=CC(=C2)Cl)Cl""",21,"""7C39A7AFDC4DB839"""
+"""9CD3FD6282EA6C39_8FC931877E84A614_6003_UN""","""CC(C)C(OC1=CC=CC=C1[N+]#[C-])C2=CC(=CC(=C2)Cl)Cl""",21,"""7C39A7AFDC4DB839"""
+"""578706C5564C7906_889EC4F51FC99BB6_6003_UN""","""CC(C)C(OC1=CC=CC=C1C#N)C2=CC(=CC(=C2)Cl)Cl""",21,"""7C39A7AFDC4DB839"""
+"""07B4608269B62A6A_601E66918137B2CA_6003_UN""","""CC(C)C(OC1=CC=C(C=C1)[N+]#[C-])C2=CC(=CC(=C2)Cl)Cl""",21,"""7C39A7AFDC4DB839"""
+"""D77DA6A3982B79BB_EE25E3733E1A65B4_6003_UN""","""CC(C)C(OC1=CC=CC(=C1)[N+]#[C-])C2=CC(=CC(=C2)Cl)Cl""",21,"""7C39A7AFDC4DB839"""
+"""2C2F69C86A9131D5_192E3423AA676659_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC(=C(C(=C3)F)F)F""",21,"""7C9AC0E89F8DB6CD"""
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+"""A253F61AEA49F371_96AC54845D8878A0_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC4=C(C=C3)CCC4""",21,"""7C9AC0E89F8DB6CD"""
+"""5CC9C9671BE28BEE_367E144842E00202_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC=CC(=C3)C#CC""",21,"""7C9AC0E89F8DB6CD"""
+"""3E4863BC6696DC44_367A903A5388299D_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC=CC(=C3)CSC""",21,"""7C9AC0E89F8DB6CD"""
+"""79AEAD7657021854_B6942014F19F0598_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CN=C(C=C3)[N](=O)=O""",21,"""7C9AC0E89F8DB6CD"""
+"""5470FC0EBF603932_EECF22385707F7B2_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CSC=C3C(F)(F)F""",21,"""7C9AC0E89F8DB6CD"""
+"""3ED166995A1EA86B_C7C4C752E788F233_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC(=CC=C3)C(=O)O""",21,"""7C9AC0E89F8DB6CD"""
+"""0F3B996FE3918E78_25C83253D2B9BDB0_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C4=C3[NH]C=CC3=CC=C4""",21,"""7C9AC0E89F8DB6CD"""
+"""5222579345E540E4_E628870373E0CCA7_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=C(C=C(C)C=C3F)F""",21,"""7C9AC0E89F8DB6CD"""
+"""2BFCE5887DBDABC7_5293F90BC4BBEDFC_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC=CC4=NON=C34""",21,"""7C9AC0E89F8DB6CD"""
+"""CE606726C9E5B6EE_15E9A753A9B1BE84_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=C(C(=C(C)C=C3)F)F""",21,"""7C9AC0E89F8DB6CD"""
+"""419AE4822ED59FD9_5422EC92A32C9300_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C4=C[N]3C=NN=C3C=C4""",21,"""7C9AC0E89F8DB6CD"""
+"""B089C7387BF7D67C_BA140F5A211240AC_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC(=C(C=C3)F)OC""",21,"""7C9AC0E89F8DB6CD"""
+"""B5B5D63E7F62FF6B_ACC94CEBE687DFD0_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=C(C=C(C)C=C3C)C""",21,"""7C9AC0E89F8DB6CD"""
+"""2068A23D2A4FCF9E_D90213A4A153B95C_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=C(OC)C=CC=C3F""",21,"""7C9AC0E89F8DB6CD"""
+"""94E7DB09992DB342_0951B3A7AF8D8E70_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC=C(C(N)=O)C=C3""",21,"""7C9AC0E89F8DB6CD"""
+"""9FC944B5587FF7A4_D32E9A9B159A6BC5_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC(=C(OC)C=C3)F""",21,"""7C9AC0E89F8DB6CD"""
+"""5D173E922D3752D9_8B86995E45F78719_6006_DP""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C4=C3[N](CCNC3)N=C4""",21,"""7C9AC0E89F8DB6CD"""
+"""3ED166995A1EA86B_87D7FB06BE51D202_6006_DP""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC=CC(=C3)C(O)=O""",21,"""7C9AC0E89F8DB6CD"""
+"""A7DB632B4C21E6EA_AE7C91304C23C279_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC=CC(=C3F)OC""",21,"""7C9AC0E89F8DB6CD"""
+"""31939DCB73EAA616_19E3E64E84D20011_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=C(C=CC(=C3)OC)C""",21,"""7C9AC0E89F8DB6CD"""
+"""025956588F3A9289_08BB4AA9E596711C_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C4=C3OC=CC3=CC=C4""",21,"""7C9AC0E89F8DB6CD"""
+"""6CC21E0D7633CAA9_B14A4E0CE4E8452A_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=C(OC)C=C(C=C3)F""",21,"""7C9AC0E89F8DB6CD"""
+"""A6350F9E119B2AA6_B1175244BA53D3E3_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC(=C(OC)C=C3)C""",21,"""7C9AC0E89F8DB6CD"""
+"""6F7282E08B5F66BA_A1503D0C0D5FBC7C_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC=C(C(C)O)C=C3""",21,"""7C9AC0E89F8DB6CD"""
+"""5542AB562DE62A68_A97481B3327BFB5D_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=COC(=C3)C(F)(F)F""",21,"""7C9AC0E89F8DB6CD"""
+"""5C8FFD837D4B8B39_B781C7368DE9ACAE_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC(=CS3)C(F)(F)F""",21,"""7C9AC0E89F8DB6CD"""
+"""F48DD52627AB200D_3410C5F20C089AB5_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CN=C(N(C)C)N=C3""",21,"""7C9AC0E89F8DB6CD"""
+"""B29CBFE5EA85302E_E1912C663A134276_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C4=CC3=C(C=CC=N3)S4""",21,"""7C9AC0E89F8DB6CD"""
+"""1ABB60EC3E6B9971_56E4ACD93260440E_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=C(C(=CC=C3O)F)F""",21,"""7C9AC0E89F8DB6CD"""
+"""D6F3331CDAC9F871_B1A7965363264714_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CSC4=C3C=CC=C4""",21,"""7C9AC0E89F8DB6CD"""
+"""BBC830C1975F58C9_CEA12AE6A4113583_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC=C[N]4N=CC=C34""",21,"""7C9AC0E89F8DB6CD"""
+"""64CD06A113BAF319_770B03672557DE34_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CN=C(C=C3)C(F)F""",21,"""7C9AC0E89F8DB6CD"""
+"""589C062C63E2C901_1C10DF6C07302EB8_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC4=C(C=C3)CCO4""",21,"""7C9AC0E89F8DB6CD"""
+"""6B03D4ECC2D49AF5_4AD3A598334A7D3B_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC=C(C=C3)[N](=O)=O""",21,"""7C9AC0E89F8DB6CD"""
+"""F96ECD19DB6A488A_B11DA13DFC69C8A0_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""7C9AC0E89F8DB6CD"""
+"""5E0262731419EA53_15A9C2BD8DB09AE2_6006_UN""","""NC(=O)C1=C[NH]C2=C1C(=NC=N2)C3=CC=C(S3)C(F)(F)F""",21,"""7C9AC0E89F8DB6CD"""
+"""6870E330B66716E2_19168F5608628569_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=CC(=C(C(=C2)F)F)F)O""",21,"""7CA27B9D3D8855FD"""
+"""F750D2E9E2E37E1F_341728C02F94B055_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=CC=C(C(C)C)C=C2)O""",21,"""7CA27B9D3D8855FD"""
+"""721966DD6EDAC857_9694EFF1FF8D9B90_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=CC3=C(C=C2)CCC3)O""",21,"""7CA27B9D3D8855FD"""
+"""B6A10A7C375878D4_3646AF3DE0E5E132_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=CC=CC(=C2)C#CC)O""",21,"""7CA27B9D3D8855FD"""
+"""B27976FA8E68E23B_36422B4FF18DCAAD_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=CC=CC(=C2)CSC)O""",21,"""7CA27B9D3D8855FD"""
+"""BB948AD785F1D9CB_B6AC9B61539AE6A8_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=CN=C(C=C2)[N](=O)=O)O""",21,"""7CA27B9D3D8855FD"""
+"""5B0B0346A68F9763_EEF7994DF5021482_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=CSC=C2C(F)(F)F)O""",21,"""7CA27B9D3D8855FD"""
+"""382C9FBC394095DC_C7FC7C27458D1103_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=CC(=CC=C2)C(=O)O)O""",21,"""7CA27B9D3D8855FD"""
+"""0CF47560847B9758_25F0892670BC5E80_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C3=C2[NH]C=CC2=CC=C3)O""",21,"""7CA27B9D3D8855FD"""
+"""83A5C8326CCAA2A7_E6103C76D1E52F97_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=C(C=C(C)C=C2F)F)O""",21,"""7CA27B9D3D8855FD"""
+"""CA9F307DBDF9BE30_52AB427E66BE0ECC_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=CC=CC3=NON=C23)O""",21,"""7CA27B9D3D8855FD"""
+"""7E553FB32D467FEA_15D11C260BB45DB4_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=C(C(=C(C)C=C2)F)F)O""",21,"""7CA27B9D3D8855FD"""
+"""2A887BF1CA621053_541A57E701297030_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C3=C[N]2C=NN=C2C=C3)O""",21,"""7CA27B9D3D8855FD"""
+"""FCCE853DE21B96CC_BA2CB42F8317A39C_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=CC(=C(C=C2)F)OC)O""",21,"""7CA27B9D3D8855FD"""
+"""3BE1B32D1B224A73_ACF1F79E44823CE0_6006_UN""","""CC(C)C(=O)C1=C(C=CC(=C1)C2=C(C=C(C)C=C2C)C)O""",21,"""7CA27B9D3D8855FD"""
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+"""471C13437B7D9274_B130D383D81EE5AC_6006_UN""","""FC(F)(F)C(=O)C1=C(C=CC=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""7CB7B256BBFA9BC1"""
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+"""63777ADBB1C6DAF1_37E00DA2B787A3C9_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CC=CC(=C3)C#CC""",21,"""7D04D9026AEA1706"""
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+"""694084F510F05F1E_B70A39FE04F8A453_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CN=C(C=C3)[N](=O)=O""",21,"""7D04D9026AEA1706"""
+"""C426159D6C69CF59_EF513BD2A2605679_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CSC=C3C(F)(F)F""",21,"""7D04D9026AEA1706"""
+"""B51F8A00618F3A92_C65ADEB812EF53F8_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CC(=CC=C3)C(=O)O""",21,"""7D04D9026AEA1706"""
+"""400B2017FAF807C7_24562BB927DE1C7B_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C4=C3[NH]C=CC3=CC=C4""",21,"""7D04D9026AEA1706"""
+"""B1169DC6D220C034_E7B69EE986876D6C_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=C(C=C(C)C=C3F)F""",21,"""7D04D9026AEA1706"""
+"""1FD0D41D85808A50_530DE0E131DC4C37_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CC=CC4=NON=C34""",21,"""7D04D9026AEA1706"""
+"""7A109D41E70D9FB0_1477BEB95CD61F4F_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=C(C(=C(C)C=C3)F)F""",21,"""7D04D9026AEA1706"""
+"""B9AAC8EC53B1739C_55BCF578564B32CB_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C4=C[N]3C=NN=C3C=C4""",21,"""7D04D9026AEA1706"""
+"""44F42063987002A6_BB8A16B0D475E167_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CC(=C(C=C3)F)OC""",21,"""7D04D9026AEA1706"""
+"""FF18060A6AD2468A_AD57550113E07E1B_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=C(C=C(C)C=C3C)C""",21,"""7D04D9026AEA1706"""
+"""0D73FC0E2A5E8A64_D89C0A4E54341897_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=C(OC)C=CC=C3F""",21,"""7D04D9026AEA1706"""
+"""BB58A951124D16DB_08CFAA4D5AEA2FBB_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CC=C(C(N)=O)C=C3""",21,"""7D04D9026AEA1706"""
+"""34205E8655D0AB86_D2B08371E0FDCA0E_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CC(=C(OC)C=C3)F""",21,"""7D04D9026AEA1706"""
+"""F23C838B98F96347_8A1880B4B09026D2_6006_DP""","""O=[N](=O)C1=C(C=CC2=NON=C12)C4=C3[N](CCNC3)N=C4""",21,"""7D04D9026AEA1706"""
+"""B51F8A00618F3A92_8649E2EC4B3673C9_6006_DP""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CC=CC(=C3)C(O)=O""",21,"""7D04D9026AEA1706"""
+"""DF33A8CB1EC9CB40_AFE288DAB94463B2_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CC=CC(=C3F)OC""",21,"""7D04D9026AEA1706"""
+"""E671F348418E2A9A_187DFFA471B5A1DA_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=C(C=CC(=C3)OC)C""",21,"""7D04D9026AEA1706"""
+"""6919E4938E27195E_0925534310F1D0D7_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C4=C3OC=CC3=CC=C4""",21,"""7D04D9026AEA1706"""
+"""F3E065A2085940D0_B0D457E6118FE4E1_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=C(OC)C=C(C=C3)F""",21,"""7D04D9026AEA1706"""
+"""108563515EC9EE44_B0894BAE4F347228_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CC(=C(OC)C=C3)C""",21,"""7D04D9026AEA1706"""
+"""FCD4485F7D8A8281_A0CE24E6F8381DB7_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=CC=C(C(C)O)C=C3""",21,"""7D04D9026AEA1706"""
+"""EFB69E305CDA3B34_A8EA9859C71C5A96_6006_UN""","""O=[N](=O)C1=C(C=CC2=NON=C12)C3=COC(=C3)C(F)(F)F""",21,"""7D04D9026AEA1706"""
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+"""3CF0E5319194B255_249C25BEFD40F136_6006_UN""","""C1(=NC=C(C=C1)C2=CCNCC2)C4=C3[NH]C=CC3=CC=C4""",21,"""7DCED705B074FA4B"""
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+"""2D2EEDB2BFA7CE88_B24F6BF7A8D97366_6003_UN""","""O(CCCC1=C[NH]C2=C1C=CC=C2)C3=CC=C(C=C3)C#N""",21,"""7E9F07D74B88D06A"""
+"""2452058BBFE1F692_8D6F91FFE941CE47_6003_UN""","""O(CCCC1=C[NH]C2=C1C=CC=C2)C3=CC=CC=C3[N+]#[C-]""",21,"""7E9F07D74B88D06A"""
+"""5F7EAAA98D3E5BC6_8A38648D880CF3E5_6003_UN""","""O(CCCC1=C[NH]C2=C1C=CC=C2)C3=CC=CC=C3C#N""",21,"""7E9F07D74B88D06A"""
+"""48BEF51E914879CF_62B8C6E916F2DA99_6003_UN""","""O(CCCC1=C[NH]C2=C1C=CC=C2)C3=CC=C(C=C3)[N+]#[C-]""",21,"""7E9F07D74B88D06A"""
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+"""536AF84CC5FBAA15_EDCABEF52D62B450_6006_UN""","""NC(=O)C1=C(C=C(C=C1)[N](=O)=O)C2=CSC=C2C(F)(F)F""",21,"""7F9F5C25E5E8F52F"""
+"""198FCAC3A8B854B5_C4C15B9F9DEDB1D1_6006_UN""","""NC(=O)C1=C(C=C(C=C1)[N](=O)=O)C2=CC(=CC=C2)C(=O)O""",21,"""7F9F5C25E5E8F52F"""
+"""5055E886FEF5158D_26CDAE9EA8DCFE52_6006_UN""","""NC(=O)C1=C(C=C(C=C1)[N](=O)=O)C3=C2[NH]C=CC2=CC=C3""",21,"""7F9F5C25E5E8F52F"""
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+"""CF61B03A6997A46C_519665C6BEDEAE1E_6006_UN""","""NC(=O)C1=C(C=C(C=C1)[N](=O)=O)C2=CC=CC3=NON=C23""",21,"""7F9F5C25E5E8F52F"""
+"""F69D8A6A22605362_16EC3B9ED3D4FD66_6006_UN""","""NC(=O)C1=C(C=C(C=C1)[N](=O)=O)C2=C(C(=C(C)C=C2)F)F""",21,"""7F9F5C25E5E8F52F"""
+"""985F5880DD9096A5_5727705FD949D0E2_6006_UN""","""NC(=O)C1=C(C=C(C=C1)[N](=O)=O)C3=C[N]2C=NN=C2C=C3""",21,"""7F9F5C25E5E8F52F"""
+"""92846399D890F792_B91193975B77034E_6006_UN""","""NC(=O)C1=C(C=C(C=C1)[N](=O)=O)C2=CC(=C(C=C2)F)OC""",21,"""7F9F5C25E5E8F52F"""
+"""BA6FD3726D7FFAEA_AFCCD0269CE29C32_6006_UN""","""NC(=O)C1=C(C=C(C=C1)[N](=O)=O)C2=C(C=C(C)C=C2C)C""",21,"""7F9F5C25E5E8F52F"""
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+"""03BEE1C502B276DA_0BCB741698FC4DCE_6006_UN""","""CCNC(=O)C1=C(C=C(C=C1)C3=C2OC=CC2=CC=C3)N""",21,"""7FEAFE57E2E78A1F"""
+"""4FA438ACD807A4DB_B23A70B3998279F8_6006_UN""","""CCNC(=O)C1=C(C=C(C=C1)C2=C(OC)C=C(C=C2)F)N""",21,"""7FEAFE57E2E78A1F"""
+"""081FBD70A43C934E_B2676CFBC739EF31_6006_UN""","""CCNC(=O)C1=C(C=C(C=C1)C2=CC(=C(OC)C=C2)C)N""",21,"""7FEAFE57E2E78A1F"""
+"""5FED6B6C196A8536_A22003B3703580AE_6006_UN""","""CCNC(=O)C1=C(C=C(C=C1)C2=CC=C(C(C)O)C=C2)N""",21,"""7FEAFE57E2E78A1F"""
+"""339B27B320F86707_AA04BF0C4F11C78F_6006_UN""","""CCNC(=O)C1=C(C=C(C=C1)C2=COC(=C2)C(F)(F)F)N""",21,"""7FEAFE57E2E78A1F"""
+"""7F636269FD93E2E1_B4F1F989F083907C_6006_UN""","""CCNC(=O)C1=C(C=C(C=C1)C2=CC(=CS2)C(F)(F)F)N""",21,"""7FEAFE57E2E78A1F"""
+"""ADC7574DF7B59ABA_3760FB4D7162A667_6006_UN""","""CCNC(=O)C1=C(C=C(C=C1)C2=CN=C(N(C)C)N=C2)N""",21,"""7FEAFE57E2E78A1F"""
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+"""F0AD05366A31BA26_CA845028947D91BA_6006_UN""","""NC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CC=CC(=C2)CSC""",21,"""806400FA58780EEA"""
+"""14A0501194CEEA11_4A6AE006366ABDBF_6006_UN""","""NC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CN=C(C=C2)[N](=O)=O""",21,"""806400FA58780EEA"""
+"""BB269E0FF22C31E9_1231E22A90F24F95_6006_UN""","""NC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CSC=C2C(F)(F)F""",21,"""806400FA58780EEA"""
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+"""70B8411930EE4262_E197FD49922879B5_6006_UN""","""OC(=O)C2=C[N]1C=C(C=CC1=N2)C3=CC4=C(C=C3)CCO4""",21,"""811DE2CD0A95E1C0"""
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+"""896B0120143C71FA_4C9A831869719FAD_6006_UN""","""OC(=O)C2=C[N]1C=C(C=CC1=N2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""811DE2CD0A95E1C0"""
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+"""FC614C2723B1E5B8_83A43998328A9553_6036_UN""","""COC(=O)NC1=CC(=CC=C1)CN([S](C=C)(=O)=O)C2CC2""",21,"""8313750764D8DBA2"""
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+"""496E77E7B86604DB_1FC0187A3EED7C7C_6036_UN""","""COC(=O)NC1=CC(=CC=C1)CN([S](C)(=O)=O)CCCBr""",21,"""8313750764D8DBA2"""
+"""5616F308DC1CA66B_4FC31927878978AE_6003_UN""","""COC(=O)NC1=CC(=CC=C1)COC2=CC=C(C=C2)C#N""",21,"""8313750764D8DBA2"""
+"""F21C4AFBCF8F441C_70E3E32FC611C58F_6003_UN""","""COC(=O)NC1=CC(=CC=C1)COC2=CC=CC=C2[N+]#[C-]""",21,"""8313750764D8DBA2"""
+"""E3753E575C5C72BF_77B4165DA75CF82D_6003_UN""","""COC(=O)NC1=CC(=CC=C1)COC2=CC=CC=C2C#N""",21,"""8313750764D8DBA2"""
+"""3AA0C255A4B4BC07_9F34B43939A2D151_6003_UN""","""COC(=O)NC1=CC(=CC=C1)COC2=CC=C(C=C2)[N+]#[C-]""",21,"""8313750764D8DBA2"""
+"""227CC5692529FA23_110F31DB868F062F_6003_UN""","""COC(=O)NC1=CC(=CC=C1)COC2=CC=CC(=C2)[N+]#[C-]""",21,"""8313750764D8DBA2"""
+"""F1058F080A323F13_FD4339A7F45EA484_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N([S](C)(=O)=O)CCCN""",21,"""83DC05EB390D03A5"""
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+"""2F1BE001AEFC5B96_593AFB2EE1E975CB_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N(CCNC)[S](=O)(=O)C""",21,"""83DC05EB390D03A5"""
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+"""54A6CBAA378624BB_81B53485890A9A53_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N([S](C)(=O)=O)CCC#C""",21,"""83DC05EB390D03A5"""
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+"""2A69AB8F3B57F8E4_C90B703461252E3C_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N([S](CC)(=O)=O)CC#C""",21,"""83DC05EB390D03A5"""
+"""916E12A248CD5D12_90D89C6202E6D75C_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N2[S](CCCC2=O)(=O)=O""",21,"""83DC05EB390D03A5"""
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+"""9DDFB14DBC58C317_67EF6779A3F074DE_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N([S](C)(=O)=O)C2CNC2""",21,"""83DC05EB390D03A5"""
+"""F4EC25C695D3C01F_BD38888AC116DBF1_6036_DP""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N[S](=O)(=O)C2(CC2)C#N""",21,"""83DC05EB390D03A5"""
+"""E409E687FE0FA20C_AA34D1A61E874DF9_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N(C)[S](=O)(=O)CCCN""",21,"""83DC05EB390D03A5"""
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+"""48C1EF7B0FD24E95_45FED8F66DD0E801_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N2CCCC(C)[S]2(=O)=O""",21,"""83DC05EB390D03A5"""
+"""38411FCA49EDD075_4811FE11D4E9D3A4_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N2CCC(C)(C)[S]2(=O)=O""",21,"""83DC05EB390D03A5"""
+"""A41DB238CD83063B_73B95FD0D5DE21FB_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N([S](CC)(=O)=O)CCN""",21,"""83DC05EB390D03A5"""
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+"""241DDF39A7581660_00BF5BF52823C73E_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N2[S](=O)(=O)C3(CC2)CC3""",21,"""83DC05EB390D03A5"""
+"""ED4E0F9B7D1BC079_6F99CDC8BDA58F60_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N([S](CCNC)(=O)=O)C""",21,"""83DC05EB390D03A5"""
+"""ED4E0F9B7D1BC079_B369375E443A8446_6036_DP""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N(C)[S](=O)(=O)CCNC""",21,"""83DC05EB390D03A5"""
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+"""58754C9E1E1EA84A_3ED2187A450E4D50_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N2C(CN)CC[S]2(=O)=O""",21,"""83DC05EB390D03A5"""
+"""38726D1933186E13_AD85C7803DC4E028_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N(CC(C)C)[S](=O)(=O)C""",21,"""83DC05EB390D03A5"""
+"""9CCA41DB3C9C01C2_318C522A44CE8DFF_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N2[S](=O)(CCNCC2)=O""",21,"""83DC05EB390D03A5"""
+"""CE8CD7BE098BC1F4_836B49746F5F4D54_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N([S](C=C)(=O)=O)C2CC2""",21,"""83DC05EB390D03A5"""
+"""B9CA0CA8402F032E_236CC977B95A44AB_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N2CC3(C[S]2(=O)=O)CC3""",21,"""83DC05EB390D03A5"""
+"""A58CBBD16C919806_EF27BA46B10555E9_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N([S](C)(=O)=O)C(=O)CN""",21,"""83DC05EB390D03A5"""
+"""EACD5CFBC9DBB19F_0DA4F47061706A27_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N2CCCCC[S]2(=O)=O""",21,"""83DC05EB390D03A5"""
+"""6066ABE8C27227CA_1F0F68966338A47B_6036_UN""","""C(CSC1=CC=C(C=C1)[N](=O)=O)N([S](C)(=O)=O)CCCBr""",21,"""83DC05EB390D03A5"""
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+"""D9A44927B73F9894_5566FE7ACF7E50EB_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=C(C=C(C)C=C2C)C""",21,"""85357279B67439F6"""
+"""CE4D9FA339D3CE58_20ADA13588AA3667_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=C(OC)C=CC=C2F""",21,"""85357279B67439F6"""
+"""FAB29A91F9EF752C_F0FE01368674014B_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC=C(C(N)=O)C=C2""",21,"""85357279B67439F6"""
+"""DB3CA4A6CAC09691_2A81280A3C63E4FE_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC(=C(OC)C=C2)F""",21,"""85357279B67439F6"""
+"""30C27D75F37C2586_72292BCF6C0E0822_6006_DP""","""CC(C)N(C)C1=NC(=CC(=N1)C)C3=C2[N](CCNC2)N=C3""",21,"""85357279B67439F6"""
+"""F0B09113C907CA7A_7E78499797A85D39_6006_DP""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC=CC(=C2)C(O)=O""",21,"""85357279B67439F6"""
+"""F8A7F6C988254C89_57D323A165DA4D42_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC=CC(=C2F)OC""",21,"""85357279B67439F6"""
+"""D45B1F6C81179131_E04C54DFAD2B8F2A_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=C(C=CC(=C2)OC)C""",21,"""85357279B67439F6"""
+"""5B72DAD2C7538CA3_F114F838CC6FFE27_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C3=C2OC=CC2=CC=C3""",21,"""85357279B67439F6"""
+"""35FDB12759B2F83C_48E5FC9DCD11CA11_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=C(OC)C=C(C=C2)F""",21,"""85357279B67439F6"""
+"""366304563C27C2A2_48B8E0D593AA5CD8_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC(=C(OC)C=C2)C""",21,"""85357279B67439F6"""
+"""7BBBF229D5A8AFC3_58FF8F9D24A63347_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC=C(C(C)O)C=C2""",21,"""85357279B67439F6"""
+"""6968DAB5FDA747E8_50DB33221B827466_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=COC(=C2)C(F)(F)F""",21,"""85357279B67439F6"""
+"""20B173D946A89420_4E2E75A7A4102395_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC(=CS2)C(F)(F)F""",21,"""85357279B67439F6"""
+"""92A6000B909C7FD6_CDBF776325F1158E_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CN=C(N(C)C)N=C2""",21,"""85357279B67439F6"""
+"""877F34AAABA2C223_183E9EF713EACD4D_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C3=CC2=C(C=CC=N2)S3""",21,"""85357279B67439F6"""
+"""2D7B1CEE3DC0D5C0_AF4B1E481B99CB35_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=C(C(=CC=C2O)F)F""",21,"""85357279B67439F6"""
+"""491006CDCC7B86E2_480824C24ADFC82F_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CSC3=C2C=CC=C3""",21,"""85357279B67439F6"""
+"""79AA01BBAD16BF18_370E98778DE8BAB8_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC=C[N]3N=CC=C23""",21,"""85357279B67439F6"""
+"""AD096AC2E127E06A_8EA4B1F60CAE510F_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CN=C(C=C2)C(F)F""",21,"""85357279B67439F6"""
+"""374C9B0C2C821F61_E5BF6DFD2EC9A183_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC3=C(C=C2)CCO3""",21,"""85357279B67439F6"""
+"""C9A677EF6B323227_B37C17091AB3F200_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC=C(C=C2)[N](=O)=O""",21,"""85357279B67439F6"""
+"""D201D32EE97A7A24_48B213ACD590479B_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC3=C(C=C2)C=N[NH]3""",21,"""85357279B67439F6"""
+"""FDA8F0FF09BEF502_EC06702CA44915D9_6006_UN""","""CC(C)N(C)C1=NC(=CC(=N1)C)C2=CC=C(S2)C(F)(F)F""",21,"""85357279B67439F6"""
+"""C14C0EC1A00D2F4D_E01A1BE523FC5A67_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC(=C(C(=C4)F)F)F""",21,"""85AEEF2E16168AF3"""
+"""49A44BC28E65983E_CD1BBC73040A6F5B_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=C(C(C)C)C=C4""",21,"""85AEEF2E16168AF3"""
+"""88792FB9DF473CCC_6F987B42D413449E_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC5=C(C=C4)CCC5""",21,"""85AEEF2E16168AF3"""
+"""785879E479EE2FC5_CF4A3B8ECB7B3E3C_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=CC(=C4)C#CC""",21,"""85AEEF2E16168AF3"""
+"""1FC75CF93D04FE38_CF4EBFFCDA1315A3_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=CC(=C4)CSC""",21,"""85AEEF2E16168AF3"""
+"""D133675DD0D14E5B_4FA00FD2780439A6_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CN=C(C=C4)[N](=O)=O""",21,"""85AEEF2E16168AF3"""
+"""8623E653A8FC2998_17FB0DFEDE9CCB8C_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CSC=C4C(F)(F)F""",21,"""85AEEF2E16168AF3"""
+"""5F99AEA37EC21EEB_3EF0E8946E13CE0D_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC(=CC=C4)C(=O)O""",21,"""85AEEF2E16168AF3"""
+"""97354B79D49190CC_DCFC1D955B22818E_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C5=C4[NH]C=CC4=CC=C5""",21,"""85AEEF2E16168AF3"""
+"""700DAEA4B5CA10C7_1F1CA8C5FA7BF099_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=C(C=C(C)C=C4F)F""",21,"""85AEEF2E16168AF3"""
+"""7B40A893454ACFCC_ABA7D6CD4D20D1C2_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=CC5=NON=C45""",21,"""85AEEF2E16168AF3"""
+"""EB9C8478CDABD795_ECDD8895202A82BA_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=C(C(=C(C)C=C4)F)F""",21,"""85AEEF2E16168AF3"""
+"""ED800DCDC04CCD6A_AD16C3542AB7AF3E_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C5=C[N]4C=NN=C4C=C5""",21,"""85AEEF2E16168AF3"""
+"""E22FED998AFA5DC5_4320209CA8897C92_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC(=C(C=C4)F)OC""",21,"""85AEEF2E16168AF3"""
+"""4953B9D072246C37_55FD632D6F1CE3EE_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=C(C=C(C)C=C4C)C""",21,"""85AEEF2E16168AF3"""
+"""854D182C325249E9_20363C6228C88562_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=C(OC)C=CC=C4F""",21,"""85AEEF2E16168AF3"""
+"""D996484ED78C5BFD_F0659C612616B24E_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=C(C(N)=O)C=C4""",21,"""85AEEF2E16168AF3"""
+"""2A80275BA63C1BBC_2A1AB55D9C0157FB_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC(=C(OC)C=C4)F""",21,"""85AEEF2E16168AF3"""
+"""68C34B4359EA909E_72B2B698CC6CBB27_6006_DP""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C5=C4[N](CCNC4)N=C5""",21,"""85AEEF2E16168AF3"""
+"""5F99AEA37EC21EEB_7EE3D4C037CAEE3C_6006_DP""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=CC(=C4)C(O)=O""",21,"""85AEEF2E16168AF3"""
+"""99C4B08F4366D714_5748BEF6C5B8FE47_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=CC(=C4F)OC""",21,"""85AEEF2E16168AF3"""
+"""D07047AD58C607E0_E0D7C9880D493C2F_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=C(C=CC(=C4)OC)C""",21,"""85AEEF2E16168AF3"""
+"""A3C3AF027C766E30_F18F656F6C0D4D22_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C5=C4OC=CC4=CC=C5""",21,"""85AEEF2E16168AF3"""
+"""5015AC088974E0E4_487E61CA6D737914_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=C(OC)C=C(C=C4)F""",21,"""85AEEF2E16168AF3"""
+"""1EBE673815912341_48237D8233C8EFDD_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC(=C(OC)C=C4)C""",21,"""85AEEF2E16168AF3"""
+"""345BE7CAF2F706D4_586412CA84C48042_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=C(C(C)O)C=C4""",21,"""85AEEF2E16168AF3"""
+"""721846351C99E144_5040AE75BBE0C763_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=COC(=C4)C(F)(F)F""",21,"""85AEEF2E16168AF3"""
+"""3E11DA1C7772009F_4EB5E8F004729090_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC(=CS4)C(F)(F)F""",21,"""85AEEF2E16168AF3"""
+"""85936EC1CEFA14C4_CD24EA348593A68B_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CN=C(N(C)C)N=C4""",21,"""85AEEF2E16168AF3"""
+"""93B73B0425210F5F_18A503A0B3887E48_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C5=CC4=C(C=CC=N4)S5""",21,"""85AEEF2E16168AF3"""
+"""A2646B79BC3184C7_AFD0831FBBFB7830_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=C(C(=CC=C4O)F)F""",21,"""85AEEF2E16168AF3"""
+"""8107832208E81A8C_4893B995EABD7B2A_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CSC5=C4C=CC=C5""",21,"""85AEEF2E16168AF3"""
+"""58FD4B40EA1B4286_379505202D8A09BD_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=C[N]5N=CC=C45""",21,"""85AEEF2E16168AF3"""
+"""96BE1BE962060798_8E3F2CA1ACCCE20A_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CN=C(C=C4)C(F)F""",21,"""85AEEF2E16168AF3"""
+"""3E0D980294522395_E524F0AA8EAB1286_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC5=C(C=C4)CCO5""",21,"""85AEEF2E16168AF3"""
+"""78F3F3B530D6F8A2_B3E78A5EBAD14105_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=C(C=C4)[N](=O)=O""",21,"""85AEEF2E16168AF3"""
+"""C4297BA0B9B1479E_48298EFB75F2F49E_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC5=C(C=C4)C=N[NH]5""",21,"""85AEEF2E16168AF3"""
+"""40F9FA5FF1CAAEE9_EC9DED7B042BA6DC_6006_UN""","""C1(=NC2=C(C=C1)C(=N[NH]2)C3CC3)C4=CC=C(S4)C(F)(F)F""",21,"""85AEEF2E16168AF3"""
+"""2EFCD43DC39BC35A_F89B16129D3FDE1D_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN([S](C)(=O)=O)CCCN""",21,"""86042A5E506C793C"""
+"""C629B27AEDD95706_526E22B49DC391B3_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN([S](CC)(=O)=O)CCBr""",21,"""86042A5E506C793C"""
+"""25ACA6C16063766C_5CE2D49B88880F52_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN(CCNC)[S](=O)(=O)C""",21,"""86042A5E506C793C"""
+"""D653919E74979254_A098E8DF83F9C258_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN([S](CCCC)(=O)=O)C""",21,"""86042A5E506C793C"""
+"""B2F2F64C414F8F9D_948B0A825159B907_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN3C(C(C)(C)[S]3(=O)=O)=O""",21,"""86042A5E506C793C"""
+"""3318E55D49AFDA0A_846D1B30E06BE0CA_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN([S](C)(=O)=O)CCC#C""",21,"""86042A5E506C793C"""
+"""432290490121679D_8D2F15850E54CD6E_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN(C)[S](=O)(=O)CCCCl""",21,"""86042A5E506C793C"""
+"""EAEAC84D6F4C7854_CCD35F81084454A5_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN([S](CC)(=O)=O)CC#C""",21,"""86042A5E506C793C"""
+"""FD6F191AC10D4C8B_9500B3D76B87ADC5_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN3[S](CCCC3=O)(=O)=O""",21,"""86042A5E506C793C"""
+"""18FA61F3E03DA33E_47FE2F4F947E9393_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN3C(C(N)C[S]3(=O)=O)=O""",21,"""86042A5E506C793C"""
+"""45048B9811E8E597_623748CCCA910E47_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN([S](C)(=O)=O)C3CNC3""",21,"""86042A5E506C793C"""
+"""89255F2E9EABEDCB_B8E0A73FA877A168_6036_DP""","""CC1=CSC2=NC(=CC(=O)N12)CN[S](=O)(=O)C3(CC3)C#N""",21,"""86042A5E506C793C"""
+"""F7FDC526DE934573_AFECFE1377E63760_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN(C)[S](=O)(=O)CCCN""",21,"""86042A5E506C793C"""
+"""4F86ADE832075DD6_06F5DDF7CAA2C35F_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN(C)[S](=O)(=O)C3COC3""",21,"""86042A5E506C793C"""
+"""A7AA80E2C919F1EC_66D00C15160F73C0_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN(C)[S](=O)(=O)CCOC""",21,"""86042A5E506C793C"""
+"""CE135AF8F6AD2517_C80E91F7C23FA1D5_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN(C)[S](=O)(=O)CC(=O)C""",21,"""86042A5E506C793C"""
+"""518239AC739AA044_4026F74304B19298_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN3CCCC(C)[S]3(=O)=O""",21,"""86042A5E506C793C"""
+"""4406AF26AA80E582_4DC9D1A4BD88A93D_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN3CCC(C)(C)[S]3(=O)=O""",21,"""86042A5E506C793C"""
+"""5F5A6FC158EC5B7B_76617065BCBF5B62_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN([S](CC)(=O)=O)CCN""",21,"""86042A5E506C793C"""
+"""70300E314239A20C_37CCECDF82F95DD6_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN(CC)[S](=O)(=O)CCN""",21,"""86042A5E506C793C"""
+"""D8F81D29D75A9C1C_8D5F472A83EFA89B_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN(C)[S](=O)(=O)C(C)(C)C""",21,"""86042A5E506C793C"""
+"""089CB7DD6DA9C4D4_056774404142BDA7_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN3[S](=O)(=O)C4(CC3)CC4""",21,"""86042A5E506C793C"""
+"""C404FD3C0D61F5DE_6A41E27DD4C4F5F9_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN([S](CCNC)(=O)=O)C""",21,"""86042A5E506C793C"""
+"""C404FD3C0D61F5DE_B6B118EB2D5BFEDF_6036_DP""","""CC1=CSC2=NC(=CC(=O)N12)CN(C)[S](=O)(=O)CCNC""",21,"""86042A5E506C793C"""
+"""39A93DEC00525D5C_A70C9C0756613904_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN3[S](CCC3CI)(=O)=O""",21,"""86042A5E506C793C"""
+"""AC1BAA8B8EF95846_3B0A37CF2C6F37C9_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN3C(CN)CC[S]3(=O)=O""",21,"""86042A5E506C793C"""
+"""E87A565FA467B4CC_A85DE83554A59AB1_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN(CC(C)C)[S](=O)(=O)C""",21,"""86042A5E506C793C"""
+"""E79F3D0180E08824_34547D9F2DAFF766_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN3[S](=O)(CCNCC3)=O""",21,"""86042A5E506C793C"""
+"""950D841DEFD7427F_86B366C1063E37CD_6036_UN""","""CC1=CSC2=NC(=CC(=O)N12)CN([S](C=C)(=O)=O)C3CC3""",21,"""86042A5E506C793C"""
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+"""CC521375308F069D_05D27AB07013CBB1_6036_UN""","""CCC(C(C)(C)C1=CC=CC=C1)N2[S](=O)(=O)C3(CC2)CC3""",21,"""86B124AE613D0F2A"""
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+"""AC50F506D30BBDEF_A8E8E6C565F4ECA7_6036_UN""","""CCC(C(C)(C)C1=CC=CC=C1)N(CC(C)C)[S](=O)(=O)C""",21,"""86B124AE613D0F2A"""
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+"""FD08E5A000A5C6EB_86066831376F41DB_6036_UN""","""CCC(C(C)(C)C1=CC=CC=C1)N([S](C=C)(=O)=O)C2CC2""",21,"""86B124AE613D0F2A"""
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+"""A4EEB19ABF68603D_EA4A9B03E9355966_6036_UN""","""CCC(C(C)(C)C1=CC=CC=C1)N([S](C)(=O)=O)C(=O)CN""",21,"""86B124AE613D0F2A"""
+"""B02E532746E0759A_08C9D535394066A8_6036_UN""","""CCC(C(C)(C)C1=CC=CC=C1)N2CCCCC[S]2(=O)=O""",21,"""86B124AE613D0F2A"""
+"""F323C011C6842D68_1A6249D33B08A8F4_6036_UN""","""CCC(C(C)(C)C1=CC=CC=C1)N([S](C)(=O)=O)CCCBr""",21,"""86B124AE613D0F2A"""
+"""59C1BAB5F66478A2_4A61488E826CAC26_6003_UN""","""CCC(OC1=CC=C(C=C1)C#N)C(C)(C)C2=CC=CC=C2""",21,"""86B124AE613D0F2A"""
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+"""D67972EFFC0F5AF5_721647F4A2B92CA5_6003_UN""","""CCC(OC1=CC=CC=C1C#N)C(C)(C)C2=CC=CC=C2""",21,"""86B124AE613D0F2A"""
+"""31B6DD4B22970E01_9A96E5903C4705D9_6003_UN""","""CCC(OC1=CC=C(C=C1)[N+]#[C-])C(C)(C)C2=CC=CC=C2""",21,"""86B124AE613D0F2A"""
+"""89EFE3789925296C_14AD6072836AD2A7_6003_UN""","""CCC(OC1=CC=CC(=C1)[N+]#[C-])C(C)(C)C2=CC=CC=C2""",21,"""86B124AE613D0F2A"""
+"""7E89769ADB178AFF_F82EC1E1EAA42940_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N([S](C)(=O)=O)CCCN""",21,"""86B1FDAD27F78E61"""
+"""75C333A62EB1BB5F_52DBF547EA5866EE_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N([S](CC)(=O)=O)CCBr""",21,"""86B1FDAD27F78E61"""
+"""C1172ACDD54A0EB6_5C570368FF13F80F_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N(CCNC)[S](=O)(=O)C""",21,"""86B1FDAD27F78E61"""
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+"""2D9FAE0E1920FDFB_943EDD7126C24E5A_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""86B1FDAD27F78E61"""
+"""3A647877950F4906_84D8CCC397F01797_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N([S](C)(=O)=O)CCC#C""",21,"""86B1FDAD27F78E61"""
+"""DB073F6B05961005_8D9AC27679CF3A33_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N(C)[S](=O)(=O)CCCCl""",21,"""86B1FDAD27F78E61"""
+"""B86402AAE3FE731C_CC6688727FDFA3F8_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N([S](CC)(=O)=O)CC#C""",21,"""86B1FDAD27F78E61"""
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+"""591952F80FA668A1_474BF8BCE3E564CE_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N2C(C(N)C[S]2(=O)=O)=O""",21,"""86B1FDAD27F78E61"""
+"""425907E839539778_62829F3FBD0AF91A_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N([S](C)(=O)=O)C2CNC2""",21,"""86B1FDAD27F78E61"""
+"""22D9EE3A70ED7CF6_B85570CCDFEC5635_6036_DP""","""CN(C)C(=O)CN1CCC(CC1)N[S](=O)(=O)C2(CC2)C#N""",21,"""86B1FDAD27F78E61"""
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+"""170844A6EB8BA26E_06400A04BD393402_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N(C)[S](=O)(=O)C2COC2""",21,"""86B1FDAD27F78E61"""
+"""C01570B721802787_6665DBE66194849D_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N(C)[S](=O)(=O)CCOC""",21,"""86B1FDAD27F78E61"""
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+"""B4D763F0E6199FA0_409320B0732A65C5_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N2CCCC(C)[S]2(=O)=O""",21,"""86B1FDAD27F78E61"""
+"""A46F700F981DBF08_4D7C0657CA135E60_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N2CCC(C)(C)[S]2(=O)=O""",21,"""86B1FDAD27F78E61"""
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+"""F0756DD8F88F09A8_37793B2CF562AA8B_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N(CC)[S](=O)(=O)CCN""",21,"""86B1FDAD27F78E61"""
+"""5E258BFEC617AF0D_8DEA90D9F4745FC6_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N(C)[S](=O)(=O)C(C)(C)C""",21,"""86B1FDAD27F78E61"""
+"""E395A3F95366BF6E_05D2A3B336D94AFA_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N2[S](=O)(=O)C3(CC2)CC3""",21,"""86B1FDAD27F78E61"""
+"""727206185CBCAA3E_6AF4358EA35F02A4_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N([S](CCNC)(=O)=O)C""",21,"""86B1FDAD27F78E61"""
+"""727206185CBCAA3E_B604CF185AC00982_6036_DP""","""CN(C)C(=O)CN1CCC(CC1)N(C)[S](=O)(=O)CCNC""",21,"""86B1FDAD27F78E61"""
+"""ADEC774C81A79F92_A7B94BF421FACE59_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N2[S](CCC2CI)(=O)=O""",21,"""86B1FDAD27F78E61"""
+"""0843BF0420A5977F_3BBFE03C5BF4C094_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N2C(CN)CC[S]2(=O)=O""",21,"""86B1FDAD27F78E61"""
+"""CF77E21F25E6AE36_A8E83FC6233E6DEC_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N(CC(C)C)[S](=O)(=O)C""",21,"""86B1FDAD27F78E61"""
+"""866D854336C67053_34E1AA6C5A34003B_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N2[S](=O)(CCNCC2)=O""",21,"""86B1FDAD27F78E61"""
+"""9EDB3235567DD431_8606B13271A5C090_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N([S](C=C)(=O)=O)C2CC2""",21,"""86B1FDAD27F78E61"""
+"""E5C4C2FE216DF890_26013131A7A0C96F_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N2CC3(C[S]2(=O)=O)CC3""",21,"""86B1FDAD27F78E61"""
+"""461EBF7DEAC71CF4_EA4A4200AFFFD82D_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N([S](C)(=O)=O)C(=O)CN""",21,"""86B1FDAD27F78E61"""
+"""988F026CBFB5840C_08C90C367F8AE7E3_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N2CCCCC[S]2(=O)=O""",21,"""86B1FDAD27F78E61"""
+"""6971B794CCC67183_1A6290D07DC229BF_6036_UN""","""CN(C)C(=O)CN1CCC(CC1)N([S](C)(=O)=O)CCCBr""",21,"""86B1FDAD27F78E61"""
+"""916B30C239AD7763_4A61918DC4A62D6D_6003_UN""","""CN(C)C(=O)CN2CCC(OC1=CC=C(C=C1)C#N)CC2""",21,"""86B1FDAD27F78E61"""
+"""B1AD2486F50F986B_75416B85853E904C_6003_UN""","""CN(C)C(=O)CN2CCC(OC1=CC=CC=C1[N+]#[C-])CC2""",21,"""86B1FDAD27F78E61"""
+"""806E0326D1B63BD9_72169EF7E473ADEE_6003_UN""","""CN(C)C(=O)CN2CCC(OC1=CC=CC=C1C#N)CC2""",21,"""86B1FDAD27F78E61"""
+"""6D5804AD98EF0B67_9A963C937A8D8492_6003_UN""","""CN(C)C(=O)CN2CCC(OC1=CC=C(C=C1)[N+]#[C-])CC2""",21,"""86B1FDAD27F78E61"""
+"""FAFBE934ED36768B_14ADB971C5A053EC_6003_UN""","""CN(C)C(=O)CN2CCC(OC1=CC=CC(=C1)[N+]#[C-])CC2""",21,"""86B1FDAD27F78E61"""
+"""038A016382004152_E355284094E01244_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC(=C(C(=C2)F)F)F)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""592AF596DB50AD90_CE548FD6B3162778_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC=C(C(C)C)C=C2)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""F3D2074B5A0446C7_6CD748E7630F0CBD_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC3=C(C=C2)CCC3)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""5C3696AB8C371E05_CC05082B7C67761F_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC=CC(=C2)C#CC)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""E8F4676B4969360F_CC018C596D0F5D80_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC=CC(=C2)CSC)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""FEBA5196DBA7EB2C_4CEF3C77CF187185_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CN=C(C=C2)[N](=O)=O)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""8168F9A9BCADD736_14B43E5B698083AF_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CSC=C2C(F)(F)F)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""896F0C79A1B33A8A_3DBFDB31D90F862E_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC(=CC=C2)C(=O)O)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""85EB4A305D44D449_DFB32E30EC3EC9AD_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C3=C2[NH]C=CC2=CC=C3)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""5B2FFFD0DDB9923C_1C539B604D67B8BA_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=C(C=C(C)C=C2F)F)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""70181EB215890698_A8E8E568FA3C99E1_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC=CC3=NON=C23)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""50BC0E0C6CA9D737_EF92BB309736CA99_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=C(C(=C(C)C=C2)F)F)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""56917869EEF83C76_AE59F0F19DABE71D_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C3=C[N]2C=NN=C2C=C3)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""437A6BF630B1FB19_406F13391F9534B1_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC(=C(C=C2)F)OC)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""AC3309716ED3FEC2_56B25088D800ABCD_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=C(C=C(C)C=C2C)C)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""C3BE18D0A339571E_23790FC79FD4CD41_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=C(OC)C=CC=C2F)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""11C96B27F0BB76D9_F32AAFC4910AFA6D_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC=C(C(N)=O)C=C2)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""6FC8774B5F4F4E4A_295586F82B1D1FD8_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC(=C(OC)C=C2)F)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""16B2A0408ADA5000_71FD853D7B70F304_6006_DP""","""OC(=O)C1=CC(=C(N=C1)C3=C2[N](CCNC2)N=C3)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""896F0C79A1B33A8A_7DACE76580D6A61F_6006_DP""","""OC(=O)C1=CC(=C(N=C1)C2=CC=CC(=C2)C(O)=O)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""753AF93C9CDDE4A1_54078D5372A4B664_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC=CC(=C2F)OC)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""401029FF3A639472_E398FA2DBA55740C_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=C(C=CC(=C2)OC)C)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""C70C4C3ED2EFF442_F2C056CADB110501_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C3=C2OC=CC2=CC=C3)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""7E748B11A4B28DB6_4B31526FDA6F3137_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=C(OC)C=C(C=C2)F)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""43F8DBA1C72C68C8_4B6C4E2784D4A7FE_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC(=C(OC)C=C2)C)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""12CE6B6DECE09312_5B2B216F33D8C861_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC=C(C(C)O)C=C2)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""15718DA6FD4CC760_530F9DD00CFC8F40_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=COC(=C2)C(F)(F)F)C(F)F""",21,"""86E1DC8BA10AC2D0"""
+"""C1F01614119AB6B3_4DFADB55B36ED8B3_6006_UN""","""OC(=O)C1=CC(=C(N=C1)C2=CC(=CS2)C(F)(F)F)C(F)F""",21,"""86E1DC8BA10AC2D0"""
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+"""1391163FCBE9EBD3_5A6E5A65F7D9F3D1_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC=C)C2=CC=C(C(C)O)C=C2""",21,"""87A4A781650BF960"""
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+"""99C50C115567D609_634463B03C522985_6006_UN""","""COC(=O)C1=CC(=C(C(=C1)C)C2=CC3=C(C=C2)CCC3)N""",21,"""8972F7DCFE57E7E8"""
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+"""182882B06A36D668_C392A70E325278B8_6006_UN""","""COC(=O)C1=CC(=C(C(=C1)C)C2=CC=CC(=C2)CSC)N""",21,"""8972F7DCFE57E7E8"""
+"""02CE0440146342E7_437C1720904554BD_6006_UN""","""COC(=O)C1=CC(=C(C(=C1)C)C2=CN=C(C=C2)[N](=O)=O)N""",21,"""8972F7DCFE57E7E8"""
+"""C2E7FA7D664B8924_1B27150C36DDA697_6006_UN""","""COC(=O)C1=CC(=C(C(=C1)C)C2=CSC=C2C(F)(F)F)N""",21,"""8972F7DCFE57E7E8"""
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+"""2DE55A111347D282_C21C52C61AF4F3A0_6036_UN""","""C1(CCOC2=C1C=C(C=C2F)F)N(C)[S](=O)(=O)CC(=O)C""",21,"""8C16E96F88A72B49"""
+"""EFCDA7B87FDF3A43_4A343472DC7AC0ED_6036_UN""","""C1(CCOC2=C1C=C(C=C2F)F)N3CCCC(C)[S]3(=O)=O""",21,"""8C16E96F88A72B49"""
+"""42FDE702DE323EBF_47DB12956543FB48_6036_UN""","""C1(CCOC2=C1C=C(C=C2F)F)N3CCC(C)(C)[S]3(=O)=O""",21,"""8C16E96F88A72B49"""
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+"""FD052A195D111FA4_876890D5A661A816_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N(C)[S](=O)(=O)C(C)(C)C""",21,"""8C33FDA175E279B1"""
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+"""BA814EC7839DE8F8_60763582F14AF574_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N([S](CCNC)(=O)=O)C""",21,"""8C33FDA175E279B1"""
+"""BA814EC7839DE8F8_BC86CF1408D5FE52_6036_DP""","""CCC(C1=C(C=CC(=C1)C)OC)N(C)[S](=O)(=O)CCNC""",21,"""8C33FDA175E279B1"""
+"""7E52262409725381_AD3B4BF873EF3989_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N2[S](CCC2CI)(=O)=O""",21,"""8C33FDA175E279B1"""
+"""B6C3EC51F187E02A_313DE03009E13744_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N2C(CN)CC[S]2(=O)=O""",21,"""8C33FDA175E279B1"""
+"""3A1C647EB81B661E_A26A3FCA712B9A3C_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N(CC(C)C)[S](=O)(=O)C""",21,"""8C33FDA175E279B1"""
+"""9DCAD6CCC197590A_3E63AA600821F7EB_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N2[S](=O)(CCNCC2)=O""",21,"""8C33FDA175E279B1"""
+"""138B0CD2D561CD43_8C84B13E23B03740_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N([S](C=C)(=O)=O)C2CC2""",21,"""8C33FDA175E279B1"""
+"""7861B918792FD797_2C83313DF5B53EBF_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N2CC3(C[S]2(=O)=O)CC3""",21,"""8C33FDA175E279B1"""
+"""6F6CD3FC83D3036B_E0C8420CFDEA2FFD_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N([S](C)(=O)=O)C(=O)CN""",21,"""8C33FDA175E279B1"""
+"""2A6D727628C744F9_024B0C3A2D9F1033_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N2CCCCC[S]2(=O)=O""",21,"""8C33FDA175E279B1"""
+"""D42E3FD8A477B85D_10E090DC2FD7DE6F_6036_UN""","""CCC(C1=C(C=CC(=C1)C)OC)N([S](C)(=O)=O)CCCBr""",21,"""8C33FDA175E279B1"""
+"""A736C6D323DECF5B_40E3918196B3DABD_6003_UN""","""CCC(OC1=CC=C(C=C1)C#N)C2=C(C=CC(=C2)C)OC""",21,"""8C33FDA175E279B1"""
+"""E0EA389B9E1657D3_7FC36B89D72B679C_6003_UN""","""CCC(OC1=CC=CC=C1[N+]#[C-])C2=C(C=CC(=C2)C)OC""",21,"""8C33FDA175E279B1"""
+"""ABC9F7B40C5B9533_78949EFBB6665A3E_6003_UN""","""CCC(OC1=CC=CC=C1C#N)C2=C(C=CC(=C2)C)OC""",21,"""8C33FDA175E279B1"""
+"""24F6E8CB38A2B078_90143C9F28987342_6003_UN""","""CCC(OC1=CC=C(C=C1)[N+]#[C-])C2=C(C=CC(=C2)C)OC""",21,"""8C33FDA175E279B1"""
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+"""9DFD4D396AC0F860_D441702EBF343AE8_6006_UN""","""C1(=NC(=NC=N1)N2CCNCC2)C4=C3[NH]C=CC3=CC=C4""",21,"""8D138295F2003195"""
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+"""F833C241905A4B9F_A31ABB76A9366AA4_6006_UN""","""C1(=NC(=NC=N1)N2CCNCC2)C3=CC=CC4=NON=C34""",21,"""8D138295F2003195"""
+"""8C2D41D74BA68B9C_E460E52EC43C39DC_6006_UN""","""C1(=NC(=NC=N1)N2CCNCC2)C3=C(C(=C(C)C=C3)F)F""",21,"""8D138295F2003195"""
+"""65CBB1CD0981D910_A5ABAEEFCEA11458_6006_UN""","""C1(=NC(=NC=N1)N2CCNCC2)C4=C[N]3C=NN=C3C=C4""",21,"""8D138295F2003195"""
+"""4A360A9A99598D6E_4B9D4D274C9FC7F4_6006_UN""","""C1(=NC(=NC=N1)N2CCNCC2)C3=CC(=C(C=C3)F)OC""",21,"""8D138295F2003195"""
+"""4EBF3B440ABD88D6_5D400E968B0A5888_6006_UN""","""C1(=NC(=NC=N1)N2CCNCC2)C3=C(C=C(C)C=C3C)C""",21,"""8D138295F2003195"""
+"""4335666EB03EC3DA_288B51D9CCDE3E04_6006_UN""","""C1(=NC(=NC=N1)N2CCNCC2)C3=C(OC)C=CC=C3F""",21,"""8D138295F2003195"""
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+"""51DA5A28A8841E2B_E7BB860470E02574_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=C(C(=C(C)C=C3)F)F""",21,"""8EC8E1BF46DC2D3D"""
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+"""7531A2575FB4D551_5E9B6DBC3FD64420_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=C(C=C(C)C=C3C)C""",21,"""8EC8E1BF46DC2D3D"""
+"""75905F7761EC7227_2B5032F3780222AC_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=C(OC)C=CC=C3F""",21,"""8EC8E1BF46DC2D3D"""
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+"""274C225DB75C4A41_217CBBCCCCCBF035_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC(=C(OC)C=C3)F""",21,"""8EC8E1BF46DC2D3D"""
+"""CC9DE013D841F774_79D4B8099CA61CE9_6006_DP""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C4=C3[N](CCNC3)N=C4""",21,"""8EC8E1BF46DC2D3D"""
+"""DD71140CD53A8A49_7585DA51670049F2_6006_DP""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC=CC(=C3)C(O)=O""",21,"""8EC8E1BF46DC2D3D"""
+"""93769CC06E304234_5C2EB06795725989_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC=CC(=C3F)OC""",21,"""8EC8E1BF46DC2D3D"""
+"""0EE4BDDA024CADA6_EBB1C7195D839BE1_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=C(C=CC(=C3)OC)C""",21,"""8EC8E1BF46DC2D3D"""
+"""7A4313AB677F4794_FAE96BFE3CC7EAEC_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C4=C3OC=CC3=CC=C4""",21,"""8EC8E1BF46DC2D3D"""
+"""DCDF5F6A60560742_43186F5B3DB9DEDA_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=C(OC)C=C(C=C3)F""",21,"""8EC8E1BF46DC2D3D"""
+"""05DB203E1AC5A84A_4345731363024813_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC(=C(OC)C=C3)C""",21,"""8EC8E1BF46DC2D3D"""
+"""9402AD1A84123393_53021C5BD40E278C_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC=C(C(C)O)C=C3""",21,"""8EC8E1BF46DC2D3D"""
+"""C857C88883671EFF_5B26A0E4EB2A60AD_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=COC(=C3)C(F)(F)F""",21,"""8EC8E1BF46DC2D3D"""
+"""D88C3E4CE8CBB1CF_45D3E66154B8375E_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC(=CS3)C(F)(F)F""",21,"""8EC8E1BF46DC2D3D"""
+"""699EA04BC200E66A_C642E4A5D5590145_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CN=C(N(C)C)N=C3""",21,"""8EC8E1BF46DC2D3D"""
+"""10B21215F80155BC_13C30D31E342D986_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C4=CC3=C(C=CC=N3)S4""",21,"""8EC8E1BF46DC2D3D"""
+"""4C5D1125C32234F7_A4B68D8EEB31DFFE_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=C(C(=CC=C3O)F)F""",21,"""8EC8E1BF46DC2D3D"""
+"""3DC9D365F812AD6A_43F5B704BA77DCE4_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CSC4=C3C=CC=C4""",21,"""8EC8E1BF46DC2D3D"""
+"""8FC18FA8846EF9D8_3CF30BB17D40AE73_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC=C[N]4N=CC=C34""",21,"""8EC8E1BF46DC2D3D"""
+"""EE589D06494077E7_85592230FC0645C4_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CN=C(C=C3)C(F)F""",21,"""8EC8E1BF46DC2D3D"""
+"""457CF062151E31D5_EE42FE3BDE61B548_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC4=C(C=C3)CCO4""",21,"""8EC8E1BF46DC2D3D"""
+"""2F9D044B6DBE9087_B88184CFEA1BE6CB_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC=C(C=C3)[N](=O)=O""",21,"""8EC8E1BF46DC2D3D"""
+"""521C1860A4CFDD0F_434F806A25385350_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""8EC8E1BF46DC2D3D"""
+"""805FAEB13FB1949F_E7FBE3EA54E10112_6006_UN""","""C[N]1N=C(C=C1N)C2=CC=C(S2)C3=CC=C(S3)C(F)(F)F""",21,"""8EC8E1BF46DC2D3D"""
+"""68C6893661331236_EB7E99AAB0D2B1CF_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC(=C(C(=C3)F)F)F""",21,"""8ECA6D618538615B"""
+"""EF8C1C0DEC6B7327_C67F3E3C972484F3_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC=C(C(C)C)C=C3""",21,"""8ECA6D618538615B"""
+"""F94586606BDF599A_64FCF90D473DAF36_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC4=C(C=C3)CCC4""",21,"""8ECA6D618538615B"""
+"""225B989B672B062F_C42EB9C15855D594_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC=CC(=C3)C#CC""",21,"""8ECA6D618538615B"""
+"""74F97DDC943F5014_C42A3DB3493DFE0B_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC=CC(=C3)CSC""",21,"""8ECA6D618538615B"""
+"""2CE63A036744249D_44C48D9DEB2AD20E_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CN=C(C=C3)[N](=O)=O""",21,"""8ECA6D618538615B"""
+"""F4CBF2D36D30BC88_1C9F8FB14DB22024_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CSC=C3C(F)(F)F""",21,"""8ECA6D618538615B"""
+"""30CB2363D91364C1_35946ADBFD3D25A5_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC(=CC=C3)C(=O)O""",21,"""8ECA6D618538615B"""
+"""7016245DD6596F9E_D7989FDAC80C6A26_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C4=C3[NH]C=CC3=CC=C4""",21,"""8ECA6D618538615B"""
+"""DB6FA6FDF5C04414_14782A8A69551B31_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=C(C=C(C)C=C3F)F""",21,"""8ECA6D618538615B"""
+"""6CD28EA5AA60F7C1_A0C35482DE0E3A6A_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC=CC4=NON=C34""",21,"""8ECA6D618538615B"""
+"""5D3D1C7FA4396927_E7B90ADAB3046912_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=C(C(=C(C)C=C3)F)F""",21,"""8ECA6D618538615B"""
+"""A63C4246E5D1FC12_A672411BB9994496_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C4=C[N]3C=NN=C3C=C4""",21,"""8ECA6D618538615B"""
+"""619F503BD7E08E97_4844A2D33BA7973A_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC(=C(C=C3)F)OC""",21,"""8ECA6D618538615B"""
+"""869E5EA1DE494C22_5E99E162FC320846_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=C(C=C(C)C=C3C)C""",21,"""8ECA6D618538615B"""
+"""FCFBD4E314B683B8_2B52BE2DBBE66ECA_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=C(OC)C=CC=C3F""",21,"""8ECA6D618538615B"""
+"""A85091186895C79C_FB011E2EB53859E6_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC=C(C(N)=O)C=C3""",21,"""8ECA6D618538615B"""
+"""C10121483041DF8C_217E37120F2FBC53_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC(=C(OC)C=C3)F""",21,"""8ECA6D618538615B"""
+"""97877A26A3C14503_79D634D75F42508F_6006_DP""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C4=C3[N](CCNC3)N=C4""",21,"""8ECA6D618538615B"""
+"""30CB2363D91364C1_7587568FA4E40594_6006_DP""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC=CC(=C3)C(O)=O""",21,"""8ECA6D618538615B"""
+"""15EBD1710EE2EC06_5C2C3CB9569615EF_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC=CC(=C3F)OC""",21,"""8ECA6D618538615B"""
+"""B9F077B7E27995BD_EBB34BC79E67D787_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=C(C=CC(=C3)OC)C""",21,"""8ECA6D618538615B"""
+"""93922AB0452E98AA_FAEBE720FF23A68A_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C4=C3OC=CC3=CC=C4""",21,"""8ECA6D618538615B"""
+"""F2602A387F844352_431AE385FE5D92BC_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=C(OC)C=C(C=C3)F""",21,"""8ECA6D618538615B"""
+"""11004EE04B399792_4347FFCDA0E60475_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC(=C(OC)C=C3)C""",21,"""8ECA6D618538615B"""
+"""8F4969D0039D9311_5300908517EA6BEA_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC=C(C(C)O)C=C3""",21,"""8ECA6D618538615B"""
+"""F9AC19CB484E0218_5B242C3A28CE2CCB_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=COC(=C3)C(F)(F)F""",21,"""8ECA6D618538615B"""
+"""252EE554D02BCC25_45D16ABF975C7B38_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC(=CS3)C(F)(F)F""",21,"""8ECA6D618538615B"""
+"""42060CE1023BE603_C640687B16BD4D23_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CN=C(N(C)C)N=C3""",21,"""8ECA6D618538615B"""
+"""DEC9B2639FFABAE6_13C181EF20A695E0_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C4=CC3=C(C=CC=N3)S4""",21,"""8ECA6D618538615B"""
+"""D6283476749EA6DA_A4B4015028D59398_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=C(C(=CC=C3O)F)F""",21,"""8ECA6D618538615B"""
+"""E6FD5CFB9AB15EDA_43F73BDA79939082_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CSC4=C3C=CC=C4""",21,"""8ECA6D618538615B"""
+"""590C055871C047C8_3CF1876FBEA4E215_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC=C[N]4N=CC=C34""",21,"""8ECA6D618538615B"""
+"""45E6B0B3DE8181D4_855BAEEE3FE209A2_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CN=C(C=C3)C(F)F""",21,"""8ECA6D618538615B"""
+"""2AFD486676A29EE2_EE4072E51D85F92E_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC4=C(C=C3)CCO4""",21,"""8ECA6D618538615B"""
+"""46CDE38867711B66_B883081129FFAAAD_6006_UN""","""CC(=O)C1=CN=C2C=CC(=N[N]12)C3=CC=C(C=C3)[N](=O)=O""",21,"""8ECA6D618538615B"""
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+"""EF6AF2249D400E62_5F23D0F1075D3231_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=C(C=C(C)C=C2C)C)C3=O""",21,"""8F705CF27E575B2C"""
+"""674BE3BCD32E2A2D_2AE88FBE408954BD_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=C(OC)C=CC=C2F)C3=O""",21,"""8F705CF27E575B2C"""
+"""EADBAD5867C76E43_FABB2FBD4E576391_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CC=C(C(N)=O)C=C2)C3=O""",21,"""8F705CF27E575B2C"""
+"""250976C31F0A3383_20C40681F4408624_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CC(=C(OC)C=C2)F)C3=O""",21,"""8F705CF27E575B2C"""
+"""3B1E290D3E9BE3A0_786C0544A42D6AF8_6006_DP""","""CN4C(=O)NC1=C([NH]C(=N1)C3=C2[N](CCNC2)N=C3)C4=O""",21,"""8F705CF27E575B2C"""
+"""C436FD5E47EBAC69_743D671C5F8B3FE3_6006_DP""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CC=CC(=C2)C(O)=O)C3=O""",21,"""8F705CF27E575B2C"""
+"""5A9FCFBE409A432A_5D960D2AADF92F98_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CC=CC(=C2F)OC)C3=O""",21,"""8F705CF27E575B2C"""
+"""AEF4F511F51EEBF8_EA097A546508EDF0_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=C(C=CC(=C2)OC)C)C3=O""",21,"""8F705CF27E575B2C"""
+"""BC33C0882898092B_FB51D6B3044C9CFD_6006_UN""","""CN4C(=O)NC1=C([NH]C(=N1)C3=C2OC=CC2=CC=C3)C4=O""",21,"""8F705CF27E575B2C"""
+"""49BC0B62EBDA5A19_42A0D2160532A8CB_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=C(OC)C=C(C=C2)F)C3=O""",21,"""8F705CF27E575B2C"""
+"""08AC6B2581E2EC2A_42FDCE5E5B893E02_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CC(=C(OC)C=C2)C)C3=O""",21,"""8F705CF27E575B2C"""
+"""28D7CAE83251E363_52BAA116EC85519D_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CC=C(C(C)O)C=C2)C3=O""",21,"""8F705CF27E575B2C"""
+"""4A038CAEF8E2E1A6_5A9E1DA9D3A116BC_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=COC(=C2)C(F)(F)F)C3=O""",21,"""8F705CF27E575B2C"""
+"""8B035AD42AA76939_446B5B2C6C33414F_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CC(=CS2)C(F)(F)F)C3=O""",21,"""8F705CF27E575B2C"""
+"""E137494B92CCC373_C7FA59E8EDD27754_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CN=C(N(C)C)N=C2)C3=O""",21,"""8F705CF27E575B2C"""
+"""F4BD250118FFE21D_127BB07CDBC9AF97_6006_UN""","""CN4C(=O)NC1=C([NH]C(=N1)C3=CC2=C(C=CC=N2)S3)C4=O""",21,"""8F705CF27E575B2C"""
+"""3186E243179312E7_A50E30C3D3BAA9EF_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=C(C(=CC=C2O)F)F)C3=O""",21,"""8F705CF27E575B2C"""
+"""8A2C544588E454AC_424D0A4982FCAAF5_6006_UN""","""CN4C(=O)NC1=C([NH]C(=N1)C2=CSC3=C2C=CC=C3)C4=O""",21,"""8F705CF27E575B2C"""
+"""8C80DEB286F2EAFB_3D4BB6FC45CBD862_6006_UN""","""CN4C(=O)NC1=C([NH]C(=N1)C2=CC=C[N]3N=CC=C23)C4=O""",21,"""8F705CF27E575B2C"""
+"""9540A43BA3EDD9A9_84E19F7DC48D33D5_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CN=C(C=C2)C(F)F)C3=O""",21,"""8F705CF27E575B2C"""
+"""659EDAF4E1803186_EFFA4376E6EAC359_6006_UN""","""CN4C(=O)NC1=C([NH]C(=N1)C2=CC3=C(C=C2)CCO3)C4=O""",21,"""8F705CF27E575B2C"""
+"""7FB664303C129A42_B9393982D29090DA_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CC=C(C=C2)[N](=O)=O)C3=O""",21,"""8F705CF27E575B2C"""
+"""AC8B21CDC1E1721A_42F73D271DB32541_6006_UN""","""CN4C(=O)NC1=C([NH]C(=N1)C2=CC3=C(C=C2)C=N[NH]3)C4=O""",21,"""8F705CF27E575B2C"""
+"""DA600875F9D0D2D4_E6435EA76C6A7703_6006_UN""","""CN3C(=O)NC1=C([NH]C(=N1)C2=CC=C(S2)C(F)(F)F)C3=O""",21,"""8F705CF27E575B2C"""
+"""EC83E39076C152CC_EA59F0E7F38E246A_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC(=C(C(=C3)F)F)F""",21,"""8FED042CC664F4FE"""
+"""0DE8B57950F88D60_C7585771D4781156_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=C(C(C)C)C=C3""",21,"""8FED042CC664F4FE"""
+"""FDB1CEBBE03DC081_65DB904004613A93_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC4=C(C=C3)CCC4""",21,"""8FED042CC664F4FE"""
+"""35389EFFC2E7D77A_C509D08C1B094031_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=CC(=C3)C#CC""",21,"""8FED042CC664F4FE"""
+"""0C9C02A484B2E98B_C50D54FE0A616BAE_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=CC(=C3)CSC""",21,"""8FED042CC664F4FE"""
+"""E18C8547DF6B6FE5_45E3E4D0A87647AB_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CN=C(C=C3)[N](=O)=O""",21,"""8FED042CC664F4FE"""
+"""7BD1A498B183CAD6_1DB8E6FC0EEEB581_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CSC=C3C(F)(F)F""",21,"""8FED042CC664F4FE"""
+"""DF4A31D447F95DF1_34B30396BE61B000_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC(=CC=C3)C(=O)O""",21,"""8FED042CC664F4FE"""
+"""D07A1035CF6F1384_D6BFF6978B50FF83_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C4=C3[NH]C=CC3=CC=C4""",21,"""8FED042CC664F4FE"""
+"""3847957B909866A1_155F43C72A098E94_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=C(C=C(C)C=C3F)F""",21,"""8FED042CC664F4FE"""
+"""0BA947425FEE8918_A1E43DCF9D52AFCF_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=CC4=NON=C34""",21,"""8FED042CC664F4FE"""
+"""4E112AFB6C60B7B2_E69E6397F058FCB7_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=C(C(=C(C)C=C3)F)F""",21,"""8FED042CC664F4FE"""
+"""54703235D8AF9BAE_A7552856FAC5D133_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C4=C[N]3C=NN=C3C=C4""",21,"""8FED042CC664F4FE"""
+"""E7B69E47814032F1_4963CB9E78FB029F_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC(=C(C=C3)F)OC""",21,"""8FED042CC664F4FE"""
+"""C69A9ADDBFB4FCA2_5FBE882FBF6E9DE3_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=C(C=C(C)C=C3C)C""",21,"""8FED042CC664F4FE"""
+"""77C4E9840854D6E8_2A75D760F8BAFB6F_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=C(OC)C=CC=C3F""",21,"""8FED042CC664F4FE"""
+"""3C36DBD526FE5D2A_FA267763F664CC43_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=C(C(N)=O)C=C3""",21,"""8FED042CC664F4FE"""
+"""30A568815ACE4A62_20595E5F4C7329F6_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC(=C(OC)C=C3)F""",21,"""8FED042CC664F4FE"""
+"""9FB261AF3D69F9C4_78F15D9A1C1EC52A_6006_DP""","""CC1CCC2=C1N=C(C(=C2)C#N)C4=C3[N](CCNC3)N=C4""",21,"""8FED042CC664F4FE"""
+"""DF4A31D447F95DF1_74A03FC2E7B89031_6006_DP""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=CC(=C3)C(O)=O""",21,"""8FED042CC664F4FE"""
+"""7CE8D6D589CF9EC7_5D0B55F415CA804A_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=CC(=C3F)OC""",21,"""8FED042CC664F4FE"""
+"""FF56559161166050_EA94228ADD3B4222_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=C(C=CC(=C3)OC)C""",21,"""8FED042CC664F4FE"""
+"""168816A41CD46A3B_FBCC8E6DBC7F332F_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C4=C3OC=CC3=CC=C4""",21,"""8FED042CC664F4FE"""
+"""DCB14AC6A1028034_423D8AC8BD010719_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=C(OC)C=C(C=C3)F""",21,"""8FED042CC664F4FE"""
+"""9057F555B24D4B49_42609680E3BA91D0_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC(=C(OC)C=C3)C""",21,"""8FED042CC664F4FE"""
+"""F01B348EE35E1AED_5227F9C854B6FE4F_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=C(C(C)O)C=C3""",21,"""8FED042CC664F4FE"""
+"""E0DB9131803096CF_5A0345776B92B96E_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=COC(=C3)C(F)(F)F""",21,"""8FED042CC664F4FE"""
+"""F92F7E944FE833F3_44F603F2D400EE9D_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC(=CS3)C(F)(F)F""",21,"""8FED042CC664F4FE"""
+"""AABFC3F4BE62226E_C767013655E1D886_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CN=C(N(C)C)N=C3""",21,"""8FED042CC664F4FE"""
+"""A33F38837EA09FA9_12E6E8A263FA0045_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C4=CC3=C(C=CC=N3)S4""",21,"""8FED042CC664F4FE"""
+"""9F9C9B4FD0347CE4_A593681D6B89063D_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=C(C(=CC=C3O)F)F""",21,"""8FED042CC664F4FE"""
+"""51717775877727FB_42D052973ACF0527_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CSC4=C3C=CC=C4""",21,"""8FED042CC664F4FE"""
+"""2ABFA282550CAEE0_3DD6EE22FDF877B0_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=C[N]4N=CC=C34""",21,"""8FED042CC664F4FE"""
+"""989C19716E943B9A_847CC7A37CBE9C07_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CN=C(C=C3)C(F)F""",21,"""8FED042CC664F4FE"""
+"""C996292D567989D6_EF671BA85ED96C8B_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC4=C(C=C3)CCO4""",21,"""8FED042CC664F4FE"""
+"""61DE7D7D3F640B4F_B9A4615C6AA33F08_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=C(C=C3)[N](=O)=O""",21,"""8FED042CC664F4FE"""
+"""30C65EBE2F8260CF_426A65F9A5808A93_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC4=C(C=C3)C=N[NH]4""",21,"""8FED042CC664F4FE"""
+"""A4CFC6AA950EFC5F_E6DE0679D459D8D1_6006_UN""","""CC1CCC2=C1N=C(C(=C2)C#N)C3=CC=C(S3)C(F)(F)F""",21,"""8FED042CC664F4FE"""
+"""D8981998AA9E8A95_EE18F438A79170B6_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N([S](C)(=O)=O)CCCN""",21,"""9087C8746AC2D797"""
+"""034E6D12E4FEB5B1_44EDC09EA76D3F18_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N([S](CC)(=O)=O)CCBr""",21,"""9087C8746AC2D797"""
+"""8FF9086B0BF9287C_4A6136B1B226A1F9_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N(CCNC)[S](=O)(=O)C""",21,"""9087C8746AC2D797"""
+"""BAC65985B5F2888C_B61B0AF5B9576CF3_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N([S](CCCC)(=O)=O)C""",21,"""9087C8746AC2D797"""
+"""04B5B7071D6A9473_8208E8A86BF717AC_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""9087C8746AC2D797"""
+"""D1A8363403431C18_92EEF91ADAC54E61_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N([S](C)(=O)=O)CCC#C""",21,"""9087C8746AC2D797"""
+"""6E08A10435DEEA17_9BACF7AF34FA63C5_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N(C)[S](=O)(=O)CCCCl""",21,"""9087C8746AC2D797"""
+"""A8506641B1221734_DA50BDAB32EAFA0E_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N([S](CC)(=O)=O)CC#C""",21,"""9087C8746AC2D797"""
+"""AD868F1A60927C04_838351FD5129036E_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N3[S](CCCC3=O)(=O)=O""",21,"""9087C8746AC2D797"""
+"""2E4231E7AE622458_517DCD65AED03D38_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""9087C8746AC2D797"""
+"""CCBEF9610896D320_74B4AAE6F03FA0EC_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N([S](C)(=O)=O)C3CNC3""",21,"""9087C8746AC2D797"""
+"""6663561E9EF772B3_AE63451592D90FC3_6036_DP""","""C(CN1CCCC2=C1C=CC=C2)N[S](=O)(=O)C3(CC3)C#N""",21,"""9087C8746AC2D797"""
+"""7D18B14D4810F081_B96F1C394D4899CB_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N(C)[S](=O)(=O)CCCN""",21,"""9087C8746AC2D797"""
+"""25B24B09EC48C44D_10763FDDF00C6DF4_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N(C)[S](=O)(=O)C3COC3""",21,"""9087C8746AC2D797"""
+"""A480B9D76281BEE8_7053EE3F2CA1DD6B_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N(C)[S](=O)(=O)CCOC""",21,"""9087C8746AC2D797"""
+"""E15B4D9C8D5E82DE_DE8D73DDF8910F7E_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N(C)[S](=O)(=O)CC(=O)C""",21,"""9087C8746AC2D797"""
+"""F9CEF3008155CDD5_56A515693E1F3C33_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N3CCCC(C)[S]3(=O)=O""",21,"""9087C8746AC2D797"""
+"""4CA8E26FDF46D4AA_5B4A338E87260796_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N3CCC(C)(C)[S]3(=O)=O""",21,"""9087C8746AC2D797"""
+"""B3B9FCDD0694AED6_60E2924F8611F5C9_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N([S](CC)(=O)=O)CCN""",21,"""9087C8746AC2D797"""
+"""F7188A485B625CAA_214F0EF5B857F37D_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N(CC)[S](=O)(=O)CCN""",21,"""9087C8746AC2D797"""
+"""6B364011E3331BF8_9BDCA500B9410630_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""9087C8746AC2D797"""
+"""8EA0341940176F2B_13E4966A7BEC130C_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""9087C8746AC2D797"""
+"""0B5C2249A72DD005_7CC20057EE6A5B52_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N([S](CCNC)(=O)=O)C""",21,"""9087C8746AC2D797"""
+"""0B5C2249A72DD005_A032FAC117F55074_6036_DP""","""C(CN1CCCC2=C1C=CC=C2)N(C)[S](=O)(=O)CCNC""",21,"""9087C8746AC2D797"""
+"""A91E255C7BC8063F_B18F7E2D6CCF97AF_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N3[S](CCC3CI)(=O)=O""",21,"""9087C8746AC2D797"""
+"""D064148D5983F539_2D89D5E516C19962_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N3C(CN)CC[S]3(=O)=O""",21,"""9087C8746AC2D797"""
+"""4D74DC0AC966BACF_BEDE0A1F6E0B341A_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N(CC(C)C)[S](=O)(=O)C""",21,"""9087C8746AC2D797"""
+"""75F1E9B79A0C18A7_22D79FB5170159CD_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N3[S](=O)(CCNCC3)=O""",21,"""9087C8746AC2D797"""
+"""30C7F7766F6AACFD_903084EB3C909966_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N([S](C=C)(=O)=O)C3CC3""",21,"""9087C8746AC2D797"""
+"""AD161151DCD9DA39_303704E8EA959099_6036_UN""","""C(CN1CCCC2=C1C=CC=C2)N3CC4(C[S]3(=O)=O)CC4""",21,"""9087C8746AC2D797"""
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+"""663B89B91B9CD996_BBD147D1F9B69519_6036_UN""","""C(C1=CC=CO1)(C2=CC=CC=C2)N(C)[S](=O)(=O)CCCN""",21,"""9239939CDE3CDB45"""
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+"""7AFE5030620C53B3_DC3328354C6F03AC_6036_UN""","""C(C1=CC=CO1)(C2=CC=CC=C2)N(C)[S](=O)(=O)CC(=O)C""",21,"""9239939CDE3CDB45"""
+"""73F0F97017983217_541B4E818AE130E1_6036_UN""","""C(C1=CC=CO1)(C2=CC=CC=C2)N3CCCC(C)[S]3(=O)=O""",21,"""9239939CDE3CDB45"""
+"""2AC93A5707E5B754_59F4686633D80B44_6036_UN""","""C(C1=CC=CO1)(C2=CC=CC=C2)N3CCC(C)(C)[S]3(=O)=O""",21,"""9239939CDE3CDB45"""
+"""D856521CEDBA8C40_625CC9A732EFF91B_6036_UN""","""C(C1=CC=CO1)(C2=CC=CC=C2)N([S](CC)(=O)=O)CCN""",21,"""9239939CDE3CDB45"""
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+"""C312433A567A0B44_FF1950027978EC55_6006_UN""","""OC(=O)C1=NC(=C(C=C1)[N](=O)=O)C2=CC=C(S2)C(F)(F)F""",21,"""962A52576B45C07A"""
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+"""D57F6BF9462C0464_7C792A0CC6670D19_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC3=C(C=C2)CCC3""",21,"""964FBE600462C374"""
+"""D6324EAF4EA65671_DCAB6AC0D90F77BB_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC=CC(=C2)C#CC""",21,"""964FBE600462C374"""
+"""FF51E9B5DB59E9B6_DCAFEEB2C8675C24_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC=CC(=C2)CSC""",21,"""964FBE600462C374"""
+"""DBFBCE10CD434BB7_5C415E9C6A707021_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""964FBE600462C374"""
+"""B396182036A063C5_041A5CB0CCE8820B_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CSC=C2C(F)(F)F""",21,"""964FBE600462C374"""
+"""F74AD174A4E14E31_2D11B9DA7C67878A_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC(=CC=C2)C(=O)O""",21,"""964FBE600462C374"""
+"""6A0FE27DA8703EB6_CF1D4CDB4956C809_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""964FBE600462C374"""
+"""6E59D97BCB5310CA_0CFDF98BE80FB91E_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=C(C=C(C)C=C2F)F""",21,"""964FBE600462C374"""
+"""2D90B3821F65EA65_B84687835F549845_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC=CC3=NON=C23""",21,"""964FBE600462C374"""
+"""770D1AEBE447CE9B_FF3CD9DB325ECB3D_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=C(C(=C(C)C=C2)F)F""",21,"""964FBE600462C374"""
+"""D2EE76E5610C70F0_BEF7921A38C3E6B9_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C3=C[N]2C=NN=C2C=C3""",21,"""964FBE600462C374"""
+"""7EBB9B2AA8006315_50C171D2BAFD3515_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC(=C(C=C2)F)OC""",21,"""964FBE600462C374"""
+"""302F629CA32D58AC_461C32637D68AA69_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=C(C=C(C)C=C2C)C""",21,"""964FBE600462C374"""
+"""C5E7C7B1CF4F38BE_33D76D2C3ABCCCE5_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=C(OC)C=CC=C2F""",21,"""964FBE600462C374"""
+"""71F8BA2C2DB1DD60_E384CD2F3462FBC9_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC=C(C(N)=O)C=C2""",21,"""964FBE600462C374"""
+"""5903B745AF23EA33_39FBE4138E751E7C_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC(=C(OC)C=C2)F""",21,"""964FBE600462C374"""
+"""5EB4474962E302A2_6153E7D6DE18F2A0_6006_DP""","""CCOC(=O)CC1=CC(=NC=C1)C3=C2[N](CCNC2)N=C3""",21,"""964FBE600462C374"""
+"""F74AD174A4E14E31_6D02858E25BEA7BB_6006_DP""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC=CC(=C2)C(O)=O""",21,"""964FBE600462C374"""
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+"""756637598DA19D7F_F33698C61F3D75A8_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=C(C=CC(=C2)OC)C""",21,"""964FBE600462C374"""
+"""5C9B3E906EB70005_E26E34217E7904A5_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C3=C2OC=CC2=CC=C3""",21,"""964FBE600462C374"""
+"""BE56678283EE57C3_5B9F30847F073093_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=C(OC)C=C(C=C2)F""",21,"""964FBE600462C374"""
+"""BB0F0760F344F03C_5BC22CCC21BCA65A_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC(=C(OC)C=C2)C""",21,"""964FBE600462C374"""
+"""C4F8C2C02A6DEE9D_4B85438496B0C9C5_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC=C(C(C)O)C=C2""",21,"""964FBE600462C374"""
+"""78E0E47AE04044CC_43A1FF3BA9948EE4_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=COC(=C2)C(F)(F)F""",21,"""964FBE600462C374"""
+"""EFA89288393B4C55_5D54B9BE1606D917_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC(=CS2)C(F)(F)F""",21,"""964FBE600462C374"""
+"""607F5794BFE85FF3_DEC5BB7A97E7EF0C_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CN=C(N(C)C)N=C2""",21,"""964FBE600462C374"""
+"""38E350EF2DBCC41E_0B4452EEA1FC37CF_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C3=CC2=C(C=CC=N2)S3""",21,"""964FBE600462C374"""
+"""F24BDCB429073B95_BC31D251A98F31B7_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=C(C(=CC=C2O)F)F""",21,"""964FBE600462C374"""
+"""C90168893D1947CF_5B72E8DBF8C932AD_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CSC3=C2C=CC=C3""",21,"""964FBE600462C374"""
+"""A92180865E218950_2474546E3FFE403A_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC=C[N]3N=CC=C23""",21,"""964FBE600462C374"""
+"""B0D5D74DD809AA2C_9DDE7DEFBEB8AB8D_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CN=C(C=C2)C(F)F""",21,"""964FBE600462C374"""
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+"""4B851B2B4DE3ADBF_A006DB10A8A50882_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""964FBE600462C374"""
+"""8579EAB096206938_5BC8DFB56786BD19_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""964FBE600462C374"""
+"""B190B893DB8F3C5A_FF7CBC35165FEF5B_6006_UN""","""CCOC(=O)CC1=CC(=NC=C1)C2=CC=C(S2)C(F)(F)F""",21,"""964FBE600462C374"""
+"""AC4D837A916EEE55_E81CBF49A510DDF0_6036_UN""","""CC(C)(CN([S](C)(=O)=O)CCCN)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""B57924F215CB9331_42E98BEFA5EC925E_6036_UN""","""CC(C)(CN([S](CC)(=O)=O)CCBr)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""504E3C2B63BC6223_4C657DC0B0A70CBF_6036_UN""","""CC(C)(CN(CCNC)[S](=O)(=O)C)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""68D43F1DBC5B5A80_B01F4184BBD6C1B5_6036_UN""","""CC(C)(CN([S](CCCC)(=O)=O)C)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""419FC704C95E6508_840CA3D96976BAEA_6036_UN""","""CC(C)(CN1C(C(C)(C)[S]1(=O)=O)=O)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""BF22AB850B6C7B2A_94EAB26BD844E327_6036_UN""","""CC(C)(CN([S](C)(=O)=O)CCC#C)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""2A71F683DF8CBED9_9DA8BCDE367BCE83_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)CCCCl)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""FAD6BB8C20734554_DC54F6DA306B5748_6036_UN""","""CC(C)(CN([S](CC)(=O)=O)CC#C)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""9B506A64A1EF7691_85871A8C53A8AE28_6036_UN""","""CC(C)(CN1[S](CCCC1=O)(=O)=O)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""7583A9DBCD96896A_57798614AC51907E_6036_UN""","""CC(C)(CN1C(C(N)C[S]1(=O)=O)=O)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""22CE6C44B6B850BD_72B0E197F2BE0DAA_6036_UN""","""CC(C)(CN([S](C)(=O)=O)C1CNC1)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""24DBC508ECC3DC2A_A8670E649058A285_6036_DP""","""CC(C)(CN[S](=O)(=O)C1(CC1)C#N)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""DD576750535CF836_BF6B57484FC9348D_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)CCCN)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""C5BC44EC36DDA397_167274ACF28DC0B2_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)C1COC1)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""941D6C2467180F75_7657A54E2E20702D_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)CCOC)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""A785DAF3460BB52A_D88938ACFA10A238_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)CC(=O)C)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""45A5FBB970E283C6_50A15E183C9E9175_6036_UN""","""CC(C)(CN1CCCC(C)[S]1(=O)=O)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""1AE59C6A211D27D2_5D4E78FF85A7AAD0_6036_UN""","""CC(C)(CN1CCC(C)(C)[S]1(=O)=O)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""9AE862F16C59D20E_66E6D93E8490588F_6036_UN""","""CC(C)(CN([S](CC)(=O)=O)CCN)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""8CDCCF5171FC2E82_274B4584BAD65E3B_6036_UN""","""CC(C)(CN(CC)[S](=O)(=O)CCN)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""9D79A3AAC7A9AA41_9DD8EE71BBC0AB76_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)C(C)(C)C)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""A220533818DC22BE_15E0DD1B796DBE4A_6036_UN""","""CC(C)(CN1[S](=O)(=O)C2(CC1)CC2)C3OCC(C)(C)CO3""",21,"""9683830568437AD1"""
+"""9EB13ABF1AFCB6A8_7AC64B26ECEBF614_6036_UN""","""CC(C)(CN([S](CCNC)(=O)=O)C)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""9EB13ABF1AFCB6A8_A636B1B01574FD32_6036_DP""","""CC(C)(CN(C)[S](=O)(=O)CCNC)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""9DD0C02FFB297C18_B78B355C6E4E3AE9_6036_UN""","""CC(C)(CN1[S](CCC1CI)(=O)=O)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""1E08A0DCBCC959EB_2B8D9E9414403424_6036_UN""","""CC(C)(CN1C(CN)CC[S]1(=O)=O)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""896AB78F697320E8_B8DA416E6C8A995C_6036_UN""","""CC(C)(CN(CC(C)C)[S](=O)(=O)C)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""B767BA5D00FDC04B_24D3D4C41580F48B_6036_UN""","""CC(C)(CN1[S](=O)(CCNCC1)=O)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""6BFAC13D6B950A51_9634CF9A3E113420_6036_UN""","""CC(C)(CN([S](C=C)(=O)=O)C1CC1)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""86EB1F9EA42BD62C_36334F99E8143DDF_6036_UN""","""CC(C)(CN1CC2(C[S]1(=O)=O)CC2)C3OCC(C)(C)CO3""",21,"""9683830568437AD1"""
+"""79C29AA1A0E96E5C_FA783CA8E04B2C9D_6036_UN""","""CC(C)(CN([S](C)(=O)=O)C(=O)CN)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""78D7BECC95C1B060_18FB729E303E1353_6036_UN""","""CC(C)(CN1CCCCC[S]1(=O)=O)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""9B7F860BB736ED7E_0A50EE783276DD0F_6036_UN""","""CC(C)(CN([S](C)(=O)=O)CCCBr)C1OCC(C)(C)CO1""",21,"""9683830568437AD1"""
+"""4DA8299EFE6CC571_5A53EF258B12D9DD_6003_UN""","""CC(C)(COC1=CC=C(C=C1)C#N)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""34B387C778E10671_6573152DCA8A64FC_6003_UN""","""CC(C)(COC1=CC=CC=C1[N+]#[C-])C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""DB89D82F09704172_6224E05FABC7595E_6003_UN""","""CC(C)(COC1=CC=CC=C1C#N)C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""776C743C468A5AA1_8AA4423B35397022_6003_UN""","""CC(C)(COC1=CC=C(C=C1)[N+]#[C-])C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""E5854534CFD57C2F_049FC7D98A14A75C_6003_UN""","""CC(C)(COC1=CC=CC(=C1)[N+]#[C-])C2OCC(C)(C)CO2""",21,"""9683830568437AD1"""
+"""549F8642B4B52F04_F3224FCF21219964_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC(=C(C(=C3)F)F)F""",21,"""9696BB0414CB49F0"""
+"""3032F157A48D81EE_DE23E85906D7AC58_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC=C(C(C)C)C=C3""",21,"""9696BB0414CB49F0"""
+"""BC2CB9EB0BF5C9AE_7CA02F68D6CE879D_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC4=C(C=C3)CCC4""",21,"""9696BB0414CB49F0"""
+"""BB987C58711D9144_DC726FA4C9A6FD3F_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC=CC(=C3)C#CC""",21,"""9696BB0414CB49F0"""
+"""8044F1650447E675_DC76EBD6D8CED6A0_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC=CC(=C3)CSC""",21,"""9696BB0414CB49F0"""
+"""7D9B9EE654133078_5C985BF87AD9FAA5_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CN=C(C=C3)[N](=O)=O""",21,"""9696BB0414CB49F0"""
+"""5C7ACEE519620F0B_04C359D4DC41088F_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CSC=C3C(F)(F)F""",21,"""9696BB0414CB49F0"""
+"""805FDBAD7133F734_2DC8BCBE6CCE0D0E_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC(=CC=C3)C(=O)O""",21,"""9696BB0414CB49F0"""
+"""9F36EA06C6A3CABD_CFC449BF59FF428D_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C4=C3[NH]C=CC3=CC=C4""",21,"""9696BB0414CB49F0"""
+"""97F48CA79E6D9709_0C24FCEFF8A6339A_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=C(C=C(C)C=C3F)F""",21,"""9696BB0414CB49F0"""
+"""AC77AA9157455499_B89F82E74FFD12C1_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC=CC4=NON=C34""",21,"""9696BB0414CB49F0"""
+"""CD1AEB38722A542E_FFE5DCBF22F741B9_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=C(C(=C(C)C=C3)F)F""",21,"""9696BB0414CB49F0"""
+"""AD2A09004C8C1893_BE2E977E286A6C3D_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C4=C[N]3C=NN=C3C=C4""",21,"""9696BB0414CB49F0"""
+"""EC69EA50038D8605_501874B6AA54BF91_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC(=C(C=C3)F)OC""",21,"""9696BB0414CB49F0"""
+"""AF13BE8E95FC5D17_46C537076DC120ED_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=C(C=C(C)C=C3C)C""",21,"""9696BB0414CB49F0"""
+"""7E14F4E37D4F7285_330E68482A154661_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=C(OC)C=CC=C3F""",21,"""9696BB0414CB49F0"""
+"""4DF3126B21881002_E35DC84B24CB714D_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC=C(C(N)=O)C=C3""",21,"""9696BB0414CB49F0"""
+"""6985265B8F9EA029_3922E1779EDC94F8_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC(=C(OC)C=C3)F""",21,"""9696BB0414CB49F0"""
+"""16FA6A553D9559FD_618AE2B2CEB17824_6006_DP""","""CCCC2=NC1=NC=N[N]1C(=C2)C4=C3[N](CCNC3)N=C4""",21,"""9696BB0414CB49F0"""
+"""805FDBAD7133F734_6DDB80EA35172D3F_6006_DP""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC=CC(=C3)C(O)=O""",21,"""9696BB0414CB49F0"""
+"""77DAA70681A5A79F_4470EADCC7653D44_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC=CC(=C3F)OC""",21,"""9696BB0414CB49F0"""
+"""AD5CD7724B6723B4_F3EF9DA20F94FF2C_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=C(C=CC(=C3)OC)C""",21,"""9696BB0414CB49F0"""
+"""6E0DFF725357E5AE_E2B731456ED08E21_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C4=C3OC=CC3=CC=C4""",21,"""9696BB0414CB49F0"""
+"""6419937C8BCC6618_5B4635E06FAEBA17_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=C(OC)C=C(C=C3)F""",21,"""9696BB0414CB49F0"""
+"""5735E934F00E830E_5B1B29A831152CDE_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC(=C(OC)C=C3)C""",21,"""9696BB0414CB49F0"""
+"""F60BB5A18134EA16_4B5C46E086194341_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC=C(C(C)O)C=C3""",21,"""9696BB0414CB49F0"""
+"""CD85314A6CF2A91B_4378FA5FB93D0460_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=COC(=C3)C(F)(F)F""",21,"""9696BB0414CB49F0"""
+"""F14A49C501512DA1_5D8DBCDA06AF5393_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC(=CS3)C(F)(F)F""",21,"""9696BB0414CB49F0"""
+"""B5A43D0FE9CF49C4_DE1CBE1E874E6588_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CN=C(N(C)C)N=C3""",21,"""9696BB0414CB49F0"""
+"""06DF8CE28ACEDCF3_0B9D578AB155BD4B_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C4=CC3=C(C=CC=N3)S4""",21,"""9696BB0414CB49F0"""
+"""41F6D7AAC02154FF_BCE8D735B926BB33_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=C(C(=CC=C3O)F)F""",21,"""9696BB0414CB49F0"""
+"""519D7F610F6A0DEF_5BABEDBFE860B829_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CSC4=C3C=CC=C4""",21,"""9696BB0414CB49F0"""
+"""41CBCB74257E1492_24AD510A2F57CABE_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CC=C[N]4N=CC=C34""",21,"""9696BB0414CB49F0"""
+"""B464794264D52113_9D07788BAE112109_6006_UN""","""CCCC2=NC1=NC=N[N]1C(=C2)C3=CN=C(C=C3)C(F)F""",21,"""9696BB0414CB49F0"""
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+"""B00ABE6C7C3B389C_15AD99972A1927E7_6036_UN""","""CCN3CCN(CCCCN1[S](=O)(=O)C2(CC1)CC2)CC3""",21,"""96CEC7893B37E37C"""
+"""77FCAC856DA349B8_7A8B0FAABF9F6FB9_6036_UN""","""CCN1CCN(CCCCN([S](CCNC)(=O)=O)C)CC1""",21,"""96CEC7893B37E37C"""
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+"""711E2C49F733A13F_0A1DAAF4610244A2_6036_UN""","""CCN1CCN(CCCCN([S](C)(=O)=O)CCCBr)CC1""",21,"""96CEC7893B37E37C"""
+"""A4C761DCEB897B29_5A1EABA9D8664070_6003_UN""","""CCN2CCN(CCCCOC1=CC=C(C=C1)C#N)CC2""",21,"""96CEC7893B37E37C"""
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+"""C46C0A25B5DBB6FE_6269A4D3F8B3C0F3_6003_UN""","""CCN2CCN(CCCCOC1=CC=CC=C1C#N)CC2""",21,"""96CEC7893B37E37C"""
+"""3C0683EBF15A0431_8AE906B7664DE98F_6003_UN""","""CCN2CCN(CCCCOC1=CC=C(C=C1)[N+]#[C-])CC2""",21,"""96CEC7893B37E37C"""
+"""1DAF780985893651_04D28355D9603EF1_6003_UN""","""CCN2CCN(CCCCOC1=CC=CC(=C1)[N+]#[C-])CC2""",21,"""96CEC7893B37E37C"""
+"""71AF81CF723911AB_E90CB40C39C18A3A_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N([S](C)(=O)=O)CCCN""",21,"""97938840F4922D1B"""
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+"""B52115CB5AE6269E_4D7576852C765B75_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N(CCNC)[S](=O)(=O)C""",21,"""97938840F4922D1B"""
+"""13B243A140EE6BFB_B10F4AC12707967F_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N([S](CCCC)(=O)=O)C""",21,"""97938840F4922D1B"""
+"""5AA25A01B5830FBA_851CA89CF5A7ED20_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""97938840F4922D1B"""
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+"""58AC2011353A0228_9CB8B79BAAAA9949_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N(C)[S](=O)(=O)CCCCl""",21,"""97938840F4922D1B"""
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+"""29A0208AD30793CA_73A0EAD26E6F5A60_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N([S](C)(=O)=O)C3CNC3""",21,"""97938840F4922D1B"""
+"""3C356E97F9DD78FB_A97705210C89F54F_6036_DP""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N[S](=O)(=O)C3(CC3)C#N""",21,"""97938840F4922D1B"""
+"""647DF5FA1558EFD6_BE7B5C0DD3186347_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N(C)[S](=O)(=O)CCCN""",21,"""97938840F4922D1B"""
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+"""6E7485E4AA1B09AB_7747AE0BB2F127E7_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N(C)[S](=O)(=O)CCOC""",21,"""97938840F4922D1B"""
+"""A015CA4906C63CA3_D99933E966C1F5F2_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N(C)[S](=O)(=O)CC(=O)C""",21,"""97938840F4922D1B"""
+"""E29A8A492E48979D_51B1555DA04FC6BF_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N3CCCC(C)[S]3(=O)=O""",21,"""97938840F4922D1B"""
+"""0CF72F653E993262_5C5E73BA1976FD1A_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N3CCC(C)(C)[S]3(=O)=O""",21,"""97938840F4922D1B"""
+"""D26E952E360C6D15_67F6D27B18410F45_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N([S](CC)(=O)=O)CCN""",21,"""97938840F4922D1B"""
+"""4BC2538BDCC1351D_265B4EC1260709F1_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N(CC)[S](=O)(=O)CCN""",21,"""97938840F4922D1B"""
+"""28D4516B1A126286_9CC8E5342711FCBC_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""97938840F4922D1B"""
+"""B4BDE56D850EEBE4_14F0D65EE5BCE980_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""97938840F4922D1B"""
+"""A4D228121E596E83_7BD64063703AA1DE_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N([S](CCNC)(=O)=O)C""",21,"""97938840F4922D1B"""
+"""A4D228121E596E83_A726BAF589A5AAF8_6036_DP""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N(C)[S](=O)(=O)CCNC""",21,"""97938840F4922D1B"""
+"""8036456A71FFB006_B69B3E19F29F6D23_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N3[S](CCC3CI)(=O)=O""",21,"""97938840F4922D1B"""
+"""26DE0B73F038CE76_2A9D95D1889163EE_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N3C(CN)CC[S]3(=O)=O""",21,"""97938840F4922D1B"""
+"""B326AA6AC6DE75E3_B9CA4A2BF05BCE96_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N(CC(C)C)[S](=O)(=O)C""",21,"""97938840F4922D1B"""
+"""82F9811EC0B5B7D7_25C3DF818951A341_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N3[S](=O)(CCNCC3)=O""",21,"""97938840F4922D1B"""
+"""FCCD2BF5C80D5C7E_9724C4DFA2C063EA_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N([S](C=C)(=O)=O)C3CC3""",21,"""97938840F4922D1B"""
+"""38102AB0570E4F2E_372344DC74C56A15_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N3CC4(C[S]3(=O)=O)CC4""",21,"""97938840F4922D1B"""
+"""E7CD6D9EB9F94849_FB6837ED7C9A7B57_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N([S](C)(=O)=O)C(=O)CN""",21,"""97938840F4922D1B"""
+"""1D4869D53686FEC3_19EB79DBACEF4499_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N3CCCCC[S]3(=O)=O""",21,"""97938840F4922D1B"""
+"""FA64A8FED45C1346_0B40E53DAEA78AC5_6036_UN""","""C(C1=NC=C[NH]1)(C2=CN=CC=C2)N([S](C)(=O)=O)CCCBr""",21,"""97938840F4922D1B"""
+"""E2C44E85243A4F8B_5B43E46017C38E17_6003_UN""","""O(C(C1=NC=C[NH]1)C2=CN=CC=C2)C3=CC=C(C=C3)C#N""",21,"""97938840F4922D1B"""
+"""7FF8E9C5F63FE0A3_64631E68565B3336_6003_UN""","""O(C(C1=NC=C[NH]1)C2=CN=CC=C2)C3=CC=CC=C3[N+]#[C-]""",21,"""97938840F4922D1B"""
+"""EB9B10EB294CF7A2_6334EB1A37160E94_6003_UN""","""O(C(C1=NC=C[NH]1)C2=CN=CC=C2)C3=CC=CC=C3C#N""",21,"""97938840F4922D1B"""
+"""1AD138B7AA5D35CF_8BB4497EA9E827E8_6003_UN""","""O(C(C1=NC=C[NH]1)C2=CN=CC=C2)C3=CC=C(C=C3)[N+]#[C-]""",21,"""97938840F4922D1B"""
+"""D2F28D12B478A127_058FCC9C16C5F096_6003_UN""","""O(C(C1=NC=C[NH]1)C2=CN=CC=C2)C3=CC=CC(=C3)[N+]#[C-]""",21,"""97938840F4922D1B"""
+"""1EDEB6236370B895_F24BDE9562FD2659_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""97FF2A5E5717F6CD"""
+"""32ED95C1E86CB159_DF4A7903450B1365_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC=C(C(C)C)C=C2""",21,"""97FF2A5E5717F6CD"""
+"""99E7A3C8F9CE2AFD_7DC9BE32951238A0_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC3=C(C=C2)CCC3""",21,"""97FF2A5E5717F6CD"""
+"""45BA525AFC00484E_DD1BFEFE8A7A4202_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC=CC(=C2)C#CC""",21,"""97FF2A5E5717F6CD"""
+"""9D65FA211E836EB1_DD1F7A8C9B12699D_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC=CC(=C2)CSC""",21,"""97FF2A5E5717F6CD"""
+"""E7D09AF7132E6F7F_5DF1CAA239054598_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""97FF2A5E5717F6CD"""
+"""CAC8699D92D5B5FA_05AAC88E9F9DB7B2_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CSC=C2C(F)(F)F""",21,"""97FF2A5E5717F6CD"""
+"""9960724F9A9FD14C_2CA12DE42F12B233_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC(=CC=C2)C(=O)O""",21,"""97FF2A5E5717F6CD"""
+"""8AE0F95EAFD4AFDC_CEADD8E51A23FDB0_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""97FF2A5E5717F6CD"""
+"""D45C00EB70B29780_0D4D6DB5BB7A8CA7_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=C(C=C(C)C=C2F)F""",21,"""97FF2A5E5717F6CD"""
+"""01B30283CED71783_B9F613BD0C21ADFC_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC=CC3=NON=C23""",21,"""97FF2A5E5717F6CD"""
+"""683205D67294505E_FE8C4DE5612BFE84_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=C(C(=C(C)C=C2)F)F""",21,"""97FF2A5E5717F6CD"""
+"""9ED0637809BAF0BA_BF4706246BB6D300_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C3=C[N]2C=NN=C2C=C3""",21,"""97FF2A5E5717F6CD"""
+"""05B3521421EC402A_5171E5ECE98800AC_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC(=C(C=C2)F)OC""",21,"""97FF2A5E5717F6CD"""
+"""75494F8140EC3F2F_47ACA65D2E1D9FD0_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=C(C=C(C)C=C2C)C""",21,"""97FF2A5E5717F6CD"""
+"""8F7C35226DD04C9B_3267F91269C9F95C_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=C(OC)C=CC=C2F""",21,"""97FF2A5E5717F6CD"""
+"""B131C91551903ADC_E23459116717CE70_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC=C(C(N)=O)C=C2""",21,"""97FF2A5E5717F6CD"""
+"""F9E233B514648CC7_384B702DDD002BC5_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC(=C(OC)C=C2)F""",21,"""97FF2A5E5717F6CD"""
+"""15D5C8D5D0BE6108_60E373E88D6DC719_6006_DP""","""CCCC(C)OC1=NC(=CC=C1)C3=C2[N](CCNC2)N=C3""",21,"""97FF2A5E5717F6CD"""
+"""9960724F9A9FD14C_6CB211B076CB9202_6006_DP""","""CCCC(C)OC1=NC(=CC=C1)C2=CC=CC(=C2)C(O)=O""",21,"""97FF2A5E5717F6CD"""
+"""056188840561BB08_45197B8684B98279_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC=CC(=C2F)OC""",21,"""97FF2A5E5717F6CD"""
+"""475A085D56EA4F9C_F2860CF84C484011_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=C(C=CC(=C2)OC)C""",21,"""97FF2A5E5717F6CD"""
+"""5FAA87CB4435BDFD_E3DEA01F2D0C311C_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C3=C2OC=CC2=CC=C3""",21,"""97FF2A5E5717F6CD"""
+"""83F6A39329B56139_5A2FA4BA2C72052A_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=C(OC)C=C(C=C2)F""",21,"""97FF2A5E5717F6CD"""
+"""67AA74CE3B591C12_5A72B8F272C993E3_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC(=C(OC)C=C2)C""",21,"""97FF2A5E5717F6CD"""
+"""9BAEADF98E1FFCBB_4A35D7BAC5C5FC7C_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC=C(C(C)O)C=C2""",21,"""97FF2A5E5717F6CD"""
+"""5B8EACF123C3D71B_42116B05FAE1BB5D_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=COC(=C2)C(F)(F)F""",21,"""97FF2A5E5717F6CD"""
+"""1B3101FCA479A646_5CE42D804573ECAE_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC(=CS2)C(F)(F)F""",21,"""97FF2A5E5717F6CD"""
+"""5CB5DD3DCEF956F3_DF752F44C492DAB5_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CN=C(N(C)C)N=C2""",21,"""97FF2A5E5717F6CD"""
+"""639C8F4783048BD6_0AF4C6D0F2890276_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C3=CC2=C(C=CC=N2)S3""",21,"""97FF2A5E5717F6CD"""
+"""D1D33ACCF21F2504_BD81466FFAFA040E_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=C(C(=CC=C2O)F)F""",21,"""97FF2A5E5717F6CD"""
+"""9A9605263475BC0B_5AC27CE5ABBC0714_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CSC3=C2C=CC=C3""",21,"""97FF2A5E5717F6CD"""
+"""4B404E977C07E71A_25C4C0506C8B7583_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC=C[N]3N=CC=C23""",21,"""97FF2A5E5717F6CD"""
+"""18206F01C5DEBEEE_9C6EE9D1EDCD9E34_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CN=C(C=C2)C(F)F""",21,"""97FF2A5E5717F6CD"""
+"""C3D5BAB55BA3FBE1_F77535DACFAA6EB8_6006_UN""","""CCCC(C)OC1=NC(=CC=C1)C2=CC3=C(C=C2)CCO3""",21,"""97FF2A5E5717F6CD"""
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+"""B6D71F89D37F343D_ED0EF6211F97083F_6006_UN""","""COC1=C(C=C(C(=C1)C3=C2OC=CC2=CC=C3)[N](=O)=O)C""",21,"""992F7C60658CCFEE"""
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+"""640A6FF8E234F340_4CC13D3BC87A827E_6006_UN""","""COC1=C(C=C(C(=C1)C2=COC(=C2)C(F)(F)F)[N](=O)=O)C""",21,"""992F7C60658CCFEE"""
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+"""69524B40EA67EF16_54122ADB99273E37_6006_UN""","""COC1=C(C=C(C(=C1)C2=CSC3=C2C=CC=C3)[N](=O)=O)C""",21,"""992F7C60658CCFEE"""
+"""F477760050A8754C_2B14966E5E104CA0_6006_UN""","""COC1=C(C=C(C(=C1)C2=CC=C[N]3N=CC=C23)[N](=O)=O)C""",21,"""992F7C60658CCFEE"""
+"""D3635252B2A272AD_92BEBFEFDF56A717_6006_UN""","""COC1=C(C=C(C(=C1)C2=CN=C(C=C2)C(F)F)[N](=O)=O)C""",21,"""992F7C60658CCFEE"""
+"""0B1EE448543D46DA_F9A563E4FD31579B_6006_UN""","""COC1=C(C=C(C(=C1)C2=CC3=C(C=C2)CCO3)[N](=O)=O)C""",21,"""992F7C60658CCFEE"""
+"""66C512EA34D6725F_AF661910C94B0418_6006_UN""","""COC1=C(C=C(C(=C1)C2=CC=C(C=C2)[N](=O)=O)[N](=O)=O)C""",21,"""992F7C60658CCFEE"""
+"""1B49853D6E2AEEC1_54A81DB50668B183_6006_UN""","""COC1=C(C=C(C(=C1)C2=CC3=C(C=C2)C=N[NH]3)[N](=O)=O)C""",21,"""992F7C60658CCFEE"""
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+"""763B07B52EBF8351_FC84C2311923567C_6006_UN""","""COCC2=NC1=NC=N[N]1C(=C2)C3=CC(=C(C(=C3)F)F)F""",21,"""993036FA2CC986E8"""
+"""BC36F5934BFD7506_D18565A73ED56340_6006_UN""","""COCC2=NC1=NC=N[N]1C(=C2)C3=CC=C(C(C)C)C=C3""",21,"""993036FA2CC986E8"""
+"""F7805EADABF23FA9_7306A296EECC4885_6006_UN""","""COCC2=NC1=NC=N[N]1C(=C2)C3=CC4=C(C=C3)CCC4""",21,"""993036FA2CC986E8"""
+"""ABD54A4382181358_D3D4E25AF1A43227_6006_UN""","""COCC2=NC1=NC=N[N]1C(=C2)C3=CC=CC(=C3)C#CC""",21,"""993036FA2CC986E8"""
+"""AB4ED77B98226DF4_D3D06628E0CC19B8_6006_UN""","""COCC2=NC1=NC=N[N]1C(=C2)C3=CC=CC(=C3)CSC""",21,"""993036FA2CC986E8"""
+"""C3202AAD5673C145_533ED60642DB35BD_6006_UN""","""COCC2=NC1=NC=N[N]1C(=C2)C3=CN=C(C=C3)[N](=O)=O""",21,"""993036FA2CC986E8"""
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+"""9BEE7896B7A27CA7_B00247254D13006E_6006_UN""","""COC2=C1C(=NC=NC1=CC=C2)C3=C(C(=CC=C3O)F)F""",21,"""9A7C2B14E0FEF2AD"""
+"""DE18729FA271C606_57417DAF1C550374_6006_UN""","""COC2=C1C(=NC=NC1=CC=C2)C3=CSC4=C3C=CC=C4""",21,"""9A7C2B14E0FEF2AD"""
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+"""9A628CA32BC43120_AC354E644C39395B_6006_UN""","""COC2=C1C(=NC=NC1=CC=C2)C3=CC=C(C=C3)[N](=O)=O""",21,"""9A7C2B14E0FEF2AD"""
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+"""AAED3F39F2A2C7C4_F34F2941F2C3DE82_6006_UN""","""COC2=C1C(=NC=NC1=CC=C2)C3=CC=C(S3)C(F)(F)F""",21,"""9A7C2B14E0FEF2AD"""
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+"""231D546847C38DC0_70E414B081EC8EAE_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC3=C(C=C2)CCC3""",21,"""9AD280DC43E940C3"""
+"""002CF5E199524DD7_D036547C9E84F40C_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC=CC(=C2)C#CC""",21,"""9AD280DC43E940C3"""
+"""C481B21379CF235C_D032D00E8FECDF93_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC=CC(=C2)CSC""",21,"""9AD280DC43E940C3"""
+"""484A0C69DA7AAA17_50DC60202DFBF396_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""9AD280DC43E940C3"""
+"""6B59168C8D95BC89_0887620C8B6301BC_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CSC=C2C(F)(F)F""",21,"""9AD280DC43E940C3"""
+"""1025B2938C09365B_218C87663BEC043D_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC(=CC=C2)C(=O)O""",21,"""9AD280DC43E940C3"""
+"""86AA7AA4A6E21A91_C38072670EDD4BBE_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""9AD280DC43E940C3"""
+"""14F5AE57ACA6EA7E_0060C737AF843AA9_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=C(C=C(C)C=C2F)F""",21,"""9AD280DC43E940C3"""
+"""8906404BD01C47DE_B4DBB93F18DF1BF2_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC=CC3=NON=C23""",21,"""9AD280DC43E940C3"""
+"""93AE712D813B377B_F3A1E76775D5488A_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=C(C(=C(C)C=C2)F)F""",21,"""9AD280DC43E940C3"""
+"""EF028CFDA889B81A_B26AACA67F48650E_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C3=C[N]2C=NN=C2C=C3""",21,"""9AD280DC43E940C3"""
+"""AB07EACB2A05A612_5C5C4F6EFD76B6A2_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC(=C(C=C2)F)OC""",21,"""9AD280DC43E940C3"""
+"""580EFEE16CA56F3F_4A810CDF3AE329DE_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=C(C=C(C)C=C2C)C""",21,"""9AD280DC43E940C3"""
+"""0A9334C49BEF247A_3F4A53907D374F52_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=C(OC)C=CC=C2F""",21,"""9AD280DC43E940C3"""
+"""850CF8CFB2509E4C_EF19F39373E9787E_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC=C(C(N)=O)C=C2""",21,"""9AD280DC43E940C3"""
+"""EA6D672E5BD80376_3566DAAFC9FE9DCB_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC(=C(OC)C=C2)F""",21,"""9AD280DC43E940C3"""
+"""9A10101EF7C16870_6DCED96A99937117_6006_DP""","""CC(=O)CC(=O)C1=CC(=CC=C1)C3=C2[N](CCNC2)N=C3""",21,"""9AD280DC43E940C3"""
+"""1025B2938C09365B_619FBB326235240C_6006_DP""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC=CC(=C2)C(O)=O""",21,"""9AD280DC43E940C3"""
+"""F06970BE3C237B18_4834D10490473477_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC=CC(=C2F)OC""",21,"""9AD280DC43E940C3"""
+"""A4E3415244D2B621_FFABA67A58B6F61F_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=C(C=CC(=C2)OC)C""",21,"""9AD280DC43E940C3"""
+"""8F6D0D5D4E5DD229_EEF30A9D39F28712_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C3=C2OC=CC2=CC=C3""",21,"""9AD280DC43E940C3"""
+"""5F35B044C9F8BD4E_57020E38388CB324_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=C(OC)C=C(C=C2)F""",21,"""9AD280DC43E940C3"""
+"""79BF10588F72F628_575F1270663725ED_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC(=C(OC)C=C2)C""",21,"""9AD280DC43E940C3"""
+"""A86AB5E722DAAA5F_47187D38D13B4A72_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC=C(C(C)O)C=C2""",21,"""9AD280DC43E940C3"""
+"""4AFA34C431DB86FC_4F3CC187EE1F0D53_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=COC(=C2)C(F)(F)F""",21,"""9AD280DC43E940C3"""
+"""9412EBDC80B622A2_51C98702518D5AA0_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC(=CS2)C(F)(F)F""",21,"""9AD280DC43E940C3"""
+"""81ACA4B23C84DA73_D25885C6D06C6CBB_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CN=C(N(C)C)N=C2""",21,"""9AD280DC43E940C3"""
+"""51FA00C9F51D437C_07D96C52E677B478_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C3=CC2=C(C=CC=N2)S3""",21,"""9AD280DC43E940C3"""
+"""76BAA8929F3BA7AE_B0ACECEDEE04B200_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=C(C(=CC=C2O)F)F""",21,"""9AD280DC43E940C3"""
+"""C686EEB31421A711_57EFD667BF42B11A_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CSC3=C2C=CC=C3""",21,"""9AD280DC43E940C3"""
+"""FF66CE1E5C2ED32E_28E96AD27875C38D_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC=C[N]3N=CC=C23""",21,"""9AD280DC43E940C3"""
+"""40DF05002F431039_91434353F933283A_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CN=C(C=C2)C(F)F""",21,"""9AD280DC43E940C3"""
+"""0D8084D91C0A5BED_FA589F58DB54D8B6_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC3=C(C=C2)CCO3""",21,"""9AD280DC43E940C3"""
+"""345524A6A1B37CAF_AC9BE5ACEF2E8B35_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""9AD280DC43E940C3"""
+"""E7640F47F415E306_5755E109200D3EAE_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""9AD280DC43E940C3"""
+"""D183AAA462F1AE23_F3E1828951D46CEC_6006_UN""","""CC(=O)CC(=O)C1=CC(=CC=C1)C2=CC=C(S2)C(F)(F)F""",21,"""9AD280DC43E940C3"""
+"""3CF981B7E641568A_E5AF988F82A36FF6_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](C)(=O)=O)CCCN""",21,"""9B30A4C34FF0C8D7"""
+"""4DAE42699439BDA9_4F5AAC29825F2058_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](CC)(=O)=O)CCBr""",21,"""9B30A4C34FF0C8D7"""
+"""152C66447466DB46_41D65A069714BEB9_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N(CCNC)[S](=O)(=O)C""",21,"""9B30A4C34FF0C8D7"""
+"""7982A0EB1939D218_BDAC66429C6573B3_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](CCCC)(=O)=O)C""",21,"""9B30A4C34FF0C8D7"""
+"""F1A392815F42F18D_89BF841F4EC508EC_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""9B30A4C34FF0C8D7"""
+"""5BC7EEFA7828BCB9_995995ADFFF75121_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](C)(=O)=O)CCC#C""",21,"""9B30A4C34FF0C8D7"""
+"""1A288AE91B85A22B_901B9B1811C87C85_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N(C)[S](=O)(=O)CCCCl""",21,"""9B30A4C34FF0C8D7"""
+"""F3FDDFFA9106F9DC_D1E7D11C17D8E54E_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](CC)(=O)=O)CC#C""",21,"""9B30A4C34FF0C8D7"""
+"""963CFF28689DABBF_88343D4A741B1C2E_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2[S](CCCC2=O)(=O)=O""",21,"""9B30A4C34FF0C8D7"""
+"""BA0C2DE51743720F_5ACAA1D28BE22278_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2C(C(N)C[S]2(=O)=O)=O""",21,"""9B30A4C34FF0C8D7"""
+"""65120BFA2CE29D79_7F03C651D50DBFAC_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](C)(=O)=O)C2CNC2""",21,"""9B30A4C34FF0C8D7"""
+"""66A308C762FBA612_A5D429A2B7EB1083_6036_DP""","""CC(C1=NC=C(C=C1)C(F)(F)F)N[S](=O)(=O)C2(CC2)C#N""",21,"""9B30A4C34FF0C8D7"""
+"""1B533AE9C1DA8E16_B2D8708E687A868B_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N(C)[S](=O)(=O)CCCN""",21,"""9B30A4C34FF0C8D7"""
+"""35F847A10136E659_1BC1536AD53E72B4_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N(C)[S](=O)(=O)C2COC2""",21,"""9B30A4C34FF0C8D7"""
+"""C92F140C7F91C5E2_7BE482880993C22B_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N(C)[S](=O)(=O)CCOC""",21,"""9B30A4C34FF0C8D7"""
+"""B3F39F6AD0D68257_D53A1F6ADDA3103E_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N(C)[S](=O)(=O)CC(=O)C""",21,"""9B30A4C34FF0C8D7"""
+"""B4266BBBAD7FA1EE_5D1279DE1B2D2373_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2CCCC(C)[S]2(=O)=O""",21,"""9B30A4C34FF0C8D7"""
+"""F1DEAF0F3155BE68_50FD5F39A21418D6_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2CCC(C)(C)[S]2(=O)=O""",21,"""9B30A4C34FF0C8D7"""
+"""76126B4F7F6D857E_6B55FEF8A323EA89_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](CC)(=O)=O)CCN""",21,"""9B30A4C34FF0C8D7"""
+"""DCAA50D5DE0E1008_2AF862429D65EC3D_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N(CC)[S](=O)(=O)CCN""",21,"""9B30A4C34FF0C8D7"""
+"""30800600188430C0_906BC9B79C731970_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N(C)[S](=O)(=O)C(C)(C)C""",21,"""9B30A4C34FF0C8D7"""
+"""2C91649B58E05239_1853FADD5EDE0C4C_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2[S](=O)(=O)C3(CC2)CC3""",21,"""9B30A4C34FF0C8D7"""
+"""6A3E650A234B520E_77756CE0CB584412_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](CCNC)(=O)=O)C""",21,"""9B30A4C34FF0C8D7"""
+"""6A3E650A234B520E_AB85967632C74F34_6036_DP""","""CC(C1=NC=C(C=C1)C(F)(F)F)N(C)[S](=O)(=O)CCNC""",21,"""9B30A4C34FF0C8D7"""
+"""8878481E9FAB50A6_BA38129A49FD88EF_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2[S](CCC2CI)(=O)=O""",21,"""9B30A4C34FF0C8D7"""
+"""03AED09A92C3A411_263EB95233F38622_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2C(CN)CC[S]2(=O)=O""",21,"""9B30A4C34FF0C8D7"""
+"""B34837B03BBD2420_B56966A84B392B5A_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N(CC(C)C)[S](=O)(=O)C""",21,"""9B30A4C34FF0C8D7"""
+"""38D8C8A979008327_2960F3023233468D_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2[S](=O)(CCNCC2)=O""",21,"""9B30A4C34FF0C8D7"""
+"""4586E98E4DEFA8AC_9B87E85C19A28626_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](C=C)(=O)=O)C2CC2""",21,"""9B30A4C34FF0C8D7"""
+"""F20BF72ADEAD9259_3B80685FCFA78FD9_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2CC3(C[S]2(=O)=O)CC3""",21,"""9B30A4C34FF0C8D7"""
+"""68D624ADED8BC606_F7CB1B6EC7F89E9B_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](C)(=O)=O)C(=O)CN""",21,"""9B30A4C34FF0C8D7"""
+"""126F7EC9D3FF912C_15485558178DA155_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N2CCCCC[S]2(=O)=O""",21,"""9B30A4C34FF0C8D7"""
+"""418DBD2CC43351F5_07E3C9BE15C56F09_6036_UN""","""CC(C1=NC=C(C=C1)C(F)(F)F)N([S](C)(=O)=O)CCCBr""",21,"""9B30A4C34FF0C8D7"""
+"""7E4472441C11DE3B_57E0C8E3ACA16BDB_6003_UN""","""CC(OC1=CC=C(C=C1)C#N)C2=NC=C(C=C2)C(F)(F)F""",21,"""9B30A4C34FF0C8D7"""
+"""FF118C0DEDEAC0F6_68C032EBED39D6FA_6003_UN""","""CC(OC1=CC=CC=C1[N+]#[C-])C2=NC=C(C=C2)C(F)(F)F""",21,"""9B30A4C34FF0C8D7"""
+"""8C3071ABF5FC4E07_6F97C7998C74EB58_6003_UN""","""CC(OC1=CC=CC=C1C#N)C2=NC=C(C=C2)C(F)(F)F""",21,"""9B30A4C34FF0C8D7"""
+"""6DCD015DB94E7570_871765FD128AC224_6003_UN""","""CC(OC1=CC=C(C=C1)[N+]#[C-])C2=NC=C(C=C2)C(F)(F)F""",21,"""9B30A4C34FF0C8D7"""
+"""AEE0D81C3C197999_092CE01FADA7155A_6003_UN""","""CC(OC1=CC=CC(=C1)[N+]#[C-])C2=NC=C(C=C2)C(F)(F)F""",21,"""9B30A4C34FF0C8D7"""
+"""C7D064251ABF931D_E5ABD997EFCEF7DB_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](C)(=O)=O)CCCN""",21,"""9B34E5DB229D50FA"""
+"""B6FFCA9EF306865D_4F5EED31EF32B875_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](CC)(=O)=O)CCBr""",21,"""9B34E5DB229D50FA"""
+"""87FC48EC528F412F_41D21B1EFA792694_6036_UN""","""CCOC(=O)NC1CCC(CC1)N(CCNC)[S](=O)(=O)C""",21,"""9B34E5DB229D50FA"""
+"""CCCB1C602A69AE6E_BDA8275AF108EB9E_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](CCCC)(=O)=O)C""",21,"""9B34E5DB229D50FA"""
+"""83BA8F8FC4C427C5_89BBC50723A890C1_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""9B34E5DB229D50FA"""
+"""C6A15998AFB2A76C_995DD4B5929AC90C_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](C)(=O)=O)CCC#C""",21,"""9B34E5DB229D50FA"""
+"""CB0DEC67E7985757_901FDA007CA5E4A8_6036_UN""","""CCOC(=O)NC1CCC(CC1)N(C)[S](=O)(=O)CCCCl""",21,"""9B34E5DB229D50FA"""
+"""FE1B0226DF3CCD04_D1E390047AB57D63_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](CC)(=O)=O)CC#C""",21,"""9B34E5DB229D50FA"""
+"""AE519AFDE0924CC8_88307C5219768403_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2[S](CCCC2=O)(=O)=O""",21,"""9B34E5DB229D50FA"""
+"""3AA944C0696EFB29_5ACEE0CAE68FBA55_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2C(C(N)C[S]2(=O)=O)=O""",21,"""9B34E5DB229D50FA"""
+"""033928B9D6F332B8_7F078749B8602781_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](C)(=O)=O)C2CNC2""",21,"""9B34E5DB229D50FA"""
+"""1577CF27558AAB1B_A5D068BADA8688AE_6036_DP""","""CCOC(=O)NC1CCC(CC1)N[S](=O)(=O)C2(CC2)C#N""",21,"""9B34E5DB229D50FA"""
+"""5D477423EF110EF8_B2DC319605171EA6_6036_UN""","""CCOC(=O)NC1CCC(CC1)N(C)[S](=O)(=O)CCCN""",21,"""9B34E5DB229D50FA"""
+"""4815900E020B455B_1BC51272B853EA99_6036_UN""","""CCOC(=O)NC1CCC(CC1)N(C)[S](=O)(=O)C2COC2""",21,"""9B34E5DB229D50FA"""
+"""4A47645D91D80D5B_7BE0C39064FE5A06_6036_UN""","""CCOC(=O)NC1CCC(CC1)N(C)[S](=O)(=O)CCOC""",21,"""9B34E5DB229D50FA"""
+"""011D3CB59D5EFC97_D53E5E72B0CE8813_6036_UN""","""CCOC(=O)NC1CCC(CC1)N(C)[S](=O)(=O)CC(=O)C""",21,"""9B34E5DB229D50FA"""
+"""A6F65827AD1F6D03_5D1638C67640BB5E_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2CCCC(C)[S]2(=O)=O""",21,"""9B34E5DB229D50FA"""
+"""C0A41D1BE4F254A2_50F91E21CF7980FB_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2CCC(C)(C)[S]2(=O)=O""",21,"""9B34E5DB229D50FA"""
+"""CF30B02F5309DCD9_6B51BFE0CE4E72A4_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](CC)(=O)=O)CCN""",21,"""9B34E5DB229D50FA"""
+"""FA51DB8B7F316EE7_2AFC235AF0087410_6036_UN""","""CCOC(=O)NC1CCC(CC1)N(CC)[S](=O)(=O)CCN""",21,"""9B34E5DB229D50FA"""
+"""736582D558A19E55_906F88AFF11E815D_6036_UN""","""CCOC(=O)NC1CCC(CC1)N(C)[S](=O)(=O)C(C)(C)C""",21,"""9B34E5DB229D50FA"""
+"""264C1B4BC42B6064_1857BBC533B39461_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2[S](=O)(=O)C3(CC2)CC3""",21,"""9B34E5DB229D50FA"""
+"""2E3CBDEEBB33A29D_77712DF8A635DC3F_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](CCNC)(=O)=O)C""",21,"""9B34E5DB229D50FA"""
+"""2E3CBDEEBB33A29D_AB81D76E5FAAD719_6036_DP""","""CCOC(=O)NC1CCC(CC1)N(C)[S](=O)(=O)CCNC""",21,"""9B34E5DB229D50FA"""
+"""C184B3BA63C7A3F1_BA3C5382249010C2_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2[S](CCC2CI)(=O)=O""",21,"""9B34E5DB229D50FA"""
+"""072774B65F4EA891_263AF84A5E9E1E0F_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2C(CN)CC[S]2(=O)=O""",21,"""9B34E5DB229D50FA"""
+"""642E15DFD0A2A6E2_B56D27B02654B377_6036_UN""","""CCOC(=O)NC1CCC(CC1)N(CC(C)C)[S](=O)(=O)C""",21,"""9B34E5DB229D50FA"""
+"""FF35F065B35E1FDC_2964B21A5F5EDEA0_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2[S](=O)(CCNCC2)=O""",21,"""9B34E5DB229D50FA"""
+"""3819615A310331B3_9B83A94474CF1E0B_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](C=C)(=O)=O)C2CC2""",21,"""9B34E5DB229D50FA"""
+"""98B387B0AEC9B24B_3B842947A2CA17F4_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2CC3(C[S]2(=O)=O)CC3""",21,"""9B34E5DB229D50FA"""
+"""0AA3181EFE7B0212_F7CF5A76AA9506B6_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](C)(=O)=O)C(=O)CN""",21,"""9B34E5DB229D50FA"""
+"""401002B467F9FF84_154C14407AE03978_6036_UN""","""CCOC(=O)NC1CCC(CC1)N2CCCCC[S]2(=O)=O""",21,"""9B34E5DB229D50FA"""
+"""C7CF321748EC192C_07E788A678A8F724_6036_UN""","""CCOC(=O)NC1CCC(CC1)N([S](C)(=O)=O)CCCBr""",21,"""9B34E5DB229D50FA"""
+"""527E7E5608718A9D_57E489FBC1CCF3F6_6003_UN""","""CCOC(=O)NC2CCC(OC1=CC=C(C=C1)C#N)CC2""",21,"""9B34E5DB229D50FA"""
+"""311E69EBA3248AAB_68C473F380544ED7_6003_UN""","""CCOC(=O)NC2CCC(OC1=CC=CC=C1[N+]#[C-])CC2""",21,"""9B34E5DB229D50FA"""
+"""25425B8C383A8197_6F938681E1197375_6003_UN""","""CCOC(=O)NC2CCC(OC1=CC=CC=C1C#N)CC2""",21,"""9B34E5DB229D50FA"""
+"""53E9E661DEE3680B_871324E57FE75A09_6003_UN""","""CCOC(=O)NC2CCC(OC1=CC=C(C=C1)[N+]#[C-])CC2""",21,"""9B34E5DB229D50FA"""
+"""DCD85D42EB057630_0928A107C0CA8D77_6003_UN""","""CCOC(=O)NC2CCC(OC1=CC=CC(=C1)[N+]#[C-])CC2""",21,"""9B34E5DB229D50FA"""
+"""029510B0F9EE99AD_FEF4F48FF35B9210_6006_UN""","""CNC1=C(C=CC=C1C2=CC(=C(C(=C2)F)F)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""4D35D7406115E07D_D3F55319D4ADA72C_6006_UN""","""CNC1=C(C=CC=C1C2=CC=C(C(C)C)C=C2)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""EC047218A54761EC_7176942804B48CE9_6006_UN""","""CNC1=C(C=CC=C1C2=CC3=C(C=C2)CCC3)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""0F39D2288471D014_D1A4D4E41BDCF64B_6006_UN""","""CNC1=C(C=CC=C1C2=CC=CC(=C2)C#CC)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""B649A30CFD87C7FB_D1A050960AB4DDD4_6006_UN""","""CNC1=C(C=CC=C1C2=CC=CC(=C2)CSC)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""8A213CFBEA5C4264_514EE0B8A8A3F1D1_6006_UN""","""CNC1=C(C=CC=C1C2=CN=C(C=C2)[N](=O)=O)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""9D75F06C761265A1_0915E2940E3B03FB_6006_UN""","""CNC1=C(C=CC=C1C2=CSC=C2C(F)(F)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""96018B8450F531FB_201E07FEBEB4067A_6006_UN""","""CNC1=C(C=CC=C1C2=CC(=CC=C2)C(=O)O)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""FFEAB70EC69A7CD4_C212F2FF8B8549F9_6006_UN""","""CNC1=C(C=CC=C1C3=C2[NH]C=CC2=CC=C3)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""F8641D0697D469D5_01F247AF2ADC38EE_6006_UN""","""CNC1=C(C=CC=C1C2=C(C=C(C)C=C2F)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""EF8521EC16676FCE_B54939A79D8719B5_6006_UN""","""CNC1=C(C=CC=C1C2=CC=CC3=NON=C23)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""25E6117D9E8CDFB2_F23367FFF08D4ACD_6006_UN""","""CNC1=C(C=CC=C1C2=C(C(=C(C)C=C2)F)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""3ECA5EC0CF4464BA_B3F82C3EFA106749_6006_UN""","""CNC1=C(C=CC=C1C3=C[N]2C=NN=C2C=C3)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""249304631D356563_5DCECFF6782EB4E5_6006_UN""","""CNC1=C(C=CC=C1C2=CC(=C(C=C2)F)OC)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""8A31131571BE5BC0_4B138C47BFBB2B99_6006_UN""","""CNC1=C(C=CC=C1C2=C(C=C(C)C=C2C)C)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""82DE090D6604C07B_3ED8D308F86F4D15_6006_UN""","""CNC1=C(C=CC=C1C2=C(OC)C=CC=C2F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""2467DA038947AA3D_EE8B730BF6B17A39_6006_UN""","""CNC1=C(C=CC=C1C2=CC=C(C(N)=O)C=C2)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""15E31B30D64D4390_34F45A374CA69F8C_6006_UN""","""CNC1=C(C=CC=C1C2=CC(=C(OC)C=C2)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""A73D644FBA46DBDD_6C5C59F21CCB7350_6006_DP""","""CNC1=C(C=CC=C1C3=C2[N](CCNC2)N=C3)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""96018B8450F531FB_600D3BAAE76D264B_6006_DP""","""CNC1=C(C=CC=C1C2=CC=CC(=C2)C(O)=O)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""30C94CC5A818DE23_49A6519C151F3630_6006_UN""","""CNC1=C(C=CC=C1C2=CC=CC(=C2F)OC)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""30D630C0F9D15CAE_FE3926E2DDEEF458_6006_UN""","""CNC1=C(C=CC=C1C2=C(C=CC(=C2)OC)C)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""FB06F43F5B592379_EF618A05BCAA8555_6006_UN""","""CNC1=C(C=CC=C1C3=C2OC=CC2=CC=C3)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""662952F9605D16A1_56908EA0BDD4B163_6006_UN""","""CNC1=C(C=CC=C1C2=C(OC)C=C(C=C2)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""EA59403AA135B4C8_56CD92E8E36F27AA_6006_UN""","""CNC1=C(C=CC=C1C2=CC(=C(OC)C=C2)C)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""F635B6A59E9ED45A_468AFDA054634835_6006_UN""","""CNC1=C(C=CC=C1C2=CC=C(C(C)O)C=C2)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""FAC34E861C0F0396_4EAE411F6B470F14_6006_UN""","""CNC1=C(C=CC=C1C2=COC(=C2)C(F)(F)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""D41E506F442D1475_505B079AD4D558E7_6006_UN""","""CNC1=C(C=CC=C1C2=CC(=CS2)C(F)(F)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""225236B725A2E301_D3CA055E55346EFC_6006_UN""","""CNC1=C(C=CC=C1C2=CN=C(N(C)C)N=C2)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""03EF7F905CC9CC1D_064BECCA632FB63F_6006_UN""","""CNC1=C(C=CC=C1C3=CC2=C(C=CC=N2)S3)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""59308857DF83B2F0_B13E6C756B5CB047_6006_UN""","""CNC1=C(C=CC=C1C2=C(C(=CC=C2O)F)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""7811AF18500B9A8A_567D56FF3A1AB35D_6006_UN""","""CNC1=C(C=CC=C1C2=CSC3=C2C=CC=C3)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""CC4EF8A5C604A002_297BEA4AFD2DC1CA_6006_UN""","""CNC1=C(C=CC=C1C2=CC=C[N]3N=CC=C23)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""266CF173E004C7E2_90D1C3CB7C6B2A7D_6006_UN""","""CNC1=C(C=CC=C1C2=CN=C(C=C2)C(F)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""38E283B67357DEC7_FBCA1FC05E0CDAF1_6006_UN""","""CNC1=C(C=CC=C1C2=CC3=C(C=C2)CCO3)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""3CFB45363E0F8452_AD0965346A768972_6006_UN""","""CNC1=C(C=CC=C1C2=CC=C(C=C2)[N](=O)=O)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""9CDF7CCE01B28939_56C76191A5553CE9_6006_UN""","""CNC1=C(C=CC=C1C2=CC3=C(C=C2)C=N[NH]3)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""1B2618339D9033A9_F2730211D48C6EAB_6006_UN""","""CNC1=C(C=CC=C1C2=CC=C(S2)C(F)(F)F)C(F)(F)F""",21,"""9B400044C6B14284"""
+"""D2D0C4D5881440C1_FEF4C4FA54A5A56A_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C3=CC(=C(C(=C3)F)F)F""",21,"""9B403031614F75FE"""
+"""A8C912A40197772A_D3F5636C73539056_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C3=CC=C(C(C)C)C=C3""",21,"""9B403031614F75FE"""
+"""7FBC1053DEC041FA_7176A45DA34ABB93_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C3=CC4=C(C=C3)CCC4""",21,"""9B403031614F75FE"""
+"""801B4F115BCEF957_D1A4E491BC22C131_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C3=CC=CC(=C3)C#CC""",21,"""9B403031614F75FE"""
+"""9D6C2CE099EA1091_D1A060E3AD4AEAAE_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C3=CC=CC(=C3)CSC""",21,"""9B403031614F75FE"""
+"""506F4D8E6D750E06_514ED0CD0F5DC6AB_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C3=CN=C(C=C3)[N](=O)=O""",21,"""9B403031614F75FE"""
+"""2560A141893C9AD2_0915D2E1A9C53481_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C3=CSC=C3C(F)(F)F""",21,"""9B403031614F75FE"""
+"""30831A96972958D6_201E378B194A3100_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C3=CC(=CC=C3)C(=O)O""",21,"""9B403031614F75FE"""
+"""677E4C4107F64163_C212C28A2C7B7E83_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C4=C3[NH]C=CC3=CC=C4""",21,"""9B403031614F75FE"""
+"""E8DBCC0B9D481734_01F277DA8D220F94_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C3=C(C=C(C)C=C3F)F""",21,"""9B403031614F75FE"""
+"""28EBF09CC2EA946D_B54909D23A792ECF_6006_UN""","""C1(=NN=C(C=C1)C(=O)NC2CC2)C3=CC=CC4=NON=C34""",21,"""9B403031614F75FE"""
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+"""880BDAA36D6D565D_59107CB7D076E0A6_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N2CCCC(C)[S]2(=O)=O""",21,"""9F32A1AA84AB0B02"""
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+"""240AA938CC5207A7_6F57FB916878295C_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N([S](CC)(=O)=O)CCN""",21,"""9F32A1AA84AB0B02"""
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+"""6B4D58F6D347166C_9469CCDE5728DAA5_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N(C)[S](=O)(=O)C(C)(C)C""",21,"""9F32A1AA84AB0B02"""
+"""8AE16C1F3985937E_1C51FFB49585CF99_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N2[S](=O)(=O)C3(CC2)CC3""",21,"""9F32A1AA84AB0B02"""
+"""C5D61E48683EB15B_73776989000387C7_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N([S](CCNC)(=O)=O)C""",21,"""9F32A1AA84AB0B02"""
+"""C5D61E48683EB15B_AF87931FF99C8CE1_6036_DP""","""CC(C)C(C1=CC(=C(C=C1)F)F)N(C)[S](=O)(=O)CCNC""",21,"""9F32A1AA84AB0B02"""
+"""06D8CDA22CA1770E_BE3A17F382A64B3A_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N2[S](CCC2CI)(=O)=O""",21,"""9F32A1AA84AB0B02"""
+"""A4F08A6994BA6960_223CBC3BF8A845F7_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N2C(CN)CC[S]2(=O)=O""",21,"""9F32A1AA84AB0B02"""
+"""2FAEA4EB2740B574_B16B63C18062E88F_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N(CC(C)C)[S](=O)(=O)C""",21,"""9F32A1AA84AB0B02"""
+"""B0242AC187BAAFC3_2D62F66BF9688558_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N2[S](=O)(CCNCC2)=O""",21,"""9F32A1AA84AB0B02"""
+"""F0B51FB3A9A1948A_9F85ED35D2F945F3_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N([S](C=C)(=O)=O)C2CC2""",21,"""9F32A1AA84AB0B02"""
+"""0D25709CDEBC2E92_3F826D3604FC4C0C_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N2CC3(C[S]2(=O)=O)CC3""",21,"""9F32A1AA84AB0B02"""
+"""E785532E88F5DE7B_F3C91E070CA35D4E_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N([S](C)(=O)=O)C(=O)CN""",21,"""9F32A1AA84AB0B02"""
+"""008477457963F1EF_114A5031DCD66280_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N2CCCCC[S]2(=O)=O""",21,"""9F32A1AA84AB0B02"""
+"""30E09D29AA145FA1_03E1CCD7DE9EACDC_6036_UN""","""CC(C)C(C1=CC(=C(C=C1)F)F)N([S](C)(=O)=O)CCCBr""",21,"""9F32A1AA84AB0B02"""
+"""A625F20955E39235_53E2CD8A67FAA80E_6003_UN""","""CC(C)C(OC1=CC=C(C=C1)C#N)C2=CC(=C(C=C2)F)F""",21,"""9F32A1AA84AB0B02"""
+"""C50180CBD44E8018_6CC237822662152F_6003_UN""","""CC(C)C(OC1=CC=CC=C1[N+]#[C-])C2=CC(=C(C=C2)F)F""",21,"""9F32A1AA84AB0B02"""
+"""D9B09224FFB5FA05_6B95C2F0472F288D_6003_UN""","""CC(C)C(OC1=CC=CC=C1C#N)C2=CC(=C(C=C2)F)F""",21,"""9F32A1AA84AB0B02"""
+"""ADDFFB678252E5AA_83156094D9D101F1_6003_UN""","""CC(C)C(OC1=CC=C(C=C1)[N+]#[C-])C2=CC(=C(C=C2)F)F""",21,"""9F32A1AA84AB0B02"""
+"""3A0F08591F420E5F_0D2EE57666FCD68F_6003_UN""","""CC(C)C(OC1=CC=CC(=C1)[N+]#[C-])C2=CC(=C(C=C2)F)F""",21,"""9F32A1AA84AB0B02"""
+"""DF8998B91D706787_FAD0A88F7116E32E_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC(=C(C(=C2)F)F)F)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""FEBBE8867B1B7E30_D7D10F1956E0D612_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC=C(C(C)C)C=C2)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""1883862FEDE10A48_7552C82886F9FDD7_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC3=C(C=C2)CCC3)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""72F2CF23B18CF651_D58088E499918775_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC=CC(=C2)C#CC)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""8B22B6DC18B8D7E9_D5840C9688F9ACEA_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC=CC(=C2)CSC)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""773EBA06007CEFDF_556ABCB82AEE80EF_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CN=C(C=C2)[N](=O)=O)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""D9BBEE22000DA534_0D31BE948C7672C5_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CSC=C2C(F)(F)F)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""D65A945128E7506D_243A5BFE3CF97744_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC(=CC=C2)C(=O)O)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""0FDE7A5987EA08E1_C636AEFF09C838C7_6006_UN""","""CCNC1=C(C=CC(=C1)C3=C2[NH]C=CC2=CC=C3)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""29C6418ECC615FF8_05D61BAFA89149D0_6006_UN""","""CCNC1=C(C=CC(=C1)C2=C(C=C(C)C=C2F)F)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""7FBBD15B2DB9063C_B16D65A71FCA688B_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC=CC3=NON=C23)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""7AA517F1C1483F30_F6173BFF72C03BF3_6006_UN""","""CCNC1=C(C=CC(=C1)C2=C(C(=C(C)C=C2)F)F)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""27ECF41B548A490A_B7DC703E785D1677_6006_UN""","""CCNC1=C(C=CC(=C1)C3=C[N]2C=NN=C2C=C3)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""8206506AAE8FC305_59EA93F6FA63C5DB_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC(=C(C=C2)F)OC)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""6DBD1BF006CCD20D_4F37D0473DF65AA7_6006_UN""","""CCNC1=C(C=CC(=C1)C2=C(C=C(C)C=C2C)C)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""C83224F2E15B8B52_3AFC8F087A223C2B_6006_UN""","""CCNC1=C(C=CC(=C1)C2=C(OC)C=CC=C2F)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""CA15151FE2E70504_EAAF2F0B74FC0B07_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC=C(C(N)=O)C=C2)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""DA65DB58F5013CE7_30D00637CEEBEEB2_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC(=C(OC)C=C2)F)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""1A40F0260460DFEB_687805F29E86026E_6006_DP""","""CCNC1=C(C=CC(=C1)C3=C2[N](CCNC2)N=C3)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""D65A945128E7506D_642967AA65205775_6006_DP""","""CCNC1=C(C=CC(=C1)C2=CC=CC(=C2)C(O)=O)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""9C536142B246C92B_4D820D9C9752470E_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC=CC(=C2F)OC)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""96EF9229C4D7BBF1_FA1D7AE25FA38566_6006_UN""","""CCNC1=C(C=CC(=C1)C2=C(C=CC(=C2)OC)C)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""4D3CF9C8F368424A_EB45D6053EE7F46B_6006_UN""","""CCNC1=C(C=CC(=C1)C3=C2OC=CC2=CC=C3)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""A2919CCE252E625A_52B4D2A03F99C05D_6006_UN""","""CCNC1=C(C=CC(=C1)C2=C(OC)C=C(C=C2)F)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""D09806203F7FA6EA_52E9CEE861225694_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC(=C(OC)C=C2)C)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""83FD125E9E1E9B9D_42AEA1A0D62E390B_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC=C(C(C)O)C=C2)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""33EB9A9C0A6C2201_4A8A1D1FE90A7E2A_6006_UN""","""CCNC1=C(C=CC(=C1)C2=COC(=C2)C(F)(F)F)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""98524C8B11F6927D_547F5B9A569829D9_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CC(=CS2)C(F)(F)F)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""CD96B22B29248D63_D7EE595ED7791FC2_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CN=C(N(C)C)N=C2)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""ADCA395C49C17964_026FB0CAE162C701_6006_UN""","""CCNC1=C(C=CC(=C1)C3=CC2=C(C=CC=N2)S3)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""E33010BEDC777E13_B51A3075E911C179_6006_UN""","""CCNC1=C(C=CC(=C1)C2=C(C(=CC=C2O)F)F)[N](=O)=O""",21,"""9F645C4444FC33BA"""
+"""3A195986A85C5A7D_52590AFFB857C263_6006_UN""","""CCNC1=C(C=CC(=C1)C2=CSC3=C2C=CC=C3)[N](=O)=O""",21,"""9F645C4444FC33BA"""
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+"""DCB5F18848F756EA_4B1595D4FB688CB1_6006_UN""","""CCOC1=C(C=CC(=N1)C2=CC3=C(C=C2)CCC3)C(=O)O""",21,"""A12301B8396D42DC"""
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+"""AA6C103C8224C84A_D4E872F7096D7A61_6006_UN""","""CCOC1=C(C=CC(=N1)C2=CC=C(C(N)=O)C=C2)C(=O)O""",21,"""A12301B8396D42DC"""
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+"""323B6341AD134949_6A3806662B0958BF_6006_UN""","""CCOC1=C(C=CC(=N1)C2=CC(=CS2)C(F)(F)F)C(=O)O""",21,"""A12301B8396D42DC"""
+"""9ACF099FB3741AE0_E9A904A2AAE86EA4_6006_UN""","""CCOC1=C(C=CC(=N1)C2=CN=C(N(C)C)N=C2)C(=O)O""",21,"""A12301B8396D42DC"""
+"""547F3EC872A1F278_3C28ED369CF3B667_6006_UN""","""CCOC1=C(C=CC(=N1)C3=CC2=C(C=CC=N2)S3)C(=O)O""",21,"""A12301B8396D42DC"""
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+"""770E80871F911BF3_6C1E5703C5C6B305_6006_UN""","""CCOC1=C(C=CC(=N1)C2=CSC3=C2C=CC=C3)C(=O)O""",21,"""A12301B8396D42DC"""
+"""06C84F34C6DDF68C_1318EBB602F1C192_6006_UN""","""CCOC1=C(C=CC(=N1)C2=CC=C[N]3N=CC=C23)C(=O)O""",21,"""A12301B8396D42DC"""
+"""77CE7FFC8C8A7A5E_AAB2C23783B72A25_6006_UN""","""CCOC1=C(C=CC(=N1)C2=CN=C(C=C2)C(F)F)C(=O)O""",21,"""A12301B8396D42DC"""
+"""8A6DFD18D57B1048_C1A91E3CA1D0DAA9_6006_UN""","""CCOC1=C(C=CC(=N1)C2=CC3=C(C=C2)CCO3)C(=O)O""",21,"""A12301B8396D42DC"""
+"""7DE5A058A3BFD23C_976A64C895AA892A_6006_UN""","""CCOC1=C(C=CC(=N1)C2=CC=C(C=C2)[N](=O)=O)C(=O)O""",21,"""A12301B8396D42DC"""
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+"""74CAFC27755C1D40_C81003ED2B506EF3_6006_UN""","""CCOC1=C(C=CC(=N1)C2=CC=C(S2)C(F)(F)F)C(=O)O""",21,"""A12301B8396D42DC"""
+"""DBC192B95ED86D31_C4FCCC06AE02B00B_6006_UN""","""FC(F)(F)C(=O)C1=CN=C(C=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""A14838CD9BE8609F"""
+"""74B1576600D7D56B_E9FD6B9089F48537_6006_UN""","""FC(F)(F)C(=O)C1=CN=C(C=C1)C2=CC=C(C(C)C)C=C2""",21,"""A14838CD9BE8609F"""
+"""46DC5FC6E844C64F_4B7EACA159EDAEF2_6006_UN""","""FC(F)(F)C(=O)C1=CN=C(C=C1)C2=CC3=C(C=C2)CCC3""",21,"""A14838CD9BE8609F"""
+"""109A46803DD82E27_EBACEC6D4685D450_6006_UN""","""FC(F)(F)C(=O)C1=CN=C(C=C1)C2=CC=CC(=C2)C#CC""",21,"""A14838CD9BE8609F"""
+"""8AB9EB0E1F89E2A1_EBA8681F57EDFFCF_6006_UN""","""FC(F)(F)C(=O)C1=CN=C(C=C1)C2=CC=CC(=C2)CSC""",21,"""A14838CD9BE8609F"""
+"""1FED2BDEEDE5678F_6B46D831F5FAD3CA_6006_UN""","""FC(F)(F)C(=O)C1=CN=C(C=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""A14838CD9BE8609F"""
+"""E91E1B4B5CCDC0D6_331DDA1D536221E0_6006_UN""","""FC(F)(F)C(=O)C1=CN=C(C=C1)C2=CSC=C2C(F)(F)F""",21,"""A14838CD9BE8609F"""
+"""C8221E828C7E0397_1A163F77E3ED2461_6006_UN""","""FC(F)(F)C(=O)C1=CN=C(C=C1)C2=CC(=CC=C2)C(=O)O""",21,"""A14838CD9BE8609F"""
+"""F132E690C42E4C8D_F81ACA76D6DC6BE2_6006_UN""","""FC(F)(F)C(=O)C1=CN=C(C=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""A14838CD9BE8609F"""
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+"""74D95C5F1E86858A_EA04B19BB7E4CA60_6006_DP""","""NC1CCN(C1)C2=NC(=NC=C2)C3=CN=C(N(C)C)N=C3""",21,"""A28EB4812461E618"""
+"""ABEDD96B3758CABE_3F85580F81FF12A3_6006_DP""","""NC1CCN(C1)C2=NC(=NC=C2)C4=CC3=C(C=CC=N3)S4""",21,"""A28EB4812461E618"""
+"""79B4E130387F419C_88F0D8B0898C14DB_6006_DP""","""NC1CCN(C1)C2=NC(=NC=C2)C3=C(C(=CC=C3O)F)F""",21,"""A28EB4812461E618"""
+"""C750EBA2D7634B34_6FB3E23AD8CA17C1_6006_DP""","""NC1CCN(C1)C2=NC(=NC=C2)C3=CSC4=C3C=CC=C4""",21,"""A28EB4812461E618"""
+"""5BC91AEBB1EE9200_10B55E8F1FFD6556_6006_DP""","""NC1CCN(C1)C2=NC(=NC=C2)C3=CC=C[N]4N=CC=C34""",21,"""A28EB4812461E618"""
+"""BBDF133B5CF2BDD1_A91F770E9EBB8EE1_6006_DP""","""NC1CCN(C1)C2=NC(=NC=C2)C3=CN=C(C=C3)C(F)F""",21,"""A28EB4812461E618"""
+"""2536E7DF17270CD9_C204AB05BCDC7E6D_6006_DP""","""NC1CCN(C1)C2=NC(=NC=C2)C3=CC4=C(C=C3)CCO4""",21,"""A28EB4812461E618"""
+"""5270D4F9029F411A_94C7D1F188A62DEE_6006_DP""","""NC1CCN(C1)C2=NC(=NC=C2)C3=CC=C(C=C3)[N](=O)=O""",21,"""A28EB4812461E618"""
+"""8359DC51D0090DF7_6F09D55447859875_6006_DP""","""NC1CCN(C1)C2=NC(=NC=C2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""A28EB4812461E618"""
+"""048010CFB7ACBAE4_CBBDB6D4365CCA37_6006_DP""","""NC1CCN(C1)C2=NC(=NC=C2)C3=CC=C(S3)C(F)(F)F""",21,"""A28EB4812461E618"""
+"""3220A3869F850CCD_C76865445B2F5ACE_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC(=C(C(=C2)F)F)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""BBDC64135F6B24E0_EA69C2D27CD96FF2_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=C(C(C)C)C=C2)C#N""",21,"""A2DC918F6EC58A5A"""
+"""2BDEB84F9EFD0C9C_48EA05E3ACC04437_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC3=C(C=C2)CCC3)C#N""",21,"""A2DC918F6EC58A5A"""
+"""D3E3ED2FA91969B6_E838452FB3A83E95_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=CC(=C2)C#CC)C#N""",21,"""A2DC918F6EC58A5A"""
+"""5F0E21B32306D04D_E83CC15DA2C0150A_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=CC(=C2)CSC)C#N""",21,"""A2DC918F6EC58A5A"""
+"""168C019D2CA33AE2_68D2717300D7390F_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CN=C(C=C2)[N](=O)=O)C#N""",21,"""A2DC918F6EC58A5A"""
+"""4FA834F2EA5A9E7B_3089735FA64FCB25_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CSC=C2C(F)(F)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""20D6AB2ADE913D0D_1982963516C0CEA4_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC(=CC=C2)C(=O)O)C#N""",21,"""A2DC918F6EC58A5A"""
+"""B7DC3D793720E2F2_FB8E633423F18127_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C3=C2[NH]C=CC2=CC=C3)C#N""",21,"""A2DC918F6EC58A5A"""
+"""218A88C9D5BCAC33_386ED66482A8F030_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=C(C=C(C)C=C2F)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""ED248BA9B0DD490F_8CD5A86C35F3D16B_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=CC3=NON=C23)C#N""",21,"""A2DC918F6EC58A5A"""
+"""74C0311D30FDDE7D_CBAFF63458F98213_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=C(C(=C(C)C=C2)F)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""761EFDC6C9CD39BF_8A64BDF55264AF97_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C3=C[N]2C=NN=C2C=C3)C#N""",21,"""A2DC918F6EC58A5A"""
+"""1E3929CEA803C190_64525E3DD05A7C3B_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC(=C(C=C2)F)OC)C#N""",21,"""A2DC918F6EC58A5A"""
+"""FD743EE42F24BDCD_728F1D8C17CFE347_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=C(C=C(C)C=C2C)C)C#N""",21,"""A2DC918F6EC58A5A"""
+"""149F69BAEBBB2AF5_074442C3501B85CB_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=C(OC)C=CC=C2F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""2159D1B0C5E20375_D717E2C05EC5B2E7_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=C(C(N)=O)C=C2)C#N""",21,"""A2DC918F6EC58A5A"""
+"""605F5828CC9A9120_0D68CBFCE4D25752_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC(=C(OC)C=C2)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""AC5FC3A86144EC62_55C0C839B4BFBB8E_6006_DP""","""FC(F)(F)C1=C(N=C(C=C1)C3=C2[N](CCNC2)N=C3)C#N""",21,"""A2DC918F6EC58A5A"""
+"""20D6AB2ADE913D0D_5991AA614F19EE95_6006_DP""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=CC(=C2)C(O)=O)C#N""",21,"""A2DC918F6EC58A5A"""
+"""699CFC73E9940B55_703AC057BD6BFEEE_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=CC(=C2F)OC)C#N""",21,"""A2DC918F6EC58A5A"""
+"""B0588B8DA0599630_C7A5B729759A3C86_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=C(C=CC(=C2)OC)C)C#N""",21,"""A2DC918F6EC58A5A"""
+"""CA7A9581F936784D_D6FD1BCE14DE4D8B_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C3=C2OC=CC2=CC=C3)C#N""",21,"""A2DC918F6EC58A5A"""
+"""FBDC5DE400CE27B7_6F0C1F6B15A079BD_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=C(OC)C=C(C=C2)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""91791DD8B73568DB_6F5103234B1BEF74_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC(=C(OC)C=C2)C)C#N""",21,"""A2DC918F6EC58A5A"""
+"""474FD5D6FE2A6EB1_7F166C6BFC1780EB_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=C(C(C)O)C=C2)C#N""",21,"""A2DC918F6EC58A5A"""
+"""6E0BCE21611224E2_7732D0D4C333C7CA_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=COC(=C2)C(F)(F)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""D2480C071CC3E0C2_69C796517CA19039_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC(=CS2)C(F)(F)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""E3BAD95614C5B49F_EA569495FD40A622_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CN=C(N(C)C)N=C2)C#N""",21,"""A2DC918F6EC58A5A"""
+"""F71128C7E3878978_3FD77D01CB5B7EE1_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C3=CC2=C(C=CC=N2)S3)C#N""",21,"""A2DC918F6EC58A5A"""
+"""7EC56C374D06E15A_88A2FDBEC3287899_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=C(C(=CC=C2O)F)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""79592F7F511B8C2A_6FE1C734926E7B83_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CSC3=C2C=CC=C3)C#N""",21,"""A2DC918F6EC58A5A"""
+"""9EF638CC46588E3E_10E77B8155590914_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=C[N]3N=CC=C23)C#N""",21,"""A2DC918F6EC58A5A"""
+"""4DAD3EEEB2586EB0_A94D5200D41FE2A3_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CN=C(C=C2)C(F)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""A81904E69BFE82B5_C2568E0BF678122F_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC3=C(C=C2)CCO3)C#N""",21,"""A2DC918F6EC58A5A"""
+"""1D515BF968F47F04_9495F4FFC20241AC_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=C(C=C2)[N](=O)=O)C#N""",21,"""A2DC918F6EC58A5A"""
+"""0B4EC26BAEBD7F08_6F5BF05A0D21F437_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3)C#N""",21,"""A2DC918F6EC58A5A"""
+"""72933D605CFAB823_CBEF93DA7CF8A675_6006_UN""","""FC(F)(F)C1=C(N=C(C=C1)C2=CC=C(S2)C(F)(F)F)C#N""",21,"""A2DC918F6EC58A5A"""
+"""D1AB1E00F1F6914E_C6A6D931A783D9A0_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC(=C(C(=C3)F)F)F""",21,"""A3122DFA92690934"""
+"""F597128577C837EE_EBA77EA78075EC9C_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=C(C(C)C)C=C3""",21,"""A3122DFA92690934"""
+"""9CE472E32E1A95A9_4924B996506CC759_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC4=C(C=C3)CCC4""",21,"""A3122DFA92690934"""
+"""AC9003337F110950_E9F6F95A4F04BDFB_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=CC(=C3)C#CC""",21,"""A3122DFA92690934"""
+"""421FF7939ED1779B_E9F27D285E6C9664_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=CC(=C3)CSC""",21,"""A3122DFA92690934"""
+"""67EB92B636FBC0AB_691CCD06FC7BBA61_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CN=C(C=C3)[N](=O)=O""",21,"""A3122DFA92690934"""
+"""D58CF95DCA2F3D8D_3147CF2A5AE3484B_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CSC=C3C(F)(F)F""",21,"""A3122DFA92690934"""
+"""269A7D1C729855E8_184C2A40EA6C4DCA_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC(=CC=C3)C(=O)O""",21,"""A3122DFA92690934"""
+"""6CDDF9B42F52DABE_FA40DF41DF5D0249_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C4=C3[NH]C=CC3=CC=C4""",21,"""A3122DFA92690934"""
+"""CFE060E63E7F7F0F_39A06A117E04735E_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=C(C=C(C)C=C3F)F""",21,"""A3122DFA92690934"""
+"""6670FA67F409F9BE_8D1B1419C95F5205_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=CC4=NON=C34""",21,"""A3122DFA92690934"""
+"""328E03A0F4BB1CAB_CA614A41A455017D_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=C(C(=C(C)C=C3)F)F""",21,"""A3122DFA92690934"""
+"""4FA76E8AAC2CCE66_8BAA0180AEC82CF9_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C4=C[N]3C=NN=C3C=C4""",21,"""A3122DFA92690934"""
+"""69B15D4E4FC914F4_659CE2482CF6FF55_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC(=C(C=C3)F)OC""",21,"""A3122DFA92690934"""
+"""71C4B7A5E9445F02_7341A1F9EB636029_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=C(C=C(C)C=C3C)C""",21,"""A3122DFA92690934"""
+"""744CAAC51C4BB013_068AFEB6ACB706A5_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=C(OC)C=CC=C3F""",21,"""A3122DFA92690934"""
+"""8A01053D5717CEE2_D6D95EB5A2693189_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=C(C(N)=O)C=C3""",21,"""A3122DFA92690934"""
+"""CBCAF382A6A9B70C_0CA67789187ED43C_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC(=C(OC)C=C3)F""",21,"""A3122DFA92690934"""
+"""BD53E85A77322780_540E744C481338E0_6006_DP""","""C2(=C(C=C1CSCCC1=N2)C#N)C4=C3[N](CCNC3)N=C4""",21,"""A3122DFA92690934"""
+"""269A7D1C729855E8_585F1614B3B56DFB_6006_DP""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=CC(=C3)C(O)=O""",21,"""A3122DFA92690934"""
+"""3A033D677D00682D_71F47C2241C77D80_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=CC(=C3F)OC""",21,"""A3122DFA92690934"""
+"""A6553AF37A1323A2_C66B0B5C8936BFE8_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=C(C=CC(=C3)OC)C""",21,"""A3122DFA92690934"""
+"""5203B039A681FB13_D733A7BBE872CEE5_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C4=C3OC=CC3=CC=C4""",21,"""A3122DFA92690934"""
+"""A73ADE74FBDC9827_6EC2A31EE90CFAD3_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=C(OC)C=C(C=C3)F""",21,"""A3122DFA92690934"""
+"""E1E21053587E43B7_6E9FBF56B7B76C1A_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC(=C(OC)C=C3)C""",21,"""A3122DFA92690934"""
+"""7080F84B70A457CC_7ED8D01E00BB0385_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=C(C(C)O)C=C3""",21,"""A3122DFA92690934"""
+"""F63DE8F1BC9B8424_76FC6CA13F9F44A4_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=COC(=C3)C(F)(F)F""",21,"""A3122DFA92690934"""
+"""4FF6489CF2B55428_68092A24800D1357_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC(=CS3)C(F)(F)F""",21,"""A3122DFA92690934"""
+"""910794109597D13E_EB9828E001EC254C_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CN=C(N(C)C)N=C3""",21,"""A3122DFA92690934"""
+"""3230C9C139756FFE_3E19C17437F7FD8F_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C4=CC3=C(C=CC=N3)S4""",21,"""A3122DFA92690934"""
+"""1BB048C9F6C760FF_896C41CB3F84FBF7_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=C(C(=CC=C3O)F)F""",21,"""A3122DFA92690934"""
+"""C91300CFEFDB393D_6E2F7B416EC2F8ED_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CSC4=C3C=CC=C4""",21,"""A3122DFA92690934"""
+"""86A12DFFCE9ECF2C_1129C7F4A9F58A7A_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=C[N]4N=CC=C34""",21,"""A3122DFA92690934"""
+"""144EBAC9485B5A4F_A883EE7528B361CD_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CN=C(C=C3)C(F)F""",21,"""A3122DFA92690934"""
+"""EB323C9F4FF438F4_C398327E0AD49141_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC4=C(C=C3)CCO4""",21,"""A3122DFA92690934"""
+"""4950E2BFCDE43A9C_955B488A3EAEC2C2_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=C(C=C3)[N](=O)=O""",21,"""A3122DFA92690934"""
+"""030E28E849F1E33D_6E954C2FF18D7759_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC4=C(C=C3)C=N[NH]4""",21,"""A3122DFA92690934"""
+"""EE6150E89FD39332_CA212FAF8054251B_6006_UN""","""C2(=C(C=C1CSCCC1=N2)C#N)C3=CC=C(S3)C(F)(F)F""",21,"""A3122DFA92690934"""
+"""8F6D92ED7ECFBEFA_C689371AD3616622_6006_UN""","""CC1=N[N](C)C(=C1C2CCCN2)C3=CC(=C(C(=C3)F)F)F""",21,"""A33DC3D1E68BB6B6"""
+"""F1403A83E819A1EE_EB88908CF497531E_6006_UN""","""CC1=N[N](C)C(=C1C2CCCN2)C3=CC=C(C(C)C)C=C3""",21,"""A33DC3D1E68BB6B6"""
+"""51CE9C43E85ADA37_490B57BD248E78DB_6006_UN""","""CC1=N[N](C)C(=C1C2CCCN2)C3=CC4=C(C=C3)CCC4""",21,"""A33DC3D1E68BB6B6"""
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+"""D0E30912A6F1C2A1_ECA6CBF7D35F80F4_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=CC=CC(=C2)C#CC""",21,"""A6421F570E32343B"""
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+"""7E2F8658BAE3E1C6_FF10EDEC43063F46_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C3=C2[NH]C=CC2=CC=C3""",21,"""A6421F570E32343B"""
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+"""0C80714131247690_CF3178EC380E3C72_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=C(C(=C(C)C=C2)F)F""",21,"""A6421F570E32343B"""
+"""221D601F03F1C810_8EFA332D329311F6_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C3=C[N]2C=NN=C2C=C3""",21,"""A6421F570E32343B"""
+"""39AD65935CCB768C_60CCD0E5B0ADC25A_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=CC(=C(C=C2)F)OC""",21,"""A6421F570E32343B"""
+"""C2C8BBA789365FDD_7611935477385D26_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=C(C=C(C)C=C2C)C""",21,"""A6421F570E32343B"""
+"""D9B0B63963A4894B_03DACC1B30EC3BAA_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=C(OC)C=CC=C2F""",21,"""A6421F570E32343B"""
+"""73416F4B5BC64789_D3896C183E320C86_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=CC=C(C(N)=O)C=C2""",21,"""A6421F570E32343B"""
+"""420969620B4C5751_09F645248425E933_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=CC(=C(OC)C=C2)F""",21,"""A6421F570E32343B"""
+"""D73C8DEB8C01EC8E_515E46E1D44805EF_6006_DP""","""C1(=CC=C(C=C1)C(=O)CCC#N)C3=C2[N](CCNC2)N=C3""",21,"""A6421F570E32343B"""
+"""7B5595E15DB181B5_5D0F24B92FEE50F4_6006_DP""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=CC=CC(=C2)C(O)=O""",21,"""A6421F570E32343B"""
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+"""C15A43ED332D2323_C33B39F1156D82E7_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=C(C=CC(=C2)OC)C""",21,"""A6421F570E32343B"""
+"""2BB44EEF4F90593D_D26395167429F3EA_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C3=C2OC=CC2=CC=C3""",21,"""A6421F570E32343B"""
+"""1A93986811D62C55_6B9291B37557C7DC_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=C(OC)C=C(C=C2)F""",21,"""A6421F570E32343B"""
+"""1CD429ABC89D18BF_6BCF8DFB2BEC5115_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=CC(=C(OC)C=C2)C""",21,"""A6421F570E32343B"""
+"""339B7867E8D8CCA1_7B88E2B39CE03E8A_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=CC=C(C(C)O)C=C2""",21,"""A6421F570E32343B"""
+"""2079D85AC889785B_73AC5E0CA3C479AB_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=COC(=C2)C(F)(F)F""",21,"""A6421F570E32343B"""
+"""5E1E5378655EB897_6D5918891C562E58_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=CC(=CS2)C(F)(F)F""",21,"""A6421F570E32343B"""
+"""6414D6918B702900_EEC81A4D9DB71843_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C2=CN=C(N(C)C)N=C2""",21,"""A6421F570E32343B"""
+"""6624B44F5FBA7E4A_3B49F3D9ABACC080_6006_UN""","""C1(=CC=C(C=C1)C(=O)CCC#N)C3=CC2=C(C=CC=N2)S3""",21,"""A6421F570E32343B"""
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+"""AB9291F3813C9287_60A473A73AA0DE10_6036_UN""","""C(C1=CC=C(C=C1)N2CCCC2)N3CCCC(C)[S]3(=O)=O""",21,"""A686AEBA6E7D35B4"""
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+"""B7239E057805173A_88DF6CD16AB4D639_6036_UN""","""C(C1=CC=C(C=C1)N2CCCC2)N(CC(C)C)[S](=O)(=O)C""",21,"""A686AEBA6E7D35B4"""
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+"""DB32E98CD6D5A9D6_06366226EE2A72BA_6036_UN""","""C(C1=CC=C(C=C1)N2CCCC2)N3CC4(C[S]3(=O)=O)CC4""",21,"""A686AEBA6E7D35B4"""
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+"""E713754320D0E743_28FE5F2136005C36_6036_UN""","""C(C1=CC=C(C=C1)N2CCCC2)N3CCCCC[S]3(=O)=O""",21,"""A686AEBA6E7D35B4"""
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+"""E24DA091CA503005_34EB353B35F6FD3C_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CSC=C2C(F)(F)F""",21,"""A6BED7EBFD7CBC43"""
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+"""448F0B151B449037_3C0C90001111C629_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=C(C=C(C)C=C2F)F""",21,"""A6BED7EBFD7CBC43"""
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+"""207CCC6D36674771_090A8D98776B614B_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CC(=C(OC)C=C2)F""",21,"""A6BED7EBFD7CBC43"""
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+"""174340314DA4AE3D_D29F5DAA87677B92_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C3=C2OC=CC2=CC=C3""",21,"""A6BED7EBFD7CBC43"""
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+"""98826B2C41E096D4_6B334547D8A2D96D_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CC(=C(OC)C=C2)C""",21,"""A6BED7EBFD7CBC43"""
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+"""3D1DA94CADC41021_EE34D2F16EF9903B_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CN=C(N(C)C)N=C2""",21,"""A6BED7EBFD7CBC43"""
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+"""4463F5B250FF5E77_8CC0BBDA50914E80_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=C(C(=CC=C2O)F)F""",21,"""A6BED7EBFD7CBC43"""
+"""7A8DCFE0E07D695C_6B83815001D74D9A_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CSC3=C2C=CC=C3""",21,"""A6BED7EBFD7CBC43"""
+"""D8232BCCE26605A2_14853DE5C6E03F0D_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CC=C[N]3N=CC=C23""",21,"""A6BED7EBFD7CBC43"""
+"""099C290831DF1F37_AD2F146447A6D4BA_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CN=C(C=C2)C(F)F""",21,"""A6BED7EBFD7CBC43"""
+"""48F0E21961390F0A_C634C86F65C12436_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CC3=C(C=C2)CCO3""",21,"""A6BED7EBFD7CBC43"""
+"""C043AE6F63530FBD_90F7B29B51BB77B5_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CC=C(C=C2)[N](=O)=O""",21,"""A6BED7EBFD7CBC43"""
+"""7A21BB8F7AF00442_6B39B63E9E98C22E_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CC3=C(C=C2)C=N[NH]3""",21,"""A6BED7EBFD7CBC43"""
+"""FDE2BC181E545C3D_CF8DD5BEEF41906C_6006_UN""","""COC(=O)C1=C(N=CC(=C1)C#N)C2=CC=C(S2)C(F)(F)F""",21,"""A6BED7EBFD7CBC43"""
+"""278C7DD4293FC6D6_C292DC38445C7D15_6006_UN""","""NC(=O)C1=C(C(=NC=C1)C2=CC(=C(C(=C2)F)F)F)[N](=O)=O""",21,"""A72628F371B6AD81"""
+"""AD1AEFD30C91E023_EF937BAE63AA4829_6006_UN""","""NC(=O)C1=C(C(=NC=C1)C2=CC=C(C(C)C)C=C2)[N](=O)=O""",21,"""A72628F371B6AD81"""
+"""4A41D78C26E0230C_4D10BC9FB3B363EC_6006_UN""","""NC(=O)C1=C(C(=NC=C1)C2=CC3=C(C=C2)CCC3)[N](=O)=O""",21,"""A72628F371B6AD81"""
+"""41917B410821E7AA_EDC2FC53ACDB194E_6006_UN""","""NC(=O)C1=C(C(=NC=C1)C2=CC=CC(=C2)C#CC)[N](=O)=O""",21,"""A72628F371B6AD81"""
+"""8D5AD245CED6EDE6_EDC67821BDB332D1_6006_UN""","""NC(=O)C1=C(C(=NC=C1)C2=CC=CC(=C2)CSC)[N](=O)=O""",21,"""A72628F371B6AD81"""
+"""A44412F8628A022C_6D28C80F1FA41ED4_6006_UN""","""NC(=O)C1=C(C(=NC=C1)C2=CN=C(C=C2)[N](=O)=O)[N](=O)=O""",21,"""A72628F371B6AD81"""
+"""05E343E4E7C0FFD7_3573CA23B93CECFE_6006_UN""","""NC(=O)C1=C(C(=NC=C1)C2=CSC=C2C(F)(F)F)[N](=O)=O""",21,"""A72628F371B6AD81"""
+"""E80CF6AB88CFABAB_1C782F4909B3E97F_6006_UN""","""NC(=O)C1=C(C(=NC=C1)C2=CC(=CC=C2)C(=O)O)[N](=O)=O""",21,"""A72628F371B6AD81"""
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+"""AEAE4FC45E9F0649_389C17D514AD4E93_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CSC=C3C(F)(F)F""",21,"""AAC9F505DC270FEC"""
+"""FEBA5E3C02253756_1197F2BFA4224B12_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CC(=CC=C3)C(=O)O""",21,"""AAC9F505DC270FEC"""
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+"""07FE5135B19687B3_7A9A7906A52D66F1_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=C(C=C(C)C=C3C)C""",21,"""AAC9F505DC270FEC"""
+"""13CA7E595E36CF41_0F512649E2F9007D_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=C(OC)C=CC=C3F""",21,"""AAC9F505DC270FEC"""
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+"""B8C726301092B063_674467A9F9F96AC2_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CC(=C(OC)C=C3)C""",21,"""AAC9F505DC270FEC"""
+"""C98E7D617E37EED0_770308E14EF5055D_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CC=C(C(C)O)C=C3""",21,"""AAC9F505DC270FEC"""
+"""BD9429AE51EC3BA0_7F27B45E71D1427C_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=COC(=C3)C(F)(F)F""",21,"""AAC9F505DC270FEC"""
+"""FF4272492B4E7C47_61D2F2DBCE43158F_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CC(=CS3)C(F)(F)F""",21,"""AAC9F505DC270FEC"""
+"""4D1EE2E5D73B10DA_E243F01F4FA22394_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CN=C(N(C)C)N=C3""",21,"""AAC9F505DC270FEC"""
+"""E3D77796EC3843BA_37C2198B79B9FB57_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C4=CC3=C(C=CC=N3)S4""",21,"""AAC9F505DC270FEC"""
+"""6D0C3D7C04A1DEFE_80B7993471CAFD2F_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=C(C(=CC=C3O)F)F""",21,"""AAC9F505DC270FEC"""
+"""E38634651B6760BB_67F4A3BE208CFE35_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CSC4=C3C=CC=C4""",21,"""AAC9F505DC270FEC"""
+"""DC606CB3BA55DAB2_18F21F0BE7BB8CA2_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CC=C[N]4N=CC=C34""",21,"""AAC9F505DC270FEC"""
+"""FB5FE54BB0FC0BA7_A158368A66FD6715_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CN=C(C=C3)C(F)F""",21,"""AAC9F505DC270FEC"""
+"""EEFE1B0FE3FC3E79_CA43EA81449A9799_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CC4=C(C=C3)CCO4""",21,"""AAC9F505DC270FEC"""
+"""56112F7BBA868BDC_9C80907570E0C41A_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CC=C(C=C3)[N](=O)=O""",21,"""AAC9F505DC270FEC"""
+"""99DB60393437A3A1_674E94D0BFC37181_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""AAC9F505DC270FEC"""
+"""DAA72C82834D1677_C3FAF750CE1A23C3_6006_UN""","""C1(=NC=C(C=C1)C2=CC=CC=C2)C3=CC=C(S3)C(F)(F)F""",21,"""AAC9F505DC270FEC"""
+"""2D48BF5DA9D8E437_CF47F73A00655900_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC(=C(C(=C2)F)F)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""53BBF429913BC0E5_E24650AC27936C3C_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC=C(C(C)C)C=C2)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""E61D08BABF786F76_40C5979DF78A47F9_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC3=C(C=C2)CCC3)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""83EE8AC3E49B16C8_E017D751E8E23D5B_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC=CC(=C2)C#CC)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""83D84EDF3436FB98_E0135323F98A16C4_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC=CC(=C2)CSC)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""0691422A3AB0E52E_60FDE30D5B9D3AC1_6006_UN""","""NCC1=CC(=C(C=C1)C2=CN=C(C=C2)[N](=O)=O)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""5B48F2B408C65183_38A6E121FD05C8EB_6006_UN""","""NCC1=CC(=C(C=C1)C2=CSC=C2C(F)(F)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""74079F623B5D620B_11AD044B4D8ACD6A_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC(=CC=C2)C(=O)O)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""84D82971184E8D04_F3A1F14A78BB82E9_6006_UN""","""NCC1=CC(=C(C=C1)C3=C2[NH]C=CC2=CC=C3)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""28C25B51AB2749F0_3041441AD9E2F3FE_6006_UN""","""NCC1=CC(=C(C=C1)C2=C(C=C(C)C=C2F)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""89AECA10DBFCBDE6_84FA3A126EB9D2A5_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC=CC3=NON=C23)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""4DC98629D6C3738A_C380644A03B381DD_6006_UN""","""NCC1=CC(=C(C=C1)C2=C(C(=C(C)C=C2)F)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""2023090DC9434DC7_824B2F8B092EAC59_6006_UN""","""NCC1=CC(=C(C=C1)C3=C[N]2C=NN=C2C=C3)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""753FD2BB035473BC_6C7DCC438B107FF5_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC(=C(C=C2)F)OC)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""EFB073DF851A479E_7AA08FF24C85E089_6006_UN""","""NCC1=CC(=C(C=C1)C2=C(C=C(C)C=C2C)C)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""48A545FD2BCE98F0_0F6BD0BD0B518605_6006_UN""","""NCC1=CC(=C(C=C1)C2=C(OC)C=CC=C2F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""329D747D057A38E1_DF3870BE058FB129_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC=C(C(N)=O)C=C2)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""DECD1095241012E9_05475982BF98549C_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""BE1846FCD6234D86_5DEF5A47EFF5B840_6006_DP""","""NCC1=CC(=C(C=C1)C3=C2[N](CCNC2)N=C3)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""74079F623B5D620B_51BE381F1453ED5B_6006_DP""","""NCC1=CC(=C(C=C1)C2=CC=CC(=C2)C(O)=O)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""E034156738C40915_78155229E621FD20_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC=CC(=C2F)OC)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""8CB08D4261EF21DF_CF8A25572ED03F48_6006_UN""","""NCC1=CC(=C(C=C1)C2=C(C=CC(=C2)OC)C)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""9E8C74CBB123566D_DED289B04F944E45_6006_UN""","""NCC1=CC(=C(C=C1)C3=C2OC=CC2=CC=C3)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""5000738D5543B5C2_67238D154EEA7A73_6006_UN""","""NCC1=CC(=C(C=C1)C2=C(OC)C=C(C=C2)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""75C11C8ABDB32157_677E915D1051ECBA_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)C)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""C477A6E287DDD40B_7739FE15A75D8325_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC=C(C(C)O)C=C2)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""E402AC177A65BFAD_7F1D42AA9879C404_6006_UN""","""NCC1=CC(=C(C=C1)C2=COC(=C2)C(F)(F)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""3C037C28ABD2D82C_61E8042F27EB93F7_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC(=CS2)C(F)(F)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""4897D68E1C1974FF_E27906EBA60AA5EC_6006_UN""","""NCC1=CC(=C(C=C1)C2=CN=C(N(C)C)N=C2)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""7017E226FC47CD67_37F8EF7F90117D2F_6006_UN""","""NCC1=CC(=C(C=C1)C3=CC2=C(C=CC=N2)S3)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""DC0F9138D29B26A9_808D6FC098627B57_6006_UN""","""NCC1=CC(=C(C=C1)C2=C(C(=CC=C2O)F)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""057D4E13FF404E6E_67CE554AC924784D_6006_UN""","""NCC1=CC(=C(C=C1)C2=CSC3=C2C=CC=C3)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""F4D10A76823FF395_18C8E9FF0E130ADA_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC=C[N]3N=CC=C23)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""D64AE2BA424FB74E_A162C07E8F55E16D_6006_UN""","""NCC1=CC(=C(C=C1)C2=CN=C(C=C2)C(F)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""C647B1507981E147_CA791C75AD3211E1_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC3=C(C=C2)CCO3)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""13A0B333D5B71107_9CBA668199484262_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC=C(C=C2)[N](=O)=O)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""E955AD21740A6F65_67746224566BF7F9_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""562C6DFFB50F4C11_C3C001A427B2A5BB_6006_UN""","""NCC1=CC(=C(C=C1)C2=CC=C(S2)C(F)(F)F)C(F)(F)F""",21,"""AAF303F1358F8994"""
+"""B335355AACFA0356_D5C23282FAB5E655_6036_UN""","""CC(=O)NCC(C1=CC=CC=C1)N([S](C)(=O)=O)CCCN""",21,"""AB5D0ECE37E64174"""
+"""7E202AB6EF513180_7F370624FA49A9FB_6036_UN""","""CC(=O)NCC(C1=CC=CC=C1)N([S](CC)(=O)=O)CCBr""",21,"""AB5D0ECE37E64174"""
+"""6DC9276A4656DDFF_71BBF00BEF02371A_6036_UN""","""CC(=O)NCC(C1=CC=CC=C1)N(CCNC)[S](=O)(=O)C""",21,"""AB5D0ECE37E64174"""
+"""D9290A09BBCC2FE6_8DC1CC4FE473FA10_6036_UN""","""CC(=O)NCC(C1=CC=CC=C1)N([S](CCCC)(=O)=O)C""",21,"""AB5D0ECE37E64174"""
+"""E9DE24248C39FDA9_B9D22E1236D3814F_6036_UN""","""CC(=O)NCC(C1=CC=CC=C1)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""AB5D0ECE37E64174"""
+"""6716F0F59EF98692_A9343FA087E1D882_6036_UN""","""CC(=O)NCC(C1=CC=CC=C1)N([S](C)(=O)=O)CCC#C""",21,"""AB5D0ECE37E64174"""
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+"""830C7233C34D54BA_33FF1FBB8B3D4818_6036_UN""","""C(C2=NC1=C(C=CC=C1)C(=O)N2)N([S](C)(=O)=O)CCCBr""",21,"""AF2C72C6D108EFC6"""
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+"""DD3BE8C0A5703E36_CAD03F0B52296087_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC(=C(C(=C3)F)F)F""",21,"""AF64CBC067C3B013"""
+"""40CE79A0E1D85DA3_E7D1989D75DF55BB_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=C(C(C)C)C=C3""",21,"""AF64CBC067C3B013"""
+"""F648C481AECEBBAC_45525FACA5C67E7E_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC4=C(C=C3)CCC4""",21,"""AF64CBC067C3B013"""
+"""B573512645F8237F_E5801F60BAAE04DC_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=CC(=C3)C#CC""",21,"""AF64CBC067C3B013"""
+"""C5E27C4EF4917362_E5849B12ABC62F43_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=CC(=C3)CSC""",21,"""AF64CBC067C3B013"""
+"""125163B23849B875_656A2B3C09D10346_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CN=C(C=C3)[N](=O)=O""",21,"""AF64CBC067C3B013"""
+"""279733125F81DF55_3D312910AF49F16C_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CSC=C3C(F)(F)F""",21,"""AF64CBC067C3B013"""
+"""F05DBEEB35E3131A_143ACC7A1FC6F4ED_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC(=CC=C3)C(=O)O""",21,"""AF64CBC067C3B013"""
+"""0A357FB250013EE0_F636397B2AF7BB6E_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C4=C3[NH]C=CC3=CC=C4""",21,"""AF64CBC067C3B013"""
+"""B98FC1F7B6E9ABD8_35D68C2B8BAECA79_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=C(C=C(C)C=C3F)F""",21,"""AF64CBC067C3B013"""
+"""6A42D897CD3BFB4B_816DF2233CF5EB22_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=CC4=NON=C34""",21,"""AF64CBC067C3B013"""
+"""4DF837DECDE9131B_C617AC7B51FFB85A_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=C(C(=C(C)C=C3)F)F""",21,"""AF64CBC067C3B013"""
+"""2D026B2845D13071_87DCE7BA5B6295DE_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C4=C[N]3C=NN=C3C=C4""",21,"""AF64CBC067C3B013"""
+"""E706A96D0DA43C96_69EA0472D95C4672_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC(=C(C=C3)F)OC""",21,"""AF64CBC067C3B013"""
+"""1C1F951E9ACFE803_7F3747C31EC9D90E_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=C(C=C(C)C=C3C)C""",21,"""AF64CBC067C3B013"""
+"""41358437E4FDE72B_0AFC188C591DBF82_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=C(OC)C=CC=C3F""",21,"""AF64CBC067C3B013"""
+"""73EE8F12E9AC7A8F_DAAFB88F57C388AE_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=C(C(N)=O)C=C3""",21,"""AF64CBC067C3B013"""
+"""AE628D5B198BCF49_00D091B3EDD46D1B_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC(=C(OC)C=C3)F""",21,"""AF64CBC067C3B013"""
+"""DB4DEA8C13020BD6_58789276BDB981C7_6006_DP""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C4=C3[N](CCNC3)N=C4""",21,"""AF64CBC067C3B013"""
+"""F05DBEEB35E3131A_5429F02E461FD4DC_6006_DP""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=CC(=C3)C(O)=O""",21,"""AF64CBC067C3B013"""
+"""C479D9A263C588C8_7D829A18B46DC4A7_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=CC(=C3F)OC""",21,"""AF64CBC067C3B013"""
+"""8EA3479BA384F753_CA1DED667C9C06CF_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=C(C=CC(=C3)OC)C""",21,"""AF64CBC067C3B013"""
+"""9BE7703274C40CEA_DB4541811DD877C2_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C4=C3OC=CC3=CC=C4""",21,"""AF64CBC067C3B013"""
+"""47A06B3D8EB6E6C2_62B445241CA643F4_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=C(OC)C=C(C=C3)F""",21,"""AF64CBC067C3B013"""
+"""8563B9DB14E1032B_62E9596C421DD53D_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC(=C(OC)C=C3)C""",21,"""AF64CBC067C3B013"""
+"""B47E70A030842F60_72AE3624F511BAA2_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=C(C(C)O)C=C3""",21,"""AF64CBC067C3B013"""
+"""A777D0B7B2A32B1D_7A8A8A9BCA35FD83_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=COC(=C3)C(F)(F)F""",21,"""AF64CBC067C3B013"""
+"""C94F7E014ABA5E5A_647FCC1E75A7AA70_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC(=CS3)C(F)(F)F""",21,"""AF64CBC067C3B013"""
+"""40D217AA03C02DDC_E7EECEDAF4469C6B_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CN=C(N(C)C)N=C3""",21,"""AF64CBC067C3B013"""
+"""1C519C388ED2521F_326F274EC25D44A8_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C4=CC3=C(C=CC=N3)S4""",21,"""AF64CBC067C3B013"""
+"""72CC1A886A4BA9BA_851AA7F1CA2E42D0_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=C(C(=CC=C3O)F)F""",21,"""AF64CBC067C3B013"""
+"""B9331ACDE22BCFB2_62599D7B9B6841CA_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CSC4=C3C=CC=C4""",21,"""AF64CBC067C3B013"""
+"""1E3DADABD2677791_1D5F21CE5C5F335D_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=C[N]4N=CC=C34""",21,"""AF64CBC067C3B013"""
+"""67D8DA4B92CF0AE4_A4F5084FDD19D8EA_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CN=C(C=C3)C(F)F""",21,"""AF64CBC067C3B013"""
+"""B70301CB31EB5D5F_CFEED444FF7E2866_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC4=C(C=C3)CCO4""",21,"""AF64CBC067C3B013"""
+"""E02DFDFD2AB20213_992DAEB0CB047BE5_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=C(C=C3)[N](=O)=O""",21,"""AF64CBC067C3B013"""
+"""52FCB586167E9BF0_62E3AA150427CE7E_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""AF64CBC067C3B013"""
+"""7018D1E210489519_C657C99575FE9C3C_6006_UN""","""OC(=O)C1=NC=C(C(=C1)C2CC2)C3=CC=C(S3)C(F)(F)F""",21,"""AF64CBC067C3B013"""
+"""AFBB6CB231D605E5_D1514983AE427774_6036_UN""","""CC[C@@H](C1=CC(=CC=C1)[N](=O)=O)N([S](C)(=O)=O)CCCN""",21,"""AFCE75CF6311D055"""
+"""0A6489B5E1281F14_7BA47D25AEBE38DA_6036_UN""","""CC[C@@H](C1=CC(=CC=C1)[N](=O)=O)N([S](CC)(=O)=O)CCBr""",21,"""AFCE75CF6311D055"""
+"""BFC176E8C63776F7_75288B0ABBF5A63B_6036_UN""","""CC[C@@H](C1=CC(=CC=C1)[N](=O)=O)N(CCNC)[S](=O)(=O)C""",21,"""AFCE75CF6311D055"""
+"""4ECF7DD1157D52FA_8952B74EB0846B31_6036_UN""","""CC[C@@H](C1=CC(=CC=C1)[N](=O)=O)N([S](CCCC)(=O)=O)C""",21,"""AFCE75CF6311D055"""
+"""67F815D1A45930C0_BD4155136224106E_6036_UN""","""CC[C@@H](C1=CC(=CC=C1)[N](=O)=O)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""AFCE75CF6311D055"""
+"""39B58903FE7A7EF3_ADA744A1D31649A3_6036_UN""","""CC[C@@H](C1=CC(=CC=C1)[N](=O)=O)N([S](C)(=O)=O)CCC#C""",21,"""AFCE75CF6311D055"""
+"""E8A705EBE8AF6901_A4E54A143D296407_6036_UN""","""CC[C@@H](C1=CC(=CC=C1)[N](=O)=O)N(C)[S](=O)(=O)CCCCl""",21,"""AFCE75CF6311D055"""
+"""1C70F6457413A31C_E51900103B39FDCC_6036_UN""","""CC[C@@H](C1=CC(=CC=C1)[N](=O)=O)N([S](CC)(=O)=O)CC#C""",21,"""AFCE75CF6311D055"""
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+"""A9B4BCD40A2E8283_CA56093963264950_6006_UN""","""NC1=CC(=CC=C1)C2=C(SN=N2)C3=CC(=C(C(=C3)F)F)F""",21,"""AFE2FDF256CC99C4"""
+"""E24FE2DAFD4C04E5_E757AEAF44D07C6C_6006_UN""","""NC1=CC(=CC=C1)C2=C(SN=N2)C3=CC=C(C(C)C)C=C3""",21,"""AFE2FDF256CC99C4"""
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+"""CAAA3B07D28F2A63_E502AD209AC90694_6006_UN""","""NC1=CC(=CC=C1)C2=C(SN=N2)C3=CC=CC(=C3)CSC""",21,"""AFE2FDF256CC99C4"""
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+"""CA3B409F13A86B43_696C3240E8536FA5_6006_UN""","""NC1=CC(=CC=C1)C2=C(SN=N2)C3=CC(=C(C=C3)F)OC""",21,"""AFE2FDF256CC99C4"""
+"""1C1FAD0427C3044C_7FB171F12FC6F0D9_6006_UN""","""NC1=CC(=CC=C1)C2=C(SN=N2)C3=C(C=C(C)C=C3C)C""",21,"""AFE2FDF256CC99C4"""
+"""EF0EBC13B7778E82_0A7A2EBE68129655_6006_UN""","""NC1=CC(=CC=C1)C2=C(SN=N2)C3=C(OC)C=CC=C3F""",21,"""AFE2FDF256CC99C4"""
+"""ABA33342F6107DA3_DA298EBD66CCA179_6006_UN""","""NC1=CC(=CC=C1)C2=C(SN=N2)C3=CC=C(C(N)=O)C=C3""",21,"""AFE2FDF256CC99C4"""
+"""7C16401C8665F22F_0056A781DCDB44CC_6006_UN""","""NC1=CC(=CC=C1)C2=C(SN=N2)C3=CC(=C(OC)C=C3)F""",21,"""AFE2FDF256CC99C4"""
+"""BECBE13EF4D87CF6_58FEA4448CB6A810_6006_DP""","""NC1=CC(=CC=C1)C2=C(SN=N2)C4=C3[N](CCNC3)N=C4""",21,"""AFE2FDF256CC99C4"""
+"""BF1DFC3C8221925C_54AFC61C7710FD0B_6006_DP""","""NC1=CC(=CC=C1)C2=C(SN=N2)C3=CC=CC(=C3)C(O)=O""",21,"""AFE2FDF256CC99C4"""
+"""99616394AF4FBBA4_7D04AC2A8562ED70_6006_UN""","""NC1=CC(=CC=C1)C2=C(SN=N2)C3=CC=CC(=C3F)OC""",21,"""AFE2FDF256CC99C4"""
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+"""8AE5C3E7A0E89FE1_873901F4385B6284_6006_UN""","""N[S](=O)(=O)C1=C(C=C(S1)C2=CC=C(C=C2)[N](=O)=O)C(=O)O""",21,"""B1706484949CA972"""
+"""88FF78AE75527BE5_7CF70551F778D71F_6006_UN""","""N[S](=O)(=O)C1=C(C=C(S1)C2=CC3=C(C=C2)C=N[NH]3)C(=O)O""",21,"""B1706484949CA972"""
+"""8509409865EFD270_D84366D186A1855D_6006_UN""","""N[S](=O)(=O)C1=C(C=C(S1)C2=CC=C(S2)C(F)(F)F)C(=O)O""",21,"""B1706484949CA972"""
+"""348A1F10A475BEB7_D437DFB35D0C9FB8_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC(=C(C(=C2)F)F)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""23F09F048EF01BAE_F93678257AFAAA84_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=C(C(C)C)C=C2)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""7F3578F69881BF74_5BB5BF14AAE38141_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC3=C(C=C2)CCC3)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""1D7ABF8C003FCD20_FB67FFD8B58BFBE3_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=CC(=C2)C#CC)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""CF7C504A2FBA4AC9_FB637BAAA4E3D07C_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=CC(=C2)CSC)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""7F697C49C152DC04_7B8DCB8406F4FC79_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CN=C(C=C2)[N](=O)=O)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""752113F181631DA8_23D6C9A8A06C0E53_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CSC=C2C(F)(F)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""895B925BD70D85CF_0ADD2CC210E30BD2_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC(=CC=C2)C(=O)O)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""F69657EBCE34E0DD_E8D1D9C325D24451_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C3=C2[NH]C=CC2=CC=C3)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""2C9865D5C52FC09E_2B316C93848B3546_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=C(C=C(C)C=C2F)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""FCAB399FBDD84B0E_9F8A129B33D0141D_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=CC3=NON=C23)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""3F80DC17DD37E272_D8F04CC35EDA4765_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=C(C(=C(C)C=C2)F)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""E0E011A8CE0F36E9_993B070254476AE1_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C3=C[N]2C=NN=C2C=C3)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""B44B233F8B83739F_770DE4CAD679B94D_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC(=C(C=C2)F)OC)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""87FD4DCF6D5B6650_61D0A77B11EC2631_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=C(C=C(C)C=C2C)C)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""8E5D208A732B21A9_141BF834563840BD_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=C(OC)C=CC=C2F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""6D4E5DC2BA82CC79_C448583758E67791_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=C(C(N)=O)C=C2)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""E2FE37B938A613E2_1E37710BE2F19224_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC(=C(OC)C=C2)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""EDDB2ACDBC44DDFD_469F72CEB29C7EF8_6006_DP""","""C[N]1N=C(C(=O)O)C(=C1C3=C2[N](CCNC2)N=C3)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""895B925BD70D85CF_4ACE1096493A2BE3_6006_DP""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=CC(=C2)C(O)=O)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""81022782CA8EF720_63657AA0BB483B98_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=CC(=C2F)OC)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""2DF93175DFE542DE_D4FA0DDE73B9F9F0_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=C(C=CC(=C2)OC)C)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""BC1A3FA929218929_C5A2A13912FD88FD_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C3=C2OC=CC2=CC=C3)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""8D89360B26BD6F7B_7C53A59C1383BCCB_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=C(OC)C=C(C=C2)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""296560D33983AD3D_7C0EB9D44D382A02_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC(=C(OC)C=C2)C)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""C0FFAEEAD3E3E25B_6C49D69CFA34459D_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=C(C(C)O)C=C2)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""8879E5F049B32A7B_646D6A23C51002BC_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=COC(=C2)C(F)(F)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""E599AC1DAA3A54F0_7A982CA67A82554F_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC(=CS2)C(F)(F)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""5EBC5E5C9667C669_F9092E62FB636354_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CN=C(N(C)C)N=C2)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""656844F2D306B9BF_2C88C7F6CD78BB97_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C3=CC2=C(C=CC=N2)S3)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""901B8EA4F9443C6D_9BFD4749C50BBDEF_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=C(C(=CC=C2O)F)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""B868C7E03EC56DDF_7CBE7DC3944DBEF5_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CSC3=C2C=CC=C3)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""CD25BB99A580921D_03B8C176537ACC62_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=C[N]3N=CC=C23)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""3435F3A4120884A1_BA12E8F7D23C27D5_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CN=C(C=C2)C(F)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""1A131934070F98E4_D10934FCF05BD759_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC3=C(C=C2)CCO3)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""A9B078F8F183140F_87CA4E08C42184DA_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=C(C=C2)[N](=O)=O)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""A3D36DCE71C4E69B_7C044AAD0B023141_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC3=C(C=C2)C=N[NH]3)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""CA7B3D39C77ABF93_D8B0292D7ADB6303_6006_UN""","""C[N]1N=C(C(=O)O)C(=C1C2=CC=C(S2)C(F)(F)F)[N](=O)=O""",21,"""B1832B7868E64F2C"""
+"""7B1531663E71EF3E_D4147348C8BBC917_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC(=C(C(=C2)F)F)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""E288FA35C20528F9_F915D4DEEF4DFC2B_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC=C(C(C)C)C=C2)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""4317D51986C27EF7_5B9613EF3F54D7EE_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC3=C(C=C2)CCC3)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""800C165E6E212941_FB445323203CAD4C_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC=CC(=C2)C#CC)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""688B19B3637695D7_FB40D751315486D3_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC=CC(=C2)CSC)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""E6D065A1FC03CB7F_7BAE677F9343AAD6_6006_UN""","""NC(C1=CN=C(C=C1)C2=CN=C(C=C2)[N](=O)=O)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""F583442FA9664271_23F5655335DB58FC_6006_UN""","""NC(C1=CN=C(C=C1)C2=CSC=C2C(F)(F)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""20E497A767B4FC5F_0AFE803985545D7D_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC(=CC=C2)C(=O)O)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""D7652E0EE659C43A_E8F27538B06512FE_6006_UN""","""NC(C1=CN=C(C=C1)C3=C2[NH]C=CC2=CC=C3)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""54C1D57607A13AB9_2B12C068113C63E9_6006_UN""","""NC(C1=CN=C(C=C1)C2=C(C=C(C)C=C2F)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""DA6E2F5F83BAE0FB_9FA9BE60A66742B2_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC=CC3=NON=C23)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""9CE201CDCC244769_D8D3E038CB6D11CA_6006_UN""","""NC(C1=CN=C(C=C1)C2=C(C(=C(C)C=C2)F)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""EB3347D79C299B75_9918ABF9C1F03C4E_6006_UN""","""NC(C1=CN=C(C=C1)C3=C[N]2C=NN=C2C=C3)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""A253F3521D916AC4_772E483143CEEFE2_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC(=C(C=C2)F)OC)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""645FDEB0C1621285_61F30B80845B709E_6006_UN""","""NC(C1=CN=C(C=C1)C2=C(C=C(C)C=C2C)C)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""5A64B7EBE9638314_143854CFC38F1612_6006_UN""","""NC(C1=CN=C(C=C1)C2=C(OC)C=CC=C2F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""BE351C85FFF8EAD6_C46BF4CCCD51213E_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC=C(C(N)=O)C=C2)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""5A378BA3FB420111_1E14DDF07746C48B_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC(=C(OC)C=C2)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""47F337890A91A167_46BCDE35272B2857_6006_DP""","""NC(C1=CN=C(C=C1)C3=C2[N](CCNC2)N=C3)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""20E497A767B4FC5F_4AEDBC6DDC8D7D4C_6006_DP""","""NC(C1=CN=C(C=C1)C2=CC=CC(=C2)C(O)=O)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""FDA8C98950EF14A1_6346D65B2EFF6D37_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC=CC(=C2F)OC)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""7FF389D61AB6159D_D4D9A125E60EAF5F_6006_UN""","""NC(C1=CN=C(C=C1)C2=C(C=CC(=C2)OC)C)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""5F5B270DB472A3C3_C5810DC2874ADE52_6006_UN""","""NC(C1=CN=C(C=C1)C3=C2OC=CC2=CC=C3)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""C5C24E3A38E8FF5E_7C7009678634EA64_6006_UN""","""NC(C1=CN=C(C=C1)C2=C(OC)C=C(C=C2)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""90E3DFC5154DB6EB_7C2D152FD88F7CAD_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC(=C(OC)C=C2)C)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""2FD478847097056A_6C6A7A676F831332_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC=C(C(C)O)C=C2)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""EE90723F340C5CDF_644EC6D850A75413_6006_UN""","""NC(C1=CN=C(C=C1)C2=COC(=C2)C(F)(F)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""513FD8CE321B619E_7ABB805DEF3503E0_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC(=CS2)C(F)(F)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""62376041632D79F0_F92A82996ED435FB_6006_UN""","""NC(C1=CN=C(C=C1)C2=CN=C(N(C)C)N=C2)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""75841745AED0B03C_2CAB6B0D58CFED38_6006_UN""","""NC(C1=CN=C(C=C1)C3=CC2=C(C=CC=N2)S3)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""24ADB36A5CA6D084_9BDEEBB250BCEB40_6006_UN""","""NC(C1=CN=C(C=C1)C2=C(C(=CC=C2O)F)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""9A7E4813203D00A0_7C9DD13801FAE85A_6006_UN""","""NC(C1=CN=C(C=C1)C2=CSC3=C2C=CC=C3)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""AFAA096C42329C46_039B6D8DC6CD9ACD_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC=C[N]3N=CC=C23)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""115D8FB5E3BAF714_BA31440C478B717A_6006_UN""","""NC(C1=CN=C(C=C1)C2=CN=C(C=C2)C(F)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""59351B768E24B722_D12A980765EC81F6_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC3=C(C=C2)CCO3)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""33C13506011B8C31_87E9E2F35196D275_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC=C(C=C2)[N](=O)=O)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""DD1C9FCBFB996517_7C27E6569EB567EE_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""A3F6CFEF1FF38508_D89385D6EF6C35AC_6006_UN""","""NC(C1=CN=C(C=C1)C2=CC=C(S2)C(F)(F)F)C(F)(F)F""",21,"""B1A08783FD511983"""
+"""8A84005F31B28A10_D4118FFC32EFE557_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=CC(=C(C(=C2)F)F)F""",21,"""B1A57B37070535C3"""
+"""126EAE11288FB276_F910286A1519D06B_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=CC=C(C(C)C)C=C2""",21,"""B1A57B37070535C3"""
+"""6383DAFEAEA5D057_5B93EF5BC500FBAE_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=CC3=C(C=C2)CCC3""",21,"""B1A57B37070535C3"""
+"""4B6FC0DBCED76669_FB41AF97DA68810C_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=CC=CC(=C2)C#CC""",21,"""B1A57B37070535C3"""
+"""FBB39B08CC7B3268_FB452BE5CB00AA93_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=CC=CC(=C2)CSC""",21,"""B1A57B37070535C3"""
+"""640BD74F4A0E1D78_7BAB9BCB69178696_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=CN=C(C=C2)[N](=O)=O""",21,"""B1A57B37070535C3"""
+"""5BA2939926128522_23F099E7CF8F74BC_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=CSC=C2C(F)(F)F""",21,"""B1A57B37070535C3"""
+"""A6DBCF555ADE53A4_0AFB7C8D7F00713D_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=CC(=CC=C2)C(=O)O""",21,"""B1A57B37070535C3"""
+"""262E3B1F8BF4BC80_E8F7898C4A313EBE_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C3=C2[NH]C=CC2=CC=C3""",21,"""B1A57B37070535C3"""
+"""B04E83440AD92F84_2B173CDCEB684FA9_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=C(C=C(C)C=C2F)F""",21,"""B1A57B37070535C3"""
+"""6C6B0A9D98226F7E_9FAC42D45C336EF2_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=CC=CC3=NON=C23""",21,"""B1A57B37070535C3"""
+"""E6D3DF14753D87A7_D8D61C8C31393D8A_6006_UN""","""NCC1=C(C=C(C=C1)C(F)(F)F)C2=C(C(=C(C)C=C2)F)F""",21,"""B1A57B37070535C3"""
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+"""BFB4F5236E729913_B22E0030E70D6658_6036_UN""","""CC(C1=C(C2=C(O1)C=CC=C2)C)N([S](C=C)(=O)=O)C3CC3""",21,"""B2994CAFB15F28A9"""
+"""D470CA4869275511_1229803331086FA7_6036_UN""","""CC(C1=C(C2=C(O1)C=CC=C2)C)N3CC4(C[S]3(=O)=O)CC4""",21,"""B2994CAFB15F28A9"""
+"""92D879168CBE486D_DE62F30239577EE5_6036_UN""","""CC(C1=C(C2=C(O1)C=CC=C2)C)N([S](C)(=O)=O)C(=O)CN""",21,"""B2994CAFB15F28A9"""
+"""A14AB68FEF34A14A_3CE1BD34E922412B_6036_UN""","""CC(C1=C(C2=C(O1)C=CC=C2)C)N3CCCCC[S]3(=O)=O""",21,"""B2994CAFB15F28A9"""
+"""6079B4362A726AE8_2E4A21D2EB6A8F77_6036_UN""","""CC(C1=C(C2=C(O1)C=CC=C2)C)N([S](C)(=O)=O)CCCBr""",21,"""B2994CAFB15F28A9"""
+"""1FE441103F936945_7E49208F520E8BA5_6003_UN""","""CC(OC1=CC=C(C=C1)C#N)C2=C(C3=C(O2)C=CC=C3)C""",21,"""B2994CAFB15F28A9"""
+"""71C4B09B6D9CBAA4_4169DA8713963684_6003_UN""","""CC(OC1=CC=CC=C1[N+]#[C-])C2=C(C3=C(O2)C=CC=C3)C""",21,"""B2994CAFB15F28A9"""
+"""7C37EFF7BE27D738_463E2FF572DB0B26_6003_UN""","""CC(OC1=CC=CC=C1C#N)C2=C(C3=C(O2)C=CC=C3)C""",21,"""B2994CAFB15F28A9"""
+"""662993C87DB0F977_AEBE8D91EC25225A_6003_UN""","""CC(OC1=CC=C(C=C1)[N+]#[C-])C2=C(C3=C(O2)C=CC=C3)C""",21,"""B2994CAFB15F28A9"""
+"""3BEEFB59B2DF54F7_208508735308F524_6003_UN""","""CC(OC1=CC=CC(=C1)[N+]#[C-])C2=C(C3=C(O2)C=CC=C3)C""",21,"""B2994CAFB15F28A9"""
+"""DB9AA7CA0DD322DF_D6B94A6B1CF96DF4_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""B30DBEA02913BD60"""
+"""A56593EB95FF0B2B_FBB8EDFD3B0F58C8_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=C(C(C)C)C=C2""",21,"""B30DBEA02913BD60"""
+"""41F1A7361E59D218_593B2ACCEB16730D_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC3=C(C=C2)CCC3""",21,"""B30DBEA02913BD60"""
+"""EA39B20831F4F06B_F9E96A00F47E09AF_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=CC(=C2)C#CC""",21,"""B30DBEA02913BD60"""
+"""D19EA1F545EB5207_F9EDEE72E5162230_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=CC(=C2)CSC""",21,"""B30DBEA02913BD60"""
+"""93F7434F8665C659_79035E5C47010E35_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""B30DBEA02913BD60"""
+"""E7E6EE7F3765CD7E_21585C70E199FC1F_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CSC=C2C(F)(F)F""",21,"""B30DBEA02913BD60"""
+"""6FA593E9500DE10A_0853B91A5116F99E_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC(=CC=C2)C(=O)O""",21,"""B30DBEA02913BD60"""
+"""C3E566D7E0FC9840_EA5F4C1B6427B61D_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""B30DBEA02913BD60"""
+"""E7D8A9C3D81A157C_29BFF94BC57EC70A_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=C(C=C(C)C=C2F)F""",21,"""B30DBEA02913BD60"""
+"""FE62FC50F518A591_9D0487437225E651_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=CC3=NON=C23""",21,"""B30DBEA02913BD60"""
+"""847880187777B3CF_DA7ED91B1F2FB529_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=C(C(=C(C)C=C2)F)F""",21,"""B30DBEA02913BD60"""
+"""4C77889F1A1A9414_9BB592DA15B298AD_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C3=C[N]2C=NN=C2C=C3""",21,"""B30DBEA02913BD60"""
+"""5C6AC6B677F3A8D0_75837112978C4B01_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC(=C(C=C2)F)OC""",21,"""B30DBEA02913BD60"""
+"""F547AA92956C4E32_635E32A35019D47D_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=C(C=C(C)C=C2C)C""",21,"""B30DBEA02913BD60"""
+"""980716BBE5A1ABBD_16956DEC17CDB2F1_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=C(OC)C=CC=C2F""",21,"""B30DBEA02913BD60"""
+"""690A43F1CE0C34CC_C6C6CDEF191385DD_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=C(C(N)=O)C=C2""",21,"""B30DBEA02913BD60"""
+"""5BF8B78EACC40E13_1CB9E4D3A3046068_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC(=C(OC)C=C2)F""",21,"""B30DBEA02913BD60"""
+"""8ECEAC15F1F590F2_4411E716F3698CB4_6006_DP""","""FC(F)(F)COC1=NN=C(C=C1)C3=C2[N](CCNC2)N=C3""",21,"""B30DBEA02913BD60"""
+"""6FA593E9500DE10A_4840854E08CFD9AF_6006_DP""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=CC(=C2)C(O)=O""",21,"""B30DBEA02913BD60"""
+"""25233BA0474CEF0E_61EBEF78FABDC9D4_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=CC(=C2F)OC""",21,"""B30DBEA02913BD60"""
+"""3C1A99130056BD0E_D6749806324C0BBC_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=C(C=CC(=C2)OC)C""",21,"""B30DBEA02913BD60"""
+"""DD4B702068720FF4_C72C34E153087AB1_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C3=C2OC=CC2=CC=C3""",21,"""B30DBEA02913BD60"""
+"""FEA7A4A475E213E3_7EDD304452764E87_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=C(OC)C=C(C=C2)F""",21,"""B30DBEA02913BD60"""
+"""1B74481047B846FB_7E802C0C0CCDD84E_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC(=C(OC)C=C2)C""",21,"""B30DBEA02913BD60"""
+"""A9EF14E1A98F3AB1_6EC74344BBC1B7D1_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=C(C(C)O)C=C2""",21,"""B30DBEA02913BD60"""
+"""C67E716EEBDBD3BD_66E3FFFB84E5F0F0_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=COC(=C2)C(F)(F)F""",21,"""B30DBEA02913BD60"""
+"""D479C63609839869_7816B97E3B77A703_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC(=CS2)C(F)(F)F""",21,"""B30DBEA02913BD60"""
+"""0CE901863B9C4146_FB87BBBABA969118_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CN=C(N(C)C)N=C2""",21,"""B30DBEA02913BD60"""
+"""BC2F6713A126C238_2E06522E8C8D49DB_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C3=CC2=C(C=CC=N2)S3""",21,"""B30DBEA02913BD60"""
+"""C093AABC4CA60BCA_9973D29184FE4FA3_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=C(C(=CC=C2O)F)F""",21,"""B30DBEA02913BD60"""
+"""04688B66DC7024E0_7E30E81BD5B84CB9_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CSC3=C2C=CC=C3""",21,"""B30DBEA02913BD60"""
+"""03EC3877349B3DC7_013654AE128F3E2E_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=C[N]3N=CC=C23""",21,"""B30DBEA02913BD60"""
+"""56B906D3DF28870F_B89C7D2F93C9D599_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CN=C(C=C2)C(F)F""",21,"""B30DBEA02913BD60"""
+"""7EB8FE02FD2C34A4_D387A124B1AE2515_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC3=C(C=C2)CCO3""",21,"""B30DBEA02913BD60"""
+"""DA389522B198F251_8544DBD085D47696_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""B30DBEA02913BD60"""
+"""0778134ADBF84E58_7E8ADF754AF7C30D_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""B30DBEA02913BD60"""
+"""5B2D9764E64DF386_DA3EBCF53B2E914F_6006_UN""","""FC(F)(F)COC1=NN=C(C=C1)C2=CC=C(S2)C(F)(F)F""",21,"""B30DBEA02913BD60"""
+"""D45FFBFC2194A74C_D6AFB6AA5E8B53B1_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC(=C(C(=C3)F)F)F""",21,"""B31B42616B618325"""
+"""6DACFAC01335CA15_FBAE113C797D668D_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=C(C(C)C)C=C3""",21,"""B31B42616B618325"""
+"""D68FCB17F9CED179_592DD60DA9644D48_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC4=C(C=C3)CCC4""",21,"""B31B42616B618325"""
+"""7A83933C09F85F69_F9FF96C1B60C37EA_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=CC(=C3)C#CC""",21,"""B31B42616B618325"""
+"""0C831B02503CEB7A_F9FB12B3A7641C75_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=CC(=C3)CSC""",21,"""B31B42616B618325"""
+"""57B7D8D7133C32E2_7915A29D05733070_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CN=C(C=C3)[N](=O)=O""",21,"""B31B42616B618325"""
+"""18012238E4CA2C82_214EA0B1A3EBC25A_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CSC=C3C(F)(F)F""",21,"""B31B42616B618325"""
+"""426EB31EE7E1E2B3_084545DB1364C7DB_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC(=CC=C3)C(=O)O""",21,"""B31B42616B618325"""
+"""943EB210991A6B14_EA49B0DA26558858_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C4=C3[NH]C=CC3=CC=C4""",21,"""B31B42616B618325"""
+"""5923B45CFC41F908_29A9058A870CF94F_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=C(C=C(C)C=C3F)F""",21,"""B31B42616B618325"""
+"""989E3B261F89955E_9D127B823057D814_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=CC4=NON=C34""",21,"""B31B42616B618325"""
+"""8DAD3309ACF089B5_DA6825DA5D5D8B6C_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=C(C(=C(C)C=C3)F)F""",21,"""B31B42616B618325"""
+"""069DC4A993E675CC_9BA36E1B57C0A6E8_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C4=C[N]3C=NN=C3C=C4""",21,"""B31B42616B618325"""
+"""DB57F76E5A86FE17_75958DD3D5FE7544_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC(=C(C=C3)F)OC""",21,"""B31B42616B618325"""
+"""C738293E9C68053F_6348CE62126BEA38_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=C(C=C(C)C=C3C)C""",21,"""B31B42616B618325"""
+"""5999E6102E9D5196_1683912D55BF8CB4_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=C(OC)C=CC=C3F""",21,"""B31B42616B618325"""
+"""0EB0824A10477853_C6D0312E5B61BB98_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=C(C(N)=O)C=C3""",21,"""B31B42616B618325"""
+"""20BA523255346B1F_1CAF1812E1765E2D_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC(=C(OC)C=C3)F""",21,"""B31B42616B618325"""
+"""38FF0F15730CAF3C_44071BD7B11BB2F1_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C4=C3[N](CCNC3)N=C4""",21,"""B31B42616B618325"""
+"""426EB31EE7E1E2B3_4856798F4ABDE7EA_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=CC(=C3)C(O)=O""",21,"""B31B42616B618325"""
+"""5D1417AEF5919F61_61FD13B9B8CFF791_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=CC(=C3F)OC""",21,"""B31B42616B618325"""
+"""0E37C3273591B2DA_D66264C7703E35F9_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=C(C=CC(=C3)OC)C""",21,"""B31B42616B618325"""
+"""7C3CBDB603AE0458_C73AC820117A44F4_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C4=C3OC=CC3=CC=C4""",21,"""B31B42616B618325"""
+"""7ADDE49EA4396975_7ECBCC85100470C2_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=C(OC)C=C(C=C3)F""",21,"""B31B42616B618325"""
+"""6181201E3B714039_7E96D0CD4EBFE60B_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC(=C(OC)C=C3)C""",21,"""B31B42616B618325"""
+"""176DC8987D8CD2B3_6ED1BF85F9B38994_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=C(C(C)O)C=C3""",21,"""B31B42616B618325"""
+"""893AA919C8423453_66F5033AC697CEB5_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=COC(=C3)C(F)(F)F""",21,"""B31B42616B618325"""
+"""E6CC064F9E5E67BD_780045BF79059946_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC(=CS3)C(F)(F)F""",21,"""B31B42616B618325"""
+"""3C4FDBC4C8FF00BD_FB91477BF8E4AF5D_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CN=C(N(C)C)N=C3""",21,"""B31B42616B618325"""
+"""5ECF38F263705407_2E10AEEFCEFF779E_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C4=CC3=C(C=CC=N3)S4""",21,"""B31B42616B618325"""
+"""A95AD026FCC81C8A_99652E50C68C71E6_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=C(C(=CC=C3O)F)F""",21,"""B31B42616B618325"""
+"""513CB60D3701D868_7E2614DA97CA72FC_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CSC4=C3C=CC=C4""",21,"""B31B42616B618325"""
+"""80126EBA0D92757D_0120A86F50FD006B_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=C[N]4N=CC=C34""",21,"""B31B42616B618325"""
+"""291FCCA38A3589E3_B88A81EED1BBEBDC_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CN=C(C=C3)C(F)F""",21,"""B31B42616B618325"""
+"""A7D52BF7E38C892A_D3915DE5F3DC1B50_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC4=C(C=C3)CCO4""",21,"""B31B42616B618325"""
+"""EE0E752F1ADE21D9_85522711C7A648D3_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=C(C=C3)[N](=O)=O""",21,"""B31B42616B618325"""
+"""E5C4CF14C48501AF_7E9C23B40885FD48_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""B31B42616B618325"""
+"""3E16C3C67D292D63_DA284034795CAF0A_6006_DP""","""N1CCN(CC1)C2=NC(=NC=C2)C3=CC=C(S3)C(F)(F)F""",21,"""B31B42616B618325"""
+"""A58C508D33673688_BF686AFB60AF3857_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=CC=C(F)C=C2)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""B29E7F23B39EB4E7_4AECF080B1F85DBC_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=CC=C(C)C=C2)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""65323A46D85CB747_03AC25EDA0FA9212_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=C(C)[NH]C(=C2)C)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""2CC1512855D8D49E_AC83528E451B6586_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=CC=CC(=C2)C)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""3468C1738F266E0B_943B9269A493A489_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=C[N](N=C2C)C)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""E30E5691D2B799D0_9C68B7A52A164221_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=C(N=C(C)O2)C)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""FF74C8FD6E16F8D1_D87B05444512F715_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=CC=CC(=C2)Cl)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""1C2F16851B5F6567_EBF6911A6C437877_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=CC=C(C=C2)Br)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""244582994EFD4708_9ADC2E1099A00173_1171_UN""","""CC(C)N(CCC1=NC(=CS1)CCC(OCC)=O)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""06E818F0D2B09290_7603BE97C9E08791_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=CN=CC(=C2)F)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""A8FDDC064EE7676D_4294F7C837CA1389_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=NC=CC(=C2)C)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""A48B38882EDE42AA_D3C862F88974D407_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=C(C)N=CC=C2)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""D5F7D9412DCE1779_B795000151289D3C_1171_UN""","""CC(C)N(CCC1=NC(=CS1)CC(C)(C)C2CC2)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
+"""9106CAFB3427A2D9_4A5743250EE66D9D_1171_UN""","""CC(C)N(CCC1=NC(=CS1)C2=C(Cl)C=CC=C2)C(=O)C""",21,"""B31F66B7DE5AD3A2"""
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+"""E98ABB45B2E37FE4_40C7261491A1AF76_6003_UN""","""CC(C)C(OC1=CC=CC=C1[N+]#[C-])CSC2=CC=CC=C2""",21,"""B337B03C3368B15B"""
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+"""EFBB2E2608D2025D_EA2D4C84C2D21F06_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C3=C2[NH]C=CC2=CC=C3""",21,"""B37FBE3F8FE6147B"""
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+"""0373907DC01BD067_16E76D73B1381BEA_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C2=C(OC)C=CC=C2F""",21,"""B37FBE3F8FE6147B"""
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+"""EB4B7B0BF372DE46_1CCBE44C05F1C973_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C2=CC(=C(OC)C=C2)F""",21,"""B37FBE3F8FE6147B"""
+"""DC02C07DBB615D55_4463E789559C25AF_6006_DP""","""C1(=NC=CC(=C1)C(=O)NCC#C)C3=C2[N](CCNC2)N=C3""",21,"""B37FBE3F8FE6147B"""
+"""16F6019FA4278CD5_483285D1AE3A70B4_6006_DP""","""C1(=NC=CC(=C1)C(=O)NCC#C)C2=CC=CC(=C2)C(O)=O""",21,"""B37FBE3F8FE6147B"""
+"""7F6A1A8408884521_6199EFE75C4860CF_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C2=CC=CC(=C2F)OC""",21,"""B37FBE3F8FE6147B"""
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+"""9B8B86AB760C43F8_7EAF30DBF483E79C_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C2=C(OC)C=C(C=C2)F""",21,"""B37FBE3F8FE6147B"""
+"""E9AE01D7F445E750_7EF22C93AA387155_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C2=CC(=C(OC)C=C2)C""",21,"""B37FBE3F8FE6147B"""
+"""59468369CB1F0918_6EB543DB1D341ECA_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C2=CC=C(C(C)O)C=C2""",21,"""B37FBE3F8FE6147B"""
+"""3F23F5A20818C65E_6691FF64221059EB_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C2=COC(=C2)C(F)(F)F""",21,"""B37FBE3F8FE6147B"""
+"""20325F6FFF2A0DF6_7864B9E19D820E18_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C2=CC(=CS2)C(F)(F)F""",21,"""B37FBE3F8FE6147B"""
+"""88B165E3B2F663E1_FBF5BB251C633803_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C2=CN=C(N(C)C)N=C2""",21,"""B37FBE3F8FE6147B"""
+"""F8D820ED54C8A848_2E7452B12A78E0C0_6006_UN""","""C1(=NC=CC(=C1)C(=O)NCC#C)C3=CC2=C(C=CC=N2)S3""",21,"""B37FBE3F8FE6147B"""
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+"""A706D14EC6D1CA80_B494499D885163B6_6036_UN""","""COC(=O)C1=CC=C(C=C1)[C@H](C)N([S](C=C)(=O)=O)C2CC2""",21,"""B4230502DE032D47"""
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+"""417499B94319323B_28F0687F84368A99_6036_UN""","""COC(=O)C1=CC=C(C=C1)[C@H](C)N([S](C)(=O)=O)CCCBr""",21,"""B4230502DE032D47"""
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+"""D3456879B1403D10_408466581D870EC8_6003_UN""","""COC(=O)C1=CC=C(C=C1)[C@H](C)OC2=CC=CC=C2C#N""",21,"""B4230502DE032D47"""
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+"""0A41DD605107908D_6EDFEF5028F2F711_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N(CCNC)[S](=O)(=O)C""",21,"""B4391195F016817F"""
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+"""276507F7824E26BB_A6B63149F1234144_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""B4391195F016817F"""
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+"""37A75EF278467652_BF122E4EAE2E352D_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N(C)[S](=O)(=O)CCCCl""",21,"""B4391195F016817F"""
+"""2D2F1C715FB246C5_FEEE644AA83EACE6_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N([S](CC)(=O)=O)CC#C""",21,"""B4391195F016817F"""
+"""C83069A4782552A1_A73D881CCBFD5586_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N3[S](CCCC3=O)(=O)=O""",21,"""B4391195F016817F"""
+"""6CA5DAC5C09E1D45_75C3148434046BD0_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""B4391195F016817F"""
+"""6E1DD556D2EA8041_500A73076AEBF604_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N([S](C)(=O)=O)C3CNC3""",21,"""B4391195F016817F"""
+"""DBEA578A3B5ECA84_8ADD9CF4080D592B_6036_DP""","""C(C1=NC(=CS1)C2CCCCC2)N[S](=O)(=O)C3(CC3)C#N""",21,"""B4391195F016817F"""
+"""070684E612E3BA76_9DD1C5D8D79CCF23_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N(C)[S](=O)(=O)CCCN""",21,"""B4391195F016817F"""
+"""7E7718731F0BA521_34C8E63C6AD83B1C_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N(C)[S](=O)(=O)C3COC3""",21,"""B4391195F016817F"""
+"""4404D6075430C711_54ED37DEB6758B83_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N(C)[S](=O)(=O)CCOC""",21,"""B4391195F016817F"""
+"""3F267CCEB31DFAB7_FA33AA3C62455996_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N(C)[S](=O)(=O)CC(=O)C""",21,"""B4391195F016817F"""
+"""7F2DEC2D97A332C6_721BCC88A4CB6ADB_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N3CCCC(C)[S]3(=O)=O""",21,"""B4391195F016817F"""
+"""B05620634D05D1C8_7FF4EA6F1DF2517E_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N3CCC(C)(C)[S]3(=O)=O""",21,"""B4391195F016817F"""
+"""C5F01B278590D78A_445C4BAE1CC5A321_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N([S](CC)(=O)=O)CCN""",21,"""B4391195F016817F"""
+"""23FCA5827409980B_05F1D7142283A595_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N(CC)[S](=O)(=O)CCN""",21,"""B4391195F016817F"""
+"""5A9C24AA2E64000F_BF627CE1239550D8_6036_UN""","""C(C1=NC(=CS1)C2CCCCC2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""B4391195F016817F"""
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+"""06AA4904CB94C12E_D4A960F59C615897_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=C(ON=C3C)C""",21,"""B4FF108EC0A6B8E8"""
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+"""66650FE1066B8729_9C1F300BB4F4A704_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=CC=C(O)C=C3""",21,"""B4FF108EC0A6B8E8"""
+"""D970A90246B18165_14EDB625DE4E118F_1171_UN""","""CC(C)C1=CC=C(C=C1)C3=NC(=C(C2=CC=CC=C2)S3)C""",21,"""B4FF108EC0A6B8E8"""
+"""3CFA959894F456DF_2F9D13EAF1D7301D_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=N[N](CC)N=C3""",21,"""B4FF108EC0A6B8E8"""
+"""EE76B56317C3E00A_DEEA22B864D83A37_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=C(F)C=CC=C3""",21,"""B4FF108EC0A6B8E8"""
+"""F8A27D090654B6E6_0A66BADE593416EE_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=CC=CC(=C3)F""",21,"""B4FF108EC0A6B8E8"""
+"""B0154AF5127DA555_00E153C022A70BF4_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=C(C)S2)CCC(OC)=O""",21,"""B4FF108EC0A6B8E8"""
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+"""B436C05D7D5A774A_71A267E74E82FA59_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=C(C)SC(=C3)C""",21,"""B4FF108EC0A6B8E8"""
+"""BFC02DB261591D55_10130E8B5B15B1B7_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=C(CC[S](=O)(=O)Cl)S2)C""",21,"""B4FF108EC0A6B8E8"""
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+"""636590C00E03B2C2_FD29B8DEF8B8B2CF_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=CC(=NC=C3)F""",21,"""B4FF108EC0A6B8E8"""
+"""7978602DDB5B42CA_D3E1753CD219A640_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=C(C)C=C(O3)Br""",21,"""B4FF108EC0A6B8E8"""
+"""3813E19C07A1FD56_8BAAD91F4D22A3C5_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=N[N](C(=C3)C)C""",21,"""B4FF108EC0A6B8E8"""
+"""6FF016C24CFC00C5_CABD6BAB26DEE018_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3C(C)(C)C3(C)C""",21,"""B4FF108EC0A6B8E8"""
+"""DDBDB995ED441D18_C123E36A2FC29660_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=C[N](CC)N=C3""",21,"""B4FF108EC0A6B8E8"""
+"""87FD9AA7AEB34CA1_9A39827FA523F2C9_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=CC(=N[N]3C)C""",21,"""B4FF108EC0A6B8E8"""
+"""AB19F31734CE1B95_3DD1B80F61CA7818_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=C(CC)S2)C(OCC)=O""",21,"""B4FF108EC0A6B8E8"""
+"""5339E8B004BB77DF_384B79DEB78BCE79_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=C(C)C=CC=C3""",21,"""B4FF108EC0A6B8E8"""
+"""DE35A148F0DD00D2_C25A40BADEB09C25_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=NN=C(Cl)C=C3""",21,"""B4FF108EC0A6B8E8"""
+"""2A77F64E78C46A69_904F9B0BE83667A6_1171_UN""","""CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C3=C(C)[N](N=C3)C""",21,"""B4FF108EC0A6B8E8"""
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+"""21C19AAC311C6BA5_57C07370DA1E0495_6036_UN""","""CC1=C(C=C(C=C1)CCCCN(C)[S](=O)(=O)CCOC)C""",21,"""B714553B9C7D0E69"""
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+"""20A3A4DB4F79A704_71368826C8A0E5CD_6036_UN""","""CC1=C(C=C(C=C1)CCCCN2CCCC(C)[S]2(=O)=O)C""",21,"""B714553B9C7D0E69"""
+"""A01C2D9288075530_7CD9AEC17199DE68_6036_UN""","""CC1=C(C=C(C=C1)CCCCN2CCC(C)(C)[S]2(=O)=O)C""",21,"""B714553B9C7D0E69"""
+"""F3433EAEDCCA46CA_47710F0070AE2C37_6036_UN""","""CC1=C(C=C(C=C1)CCCCN([S](CC)(=O)=O)CCN)C""",21,"""B714553B9C7D0E69"""
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+"""0B1008F8303FF8F3_BC4F384F4FFEDFCE_6036_UN""","""CC1=C(C=C(C=C1)CCCCN(C)[S](=O)(=O)C(C)(C)C)C""",21,"""B714553B9C7D0E69"""
+"""43839DF8B806CBB0_34770B258D53CAF2_6036_UN""","""CC1=C(C=C(C=C1)CCCCN2[S](=O)(=O)C3(CC2)CC3)C""",21,"""B714553B9C7D0E69"""
+"""46FBEADB2B2A8232_5B519D1818D582AC_6036_UN""","""CC1=C(C=C(C=C1)CCCCN([S](CCNC)(=O)=O)C)C""",21,"""B714553B9C7D0E69"""
+"""46FBEADB2B2A8232_87A1678EE14A898A_6036_DP""","""CC1=C(C=C(C=C1)CCCCN(C)[S](=O)(=O)CCNC)C""",21,"""B714553B9C7D0E69"""
+"""78B3064A2D51BD0C_961CE3629A704E51_6036_UN""","""CC1=C(C=C(C=C1)CCCCN2[S](CCC2CI)(=O)=O)C""",21,"""B714553B9C7D0E69"""
+"""DD95E7EB6BF5A6DD_0A1A48AAE07E409C_6036_UN""","""CC1=C(C=C(C=C1)CCCCN2C(CN)CC[S]2(=O)=O)C""",21,"""B714553B9C7D0E69"""
+"""19A8103839BB1930_994D975098B4EDE4_6036_UN""","""CC1=C(C=C(C=C1)CCCCN(CC(C)C)[S](=O)(=O)C)C""",21,"""B714553B9C7D0E69"""
+"""0ED65D8CD1A2819A_054402FAE1BE8033_6036_UN""","""CC1=C(C=C(C=C1)CCCCN2[S](=O)(CCNCC2)=O)C""",21,"""B714553B9C7D0E69"""
+"""8C20BB6601793E49_B7A319A4CA2F4098_6036_UN""","""CC1=C(C=C(C=C1)CCCCN([S](C=C)(=O)=O)C2CC2)C""",21,"""B714553B9C7D0E69"""
+"""B3323EAB1D7DFD07_17A499A71C2A4967_6036_UN""","""CC1=C(C=C(C=C1)CCCCN2CC3(C[S]2(=O)=O)CC3)C""",21,"""B714553B9C7D0E69"""
+"""69E99616CB5C34CC_DBEFEA9614755825_6036_UN""","""CC1=C(C=C(C=C1)CCCCN([S](C)(=O)=O)C(=O)CN)C""",21,"""B714553B9C7D0E69"""
+"""D5F180706BCFB364_396CA4A0C40067EB_6036_UN""","""CC1=C(C=C(C=C1)CCCCN2CCCCC[S]2(=O)=O)C""",21,"""B714553B9C7D0E69"""
+"""3EB1918B8A364DD9_2BC73846C648A9B7_6036_UN""","""CC1=C(C=C(C=C1)CCCCN([S](C)(=O)=O)CCCBr)C""",21,"""B714553B9C7D0E69"""
+"""636802A4DF382E06_7BC4391B7F2CAD65_6003_UN""","""CC1=C(C=C(C=C1)CCCCOC2=CC=C(C=C2)C#N)C""",21,"""B714553B9C7D0E69"""
+"""32B107A708B7A935_44E4C3133EB41044_6003_UN""","""CC1=C(C=C(C=C1)CCCCOC2=CC=CC=C2[N+]#[C-])C""",21,"""B714553B9C7D0E69"""
+"""CEB24B9728D4882B_43B336615FF92DE6_6003_UN""","""CC1=C(C=C(C=C1)CCCCOC2=CC=CC=C2C#N)C""",21,"""B714553B9C7D0E69"""
+"""29A77715A56B8959_AB339405C107049A_6003_UN""","""CC1=C(C=C(C=C1)CCCCOC2=CC=C(C=C2)[N+]#[C-])C""",21,"""B714553B9C7D0E69"""
+"""DB02DF4A20AF0D94_250811E77E2AD3E4_6003_UN""","""CC1=C(C=C(C=C1)CCCCOC2=CC=CC(=C2)[N+]#[C-])C""",21,"""B714553B9C7D0E69"""
+"""A567D496960EA5A5_D288DFC25D800C38_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC(=C(C(=C2)F)F)F""",21,"""B73C2B09686ADCAC"""
+"""62ACCAFC6C1CB184_FF8978547A763904_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC=C(C(C)C)C=C2""",21,"""B73C2B09686ADCAC"""
+"""93A2DA26E3D810E3_5D0ABF65AA6F12C1_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC3=C(C=C2)CCC3""",21,"""B73C2B09686ADCAC"""
+"""E41C8D8B89012081_FDD8FFA9B5076863_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC=CC(=C2)C#CC""",21,"""B73C2B09686ADCAC"""
+"""1E412332A02BBB7A_FDDC7BDBA46F43FC_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC=CC(=C2)CSC""",21,"""B73C2B09686ADCAC"""
+"""AD4C58C19AB4940D_7D32CBF506786FF9_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CN=C(C=C2)[N](=O)=O""",21,"""B73C2B09686ADCAC"""
+"""9C6A925F24F54CB7_2569C9D9A0E09DD3_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CSC=C2C(F)(F)F""",21,"""B73C2B09686ADCAC"""
+"""337D4C83F39114BF_0C622CB3106F9852_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC(=CC=C2)C(=O)O""",21,"""B73C2B09686ADCAC"""
+"""2693535C491D1202_EE6ED9B2255ED7D1_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C3=C2[NH]C=CC2=CC=C3""",21,"""B73C2B09686ADCAC"""
+"""33E97FC182A85A08_2D8E6CE28407A6C6_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=C(C=C(C)C=C2F)F""",21,"""B73C2B09686ADCAC"""
+"""80F94F6C0D7541CF_993512EA335C879D_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC=CC3=NON=C23""",21,"""B73C2B09686ADCAC"""
+"""8666373BC0CD7E38_DE4F4CB25E56D4E5_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=C(C(=C(C)C=C2)F)F""",21,"""B73C2B09686ADCAC"""
+"""ECCF7D4A9824536A_9F84077354CBF961_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C3=C[N]2C=NN=C2C=C3""",21,"""B73C2B09686ADCAC"""
+"""CF156FA07D17C547_71B2E4BBD6F52ACD_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC(=C(C=C2)F)OC""",21,"""B73C2B09686ADCAC"""
+"""E36BF007B64D125E_676FA70A1160B5B1_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=C(C=C(C)C=C2C)C""",21,"""B73C2B09686ADCAC"""
+"""ED2D013ECB7D8BD9_12A4F84556B4D33D_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=C(OC)C=CC=C2F""",21,"""B73C2B09686ADCAC"""
+"""D60A14731C89BA37_C2F75846586AE411_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC=C(C(N)=O)C=C2""",21,"""B73C2B09686ADCAC"""
+"""9F5FF61F975025AF_1888717AE27D01A4_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC(=C(OC)C=C2)F""",21,"""B73C2B09686ADCAC"""
+"""14BA3C998D35476E_402072BFB210ED78_6006_DP""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C3=C2[N](CCNC2)N=C3""",21,"""B73C2B09686ADCAC"""
+"""337D4C83F39114BF_4C7110E749B6B863_6006_DP""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC=CC(=C2)C(O)=O""",21,"""B73C2B09686ADCAC"""
+"""5A07FA595CFC6E7D_65DA7AD1BBC4A818_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC=CC(=C2F)OC""",21,"""B73C2B09686ADCAC"""
+"""B3E0B7AD009F2B0B_D2450DAF73356A70_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=C(C=CC(=C2)OC)C""",21,"""B73C2B09686ADCAC"""
+"""84DF25A9F516B2F5_C31DA14812711B7D_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C3=C2OC=CC2=CC=C3""",21,"""B73C2B09686ADCAC"""
+"""2C699E63BBC9AF6E_7AECA5ED130F2F4B_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=C(OC)C=C(C=C2)F""",21,"""B73C2B09686ADCAC"""
+"""80EB8F50DACB5397_7AB1B9A54DB4B982_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC(=C(OC)C=C2)C""",21,"""B73C2B09686ADCAC"""
+"""61EA21A6DDA84CE4_6AF6D6EDFAB8D61D_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC=C(C(C)O)C=C2""",21,"""B73C2B09686ADCAC"""
+"""B0C1EDD1D0640348_62D26A52C59C913C_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=COC(=C2)C(F)(F)F""",21,"""B73C2B09686ADCAC"""
+"""A0C2B81648FDB1DF_7C272CD77A0EC6CF_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC(=CS2)C(F)(F)F""",21,"""B73C2B09686ADCAC"""
+"""C087C3A095773EA1_FFB62E13FBEFF0D4_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CN=C(N(C)C)N=C2""",21,"""B73C2B09686ADCAC"""
+"""D6FD89CC36A7B983_2A37C787CDF42817_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C3=CC2=C(C=CC=N2)S3""",21,"""B73C2B09686ADCAC"""
+"""2EC887BC075A5D02_9D424738C5872E6F_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=C(C(=CC=C2O)F)F""",21,"""B73C2B09686ADCAC"""
+"""5E2173C2F9883E43_7A017DB294C12D75_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CSC3=C2C=CC=C3""",21,"""B73C2B09686ADCAC"""
+"""9EE5E0C86C476AEE_0507C10753F65FE2_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC=C[N]3N=CC=C23""",21,"""B73C2B09686ADCAC"""
+"""9817778267D524C8_BCADE886D2B0B455_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CN=C(C=C2)C(F)F""",21,"""B73C2B09686ADCAC"""
+"""D59D03AD8E059BC0_D7B6348DF0D744D9_6006_UN""","""FC(F)C(=O)C1=CC(=CC(=C1)F)C2=CC3=C(C=C2)CCO3""",21,"""B73C2B09686ADCAC"""
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+"""F78C5C236D37B99E_7C4DF455A05BA152_6006_UN""","""FC(F)CNC1=C(C=NC(=N1)C2=CC(=CS2)C(F)(F)F)F""",21,"""B756F38BB23FBB31"""
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+"""85976199C228F111_9D289FBA1FD249F2_6006_UN""","""FC(F)CNC1=C(C=NC(=N1)C2=C(C(=CC=C2O)F)F)F""",21,"""B756F38BB23FBB31"""
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+"""9F903E4E005E0644_056D198589A3387F_6006_UN""","""FC(F)CNC1=C(C=NC(=N1)C2=CC=C[N]3N=CC=C23)F""",21,"""B756F38BB23FBB31"""
+"""2BAD68ABF223EA9E_BCC7300408E5D3C8_6006_UN""","""FC(F)CNC1=C(C=NC(=N1)C2=CN=C(C=C2)C(F)F)F""",21,"""B756F38BB23FBB31"""
+"""FE66952A13023EB9_D7DCEC0F2A822344_6006_UN""","""FC(F)CNC1=C(C=NC(=N1)C2=CC3=C(C=C2)CCO3)F""",21,"""B756F38BB23FBB31"""
+"""D9D29E32DD0E1AF5_811F96FB1EF870C7_6006_UN""","""FC(F)CNC1=C(C=NC(=N1)C2=CC=C(C=C2)[N](=O)=O)F""",21,"""B756F38BB23FBB31"""
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+"""20A675838BDF9589_DE65F1DEA002971E_6006_UN""","""FC(F)CNC1=C(C=NC(=N1)C2=CC=C(S2)C(F)(F)F)F""",21,"""B756F38BB23FBB31"""
+"""B853FB32D86C15BE_D2CC67DFD6FC9BCA_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C2=CC(=C(C(=C2)F)F)F""",21,"""B7789314E3164B5E"""
+"""40DA8D80E5531D8C_FFCDC049F10AAEF6_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C2=CC=C(C(C)C)C=C2""",21,"""B7789314E3164B5E"""
+"""3E5593F20FDD9DC5_5D4E077821138533_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C2=CC3=C(C=C2)CCC3""",21,"""B7789314E3164B5E"""
+"""9C41F1F7256691F3_FD9C47B43E7BFF91_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C2=CC=CC(=C2)C#CC""",21,"""B7789314E3164B5E"""
+"""8056587E4BFCB3B0_FD98C3C62F13D40E_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C2=CC=CC(=C2)CSC""",21,"""B7789314E3164B5E"""
+"""C48377652DF04598_7D7673E88D04F80B_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C2=CN=C(C=C2)[N](=O)=O""",21,"""B7789314E3164B5E"""
+"""BE3CD3CAFA199C86_252D71C42B9C0A21_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C2=CSC=C2C(F)(F)F""",21,"""B7789314E3164B5E"""
+"""AA6D100B7FDD56D9_0C2694AE9B130FA0_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C2=CC(=CC=C2)C(=O)O""",21,"""B7789314E3164B5E"""
+"""1A837F11786DA8C7_EE2A61AFAE224023_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C3=C2[NH]C=CC2=CC=C3""",21,"""B7789314E3164B5E"""
+"""81A48262D598BD51_2DCAD4FF0F7B3134_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C2=C(C=C(C)C=C2F)F""",21,"""B7789314E3164B5E"""
+"""077807B251704B5A_9971AAF7B820106F_6006_UN""","""COC(=O)C1=C(C(=NC(=N1)C)C)C2=CC=CC3=NON=C23""",21,"""B7789314E3164B5E"""
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+"""8BDB820D3A6E8FA9_2A4F2A8A85DA82D8_6003_UN""","""CCCCCC(OC1=CC=CC(=C1)[N+]#[C-])CC(=O)OCC""",21,"""B8536E56678D5F55"""
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+"""D968DCC1C82DE67E_9F71CC17652CE4CA_1171_UN""","""CCOC1=C(C=C(C=C1)C2=NC(=CS2)C#C[Si](C)(C)C)F""",21,"""B8969E9ED38E5EF4"""
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+"""BCDA36910A508A90_D1108BFAF87FECDF_1171_UN""","""CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=NO3)C)F""",21,"""B8969E9ED38E5EF4"""
+"""13199BD10726457C_481946AC002453C5_1171_UN""","""CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=C(C)ON=C3)F""",21,"""B8969E9ED38E5EF4"""
+"""E292D331B4225ECA_79AD55C06E68EE4E_1171_UN""","""CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=N[N](C)N=C3)F""",21,"""B8969E9ED38E5EF4"""
+"""F64696D2270507E3_BBB1C9966A0AEF58_1171_UN""","""CCOC1=C(C=C(C=C1)C2=NC(=CS2)CCSC(C)=O)F""",21,"""B8969E9ED38E5EF4"""
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+"""0CCA2A34AA032DAA_968D0D42DD5E4FD9_6036_UN""","""CC1=CC=C(C=C1)CC(C2CC2)N(CC(C)C)[S](=O)(=O)C""",21,"""B8D4CF29D997AC54"""
+"""0545D9C1A21C0AF9_0A8498E8A454220E_6036_UN""","""CC1=CC=C(C=C1)CC(C2CC2)N3[S](=O)(CCNCC3)=O""",21,"""B8D4CF29D997AC54"""
+"""F5D32F339EE82CD0_B86383B68FC5E2A5_6036_UN""","""CC1=CC=C(C=C1)CC(C2CC2)N([S](C=C)(=O)=O)C3CC3""",21,"""B8D4CF29D997AC54"""
+"""2FDCCFE66CE496A3_186403B559C0EB5A_6036_UN""","""CC1=CC=C(C=C1)CC(C2CC2)N3CC4(C[S]3(=O)=O)CC4""",21,"""B8D4CF29D997AC54"""
+"""6DEB526D5FA4A62C_D42F7084519FFA18_6036_UN""","""CC1=CC=C(C=C1)CC(C2CC2)N([S](C)(=O)=O)C(=O)CN""",21,"""B8D4CF29D997AC54"""
+"""A90122079532E0C7_36AC3EB281EAC5D6_6036_UN""","""CC1=CC=C(C=C1)CC(C2CC2)N3CCCCC[S]3(=O)=O""",21,"""B8D4CF29D997AC54"""
+"""43BA8E0905D62A37_2407A25483A20B8A_6036_UN""","""CC1=CC=C(C=C1)CC(C2CC2)N([S](C)(=O)=O)CCCBr""",21,"""B8D4CF29D997AC54"""
+"""A65605FDD97E173D_7404A3093AC60F58_6003_UN""","""CC1=CC=C(C=C1)CC(OC2=CC=C(C=C2)C#N)C3CC3""",21,"""B8D4CF29D997AC54"""
+"""585B47D35F9A39EE_4B2459017B5EB279_6003_UN""","""CC1=CC=C(C=C1)CC(OC2=CC=CC=C2[N+]#[C-])C3CC3""",21,"""B8D4CF29D997AC54"""
+"""FEB6D2AC0C671B5B_4C73AC731A138FDB_6003_UN""","""CC1=CC=C(C=C1)CC(OC2=CC=CC=C2C#N)C3CC3""",21,"""B8D4CF29D997AC54"""
+"""F18FEE4E59D992E2_A4F30E1784EDA6A7_6003_UN""","""CC1=CC=C(C=C1)CC(OC2=CC=C(C=C2)[N+]#[C-])C3CC3""",21,"""B8D4CF29D997AC54"""
+"""C152F506EE4FF7A4_2AC88BF53BC071D9_6003_UN""","""CC1=CC=C(C=C1)CC(OC2=CC=CC(=C2)[N+]#[C-])C3CC3""",21,"""B8D4CF29D997AC54"""
+"""EF390123A478F014_C7B8B45CBB6226BD_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N([S](C)(=O)=O)CCCN""",21,"""B92788107631819C"""
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+"""B2AFF903AD224B70_63C176D5AED5F7F2_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N(CCNC)[S](=O)(=O)C""",21,"""B92788107631819C"""
+"""2F9C590719F8D1DA_9FBB4A91A5A43AF8_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N([S](CCCC)(=O)=O)C""",21,"""B92788107631819C"""
+"""DAA09003EA1C69BF_ABA8A8CC770441A7_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""B92788107631819C"""
+"""41E27C9446118E27_BB4EB97EC636186A_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N([S](C)(=O)=O)CCC#C""",21,"""B92788107631819C"""
+"""9B614DDDFCFA0A25_B20CB7CB280935CE_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N(C)[S](=O)(=O)CCCCl""",21,"""B92788107631819C"""
+"""F109B4B9D1320662_F3F0FDCF2E19AC05_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N([S](CC)(=O)=O)CC#C""",21,"""B92788107631819C"""
+"""18613E1832393320_AA2311994DDA5565_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N3[S](CCCC3=O)(=O)=O""",21,"""B92788107631819C"""
+"""DBB48A2A01A51EEF_78DD8D01B2236B33_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""B92788107631819C"""
+"""06EE4C65C41338CB_5D14EA82ECCCF6E7_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N([S](C)(=O)=O)C3CNC3""",21,"""B92788107631819C"""
+"""C6B64F0114C76B68_87C305718E2A59C8_6036_DP""","""CC2(C)CC(C1=C(C=CC=C1)O2)N[S](=O)(=O)C3(CC3)C#N""",21,"""B92788107631819C"""
+"""4360DD52194FD863_90CF5C5D51BBCFC0_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N(C)[S](=O)(=O)CCCN""",21,"""B92788107631819C"""
+"""36A2253464FFAA7F_39D67FB9ECFF3BFF_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N(C)[S](=O)(=O)C3COC3""",21,"""B92788107631819C"""
+"""D71E2AB759E5947F_59F3AE5B30528B60_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N(C)[S](=O)(=O)CCOC""",21,"""B92788107631819C"""
+"""3D5EE7A3965B9DE8_F72D33B9E4625975_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N(C)[S](=O)(=O)CC(=O)C""",21,"""B92788107631819C"""
+"""51A1B02FA6189CB8_7F05550D22EC6A38_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N3CCCC(C)[S]3(=O)=O""",21,"""B92788107631819C"""
+"""23F803A1DAFDB872_72EA73EA9BD5519D_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N3CCC(C)(C)[S]3(=O)=O""",21,"""B92788107631819C"""
+"""7E27903B98BF81EC_4942D22B9AE2A3C2_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N([S](CC)(=O)=O)CCN""",21,"""B92788107631819C"""
+"""FF79EFF91C5E6879_08EF4E91A4A4A576_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N(CC)[S](=O)(=O)CCN""",21,"""B92788107631819C"""
+"""CB4C94939A6B4C26_B27CE564A5B2503B_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""B92788107631819C"""
+"""A374192F95598729_3A44D60E671F4507_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""B92788107631819C"""
+"""F627EAC30FA48C7D_55624033F2990D59_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N([S](CCNC)(=O)=O)C""",21,"""B92788107631819C"""
+"""F627EAC30FA48C7D_8992BAA50B06067F_6036_DP""","""CC2(C)CC(C1=C(C=CC=C1)O2)N(C)[S](=O)(=O)CCNC""",21,"""B92788107631819C"""
+"""ACC155FF9D04E022_982F3E49703CC1A4_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N3[S](CCC3CI)(=O)=O""",21,"""B92788107631819C"""
+"""ED12BAB03B31211F_042995810A32CF69_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N3C(CN)CC[S]3(=O)=O""",21,"""B92788107631819C"""
+"""02FC4B3D8E44C3D5_977E4A7B72F86211_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N(CC(C)C)[S](=O)(=O)C""",21,"""B92788107631819C"""
+"""2CB36CD3401ADDB0_0B77DFD10BF20FC6_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N3[S](=O)(CCNCC3)=O""",21,"""B92788107631819C"""
+"""6E2D430B0E7AAE5C_B990C48F2063CF6D_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N([S](C=C)(=O)=O)C3CC3""",21,"""B92788107631819C"""
+"""294A446E6B1E5ED6_1997448CF666C692_6036_UN""","""CC2(C)CC(C1=C(C=CC=C1)O2)N3CC4(C[S]3(=O)=O)CC4""",21,"""B92788107631819C"""
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+"""9C5B0AA50211D3C5_20518CA6BA3784E5_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=C(C=C(C)C=C2F)F)F""",21,"""BAE3CB4D565AFE8F"""
+"""2BBE13111BDD0F41_94EAF2AE0D6CA5BE_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC=CC3=NON=C23)F""",21,"""BAE3CB4D565AFE8F"""
+"""45D1BC1D19F766D2_D390ACF66066F6C6_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=C(C(=C(C)C=C2)F)F)F""",21,"""BAE3CB4D565AFE8F"""
+"""468A046E39FC891A_925BE7376AFBDB42_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C3=C[N]2C=NN=C2C=C3)F""",21,"""BAE3CB4D565AFE8F"""
+"""303E52EA4269ADCA_7C6D04FFE8C508EE_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC(=C(C=C2)F)OC)F""",21,"""BAE3CB4D565AFE8F"""
+"""31C3C2250A961949_6AB0474E2F509792_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=C(C=C(C)C=C2C)C)F""",21,"""BAE3CB4D565AFE8F"""
+"""3B013A5EC4D63512_1F7B18016884F11E_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=C(OC)C=CC=C2F)F""",21,"""BAE3CB4D565AFE8F"""
+"""A36667E8F8A272BA_CF28B802665AC632_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC=C(C(N)=O)C=C2)F""",21,"""BAE3CB4D565AFE8F"""
+"""3741ACE9BC8627A1_1557913EDC4D2387_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC(=C(OC)C=C2)F)F""",21,"""BAE3CB4D565AFE8F"""
+"""991AD140A249F8EC_4DFF92FB8C20CF5B_6006_DP""","""COC(=O)C1=C(C(=C(C=C1)F)C3=C2[N](CCNC2)N=C3)F""",21,"""BAE3CB4D565AFE8F"""
+"""23AF3174C87D5B04_41AEF0A377869A40_6006_DP""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC=CC(=C2)C(O)=O)F""",21,"""BAE3CB4D565AFE8F"""
+"""FD312F3215C3FFEE_68059A9585F48A3B_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC=CC(=C2F)OC)F""",21,"""BAE3CB4D565AFE8F"""
+"""2D7B9F092C723386_DF9AEDEB4D054853_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=C(C=CC(=C2)OC)C)F""",21,"""BAE3CB4D565AFE8F"""
+"""DC23B054E7EF2FF8_CEC2410C2C41395E_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C3=C2OC=CC2=CC=C3)F""",21,"""BAE3CB4D565AFE8F"""
+"""E93038C9E847D2BE_773345A92D3F0D68_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=C(OC)C=C(C=C2)F)F""",21,"""BAE3CB4D565AFE8F"""
+"""98B66ADE590CBCA1_776E59E173849BA1_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC(=C(OC)C=C2)C)F""",21,"""BAE3CB4D565AFE8F"""
+"""021CFBB7D8C59D03_672936A9C488F43E_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC=C(C(C)O)C=C2)F""",21,"""BAE3CB4D565AFE8F"""
+"""548CB2C1A77599C7_6F0D8A16FBACB31F_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=COC(=C2)C(F)(F)F)F""",21,"""BAE3CB4D565AFE8F"""
+"""866E0AC7C2ED57B0_71F8CC93443EE4EC_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC(=CS2)C(F)(F)F)F""",21,"""BAE3CB4D565AFE8F"""
+"""8E3C7F34FE208599_F269CE57C5DFD2F7_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CN=C(N(C)C)N=C2)F""",21,"""BAE3CB4D565AFE8F"""
+"""3AA8229B47DD778E_27E827C3F3C40A34_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C3=CC2=C(C=CC=N2)S3)F""",21,"""BAE3CB4D565AFE8F"""
+"""C095E3C17A15D7D4_909DA77CFBB70C4C_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=C(C(=CC=C2O)F)F)F""",21,"""BAE3CB4D565AFE8F"""
+"""6EC4D2A778C9752C_77DE9DF6AAF10F56_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CSC3=C2C=CC=C3)F""",21,"""BAE3CB4D565AFE8F"""
+"""181329F8162A5787_08D821436DC67DC1_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC=C[N]3N=CC=C23)F""",21,"""BAE3CB4D565AFE8F"""
+"""E57269E3F9EA85AD_B17208C2EC809676_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CN=C(C=C2)C(F)F)F""",21,"""BAE3CB4D565AFE8F"""
+"""58217D269250E9DC_DA69D4C9CEE766FA_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC3=C(C=C2)CCO3)F""",21,"""BAE3CB4D565AFE8F"""
+"""5AE8063D023A07C8_8CAAAE3DFA9D3579_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC=C(C=C2)[N](=O)=O)F""",21,"""BAE3CB4D565AFE8F"""
+"""AB899F048220CD92_7764AA9835BE80E2_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC3=C(C=C2)C=N[NH]3)F""",21,"""BAE3CB4D565AFE8F"""
+"""88C210BBA9131868_D3D0C9184467D2A0_6006_UN""","""COC(=O)C1=C(C(=C(C=C1)F)C2=CC=C(S2)C(F)(F)F)F""",21,"""BAE3CB4D565AFE8F"""
+"""5458232C2358ACA9_C5D75469569AC309_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](C)(=O)=O)CCCN""",21,"""BB4868259BC96428"""
+"""B1CE8320A303C0FE_6F2260CF56668CA7_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](CC)(=O)=O)CCBr""",21,"""BB4868259BC96428"""
+"""2B0F0FDA70A76B59_61AE96E0432D1246_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N(CCNC)[S](=O)(=O)C""",21,"""BB4868259BC96428"""
+"""E2565596E39096A8_9DD4AAA4485CDF4C_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](CCCC)(=O)=O)C""",21,"""BB4868259BC96428"""
+"""F8122A4C16C06B4C_A9C748F99AFCA413_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""BB4868259BC96428"""
+"""32178ED52F482B8F_B921594B2BCEFDDE_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](C)(=O)=O)CCC#C""",21,"""BB4868259BC96428"""
+"""4D11D41E842EC356_B06357FEC5F1D07A_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N(C)[S](=O)(=O)CCCCl""",21,"""BB4868259BC96428"""
+"""8C8EF7AA21014E83_F19F1DFAC3E149B1_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](CC)(=O)=O)CC#C""",21,"""BB4868259BC96428"""
+"""CCFCA3B14E1B638B_A84CF1ACA022B0D1_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3[S](CCCC3=O)(=O)=O""",21,"""BB4868259BC96428"""
+"""84BB9C8F636C77DA_7AB26D345FDB8E87_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""BB4868259BC96428"""
+"""67071E5B3D30C858_5F7B0AB701341353_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](C)(=O)=O)C3CNC3""",21,"""BB4868259BC96428"""
+"""02264D9F5E3E6634_85ACE54463D2BC7C_6036_DP""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N[S](=O)(=O)C3(CC3)C#N""",21,"""BB4868259BC96428"""
+"""CDEFBF2CE6303F18_92A0BC68BC432A74_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N(C)[S](=O)(=O)CCCN""",21,"""BB4868259BC96428"""
+"""ADA7E8D3ABC1E975_3BB99F8C0107DE4B_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N(C)[S](=O)(=O)C3COC3""",21,"""BB4868259BC96428"""
+"""CA00AF5AD4ECE12A_5B9C4E6EDDAA6ED4_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N(C)[S](=O)(=O)CCOC""",21,"""BB4868259BC96428"""
+"""903B32ADF173FEC0_F542D38C099ABCC1_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N(C)[S](=O)(=O)CC(=O)C""",21,"""BB4868259BC96428"""
+"""00C73582543CCC62_7D6AB538CF148F8C_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3CCCC(C)[S]3(=O)=O""",21,"""BB4868259BC96428"""
+"""E1310F6CC60598E1_708593DF762DB429_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3CCC(C)(C)[S]3(=O)=O""",21,"""BB4868259BC96428"""
+"""798F71BE9FFFD0EA_4B2D321E771A4676_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](CC)(=O)=O)CCN""",21,"""BB4868259BC96428"""
+"""763288791B8C12B0_0A80AEA4495C40C2_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N(CC)[S](=O)(=O)CCN""",21,"""BB4868259BC96428"""
+"""C76AED7352A8F620_B0130551484AB58F_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""BB4868259BC96428"""
+"""31FFD32055B4381A_382B363B8AE7A0B3_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""BB4868259BC96428"""
+"""2276868310605E19_570DA0061F61E8ED_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](CCNC)(=O)=O)C""",21,"""BB4868259BC96428"""
+"""2276868310605E19_8BFD5A90E6FEE3CB_6036_DP""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N(C)[S](=O)(=O)CCNC""",21,"""BB4868259BC96428"""
+"""D391997E82A21CD9_9A40DE7C9DC42410_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3[S](CCC3CI)(=O)=O""",21,"""BB4868259BC96428"""
+"""90EE28643FAA989D_064675B4E7CA2ADD_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3C(CN)CC[S]3(=O)=O""",21,"""BB4868259BC96428"""
+"""AC28C81212FF96D9_9511AA4E9F0087A5_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N(CC(C)C)[S](=O)(=O)C""",21,"""BB4868259BC96428"""
+"""335A54F2EC44DDF5_09183FE4E60AEA72_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3[S](=O)(CCNCC3)=O""",21,"""BB4868259BC96428"""
+"""E27C8D8F06F11548_BBFF24BACD9B2AD9_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](C=C)(=O)=O)C3CC3""",21,"""BB4868259BC96428"""
+"""FADBA655CFCD81A4_1BF8A4B91B9E2326_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3CC4(C[S]3(=O)=O)CC4""",21,"""BB4868259BC96428"""
+"""7C08353657E13380_D7B3D78813C13264_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](C)(=O)=O)C(=O)CN""",21,"""BB4868259BC96428"""
+"""B5EB7766EBF7A3DE_353099BEC3B40DAA_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N3CCCCC[S]3(=O)=O""",21,"""BB4868259BC96428"""
+"""9B82BAC400A182A6_279B0558C1FCC3F6_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)Cl)[NH]2)N([S](C)(=O)=O)CCCBr""",21,"""BB4868259BC96428"""
+"""C07ACAD7D703010C_779804057898C724_6003_UN""","""CC(OC1=CC=C(C=C1)C#N)C3=NC2=C(C=CC(=C2)Cl)[NH]3""",21,"""BB4868259BC96428"""
+"""D247467412AA4BAB_48B8FE0D39007A05_6003_UN""","""CC(OC1=CC=CC=C1[N+]#[C-])C3=NC2=C(C=CC(=C2)Cl)[NH]3""",21,"""BB4868259BC96428"""
+"""87E5953D8CA7FD11_4FEF0B7F584D47A7_6003_UN""","""CC(OC1=CC=CC=C1C#N)C3=NC2=C(C=CC(=C2)Cl)[NH]3""",21,"""BB4868259BC96428"""
+"""88E2B2F6D0D227A5_A76FA91BC6B36EDB_6003_UN""","""CC(OC1=CC=C(C=C1)[N+]#[C-])C3=NC2=C(C=CC(=C2)Cl)[NH]3""",21,"""BB4868259BC96428"""
+"""B55ACCF3E09AF179_29542CF9799EB9A5_6003_UN""","""CC(OC1=CC=CC(=C1)[N+]#[C-])C3=NC2=C(C=CC(=C2)Cl)[NH]3""",21,"""BB4868259BC96428"""
+"""52ABD854C4EFA0A3_C54019097AD909FF_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N([S](C)(=O)=O)CCCN""",21,"""BBDF2545B78AAEDE"""
+"""D4D3AC9D35E72893_6FB52DAF7A254651_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N([S](CC)(=O)=O)CCBr""",21,"""BBDF2545B78AAEDE"""
+"""31D462152C76D3EB_6139DB806F6ED8B0_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N(CCNC)[S](=O)(=O)C""",21,"""BBDF2545B78AAEDE"""
+"""18CEABE4CFA00115_9D43E7C4641F15BA_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N([S](CCCC)(=O)=O)C""",21,"""BBDF2545B78AAEDE"""
+"""FE6EFAAD62CA03E6_A9500599B6BF6EE5_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""BBDF2545B78AAEDE"""
+"""DA8A7EC7AC414DD6_B9B6142B078D3728_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N([S](C)(=O)=O)CCC#C""",21,"""BBDF2545B78AAEDE"""
+"""B28A0341B228898C_B0F41A9EE9B21A8C_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N(C)[S](=O)(=O)CCCCl""",21,"""BBDF2545B78AAEDE"""
+"""3431554C9812A272_F108509AEFA28347_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N([S](CC)(=O)=O)CC#C""",21,"""BBDF2545B78AAEDE"""
+"""38A58D8390299B60_A8DBBCCC8C617A27_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N3[S](CCCC3=O)(=O)=O""",21,"""BBDF2545B78AAEDE"""
+"""98CE127E9E25DF14_7A25205473984471_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""BBDF2545B78AAEDE"""
+"""3D92D09614A8BE83_5FEC47D72D77D9A5_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N([S](C)(=O)=O)C3CNC3""",21,"""BBDF2545B78AAEDE"""
+"""195939805CE8C45D_853BA8244F91768A_6036_DP""","""CC(C1=CN=C(S1)C2OCCO2)N[S](=O)(=O)C3(CC3)C#N""",21,"""BBDF2545B78AAEDE"""
+"""51CE9A000C963777_9237F1089000E082_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N(C)[S](=O)(=O)CCCN""",21,"""BBDF2545B78AAEDE"""
+"""E0A17B78EA04D1BA_3B2ED2EC2D4414BD_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N(C)[S](=O)(=O)C3COC3""",21,"""BBDF2545B78AAEDE"""
+"""264A9D1A4EBD391E_5B0B030EF1E9A422_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N(C)[S](=O)(=O)CCOC""",21,"""BBDF2545B78AAEDE"""
+"""E9F8A751F167D747_F5D59EEC25D97637_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N(C)[S](=O)(=O)CC(=O)C""",21,"""BBDF2545B78AAEDE"""
+"""9FCDCDFAD95B49FA_7DFDF858E357457A_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N3CCCC(C)[S]3(=O)=O""",21,"""BBDF2545B78AAEDE"""
+"""699F4441B94A9504_7012DEBF5A6E7EDF_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N3CCC(C)(C)[S]3(=O)=O""",21,"""BBDF2545B78AAEDE"""
+"""40E2933798C79265_4BBA7F7E5B598C80_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N([S](CC)(=O)=O)CCN""",21,"""BBDF2545B78AAEDE"""
+"""255449CC9F3E41FC_0A17E3C4651F8A34_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N(CC)[S](=O)(=O)CCN""",21,"""BBDF2545B78AAEDE"""
+"""68C422D8780C4249_B084483164097F79_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""BBDF2545B78AAEDE"""
+"""B539F59B9C29AE2F_38BC7B5BA6A46A45_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""BBDF2545B78AAEDE"""
+"""ED99A0FC18F2971C_579AED663322221B_6036_UN""","""CC(C1=CN=C(S1)C2OCCO2)N([S](CCNC)(=O)=O)C""",21,"""BBDF2545B78AAEDE"""
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+"""58268D08C913FFFF_D2DAD3926393251F_6006_UN""","""C1(=NC=CC(=C1)N2CCOCC2)C3=CC=C(S3)C(F)(F)F""",21,"""BBE9D1C771AE0930"""
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+"""9306B03981805726_C8A013CEEB2AA724_6006_UN""","""CCOC1=NC(=C(S1)C(=O)OC)C3=C2OC=CC2=CC=C3""",21,"""BC81998F913160F5"""
+"""D460ABC0320ABF37_7151176BEA549312_6006_UN""","""CCOC1=NC(=C(S1)C(=O)OC)C2=C(OC)C=C(C=C2)F""",21,"""BC81998F913160F5"""
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+"""95BE73474FA0DA95_696FD8D43CC72D65_6006_UN""","""CCOC1=NC(=C(S1)C(=O)OC)C2=COC(=C2)C(F)(F)F""",21,"""BC81998F913160F5"""
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+"""24AC71910AF36B02_71BCCF346D9A912C_6006_UN""","""CCOC1=NC(=C(S1)C(=O)OC)C2=CSC3=C2C=CC=C3""",21,"""BC81998F913160F5"""
+"""AE176F0CA0194BFA_0EBA7381AAADE3BB_6006_UN""","""CCOC1=NC(=C(S1)C(=O)OC)C2=CC=C[N]3N=CC=C23""",21,"""BC81998F913160F5"""
+"""40987D18DB09654A_B7105A002BEB080C_6006_UN""","""CCOC1=NC(=C(S1)C(=O)OC)C2=CN=C(C=C2)C(F)F""",21,"""BC81998F913160F5"""
+"""F5C768691C091BCC_DC0B860B098CF880_6006_UN""","""CCOC1=NC(=C(S1)C(=O)OC)C2=CC3=C(C=C2)CCO3""",21,"""BC81998F913160F5"""
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+"""BB9BC140E17980E8_7106F85AF2D51E98_6006_UN""","""CCOC1=NC(=C(S1)C(=O)OC)C2=CC3=C(C=C2)C=N[NH]3""",21,"""BC81998F913160F5"""
+"""F30396686A043011_D5B29BDA830C4CDA_6006_UN""","""CCOC1=NC(=C(S1)C(=O)OC)C2=CC=C(S2)C(F)(F)F""",21,"""BC81998F913160F5"""
+"""AC32B193B891E75E_C3AFF310FF098883_6036_UN""","""COC1=CC=C(C=C1)C(=O)C=CN([S](C)(=O)=O)CCCN""",21,"""BD30CF5C325A2FA2"""
+"""6E649253DA39FDA7_695AC7B6FFF5C72D_6036_UN""","""COC1=CC=C(C=C1)C(=O)C=CN([S](CC)(=O)=O)CCBr""",21,"""BD30CF5C325A2FA2"""
+"""FD3B5260B108F251_67D63199EABE59CC_6036_UN""","""COC1=CC=C(C=C1)C(=O)C=CN(CCNC)[S](=O)(=O)C""",21,"""BD30CF5C325A2FA2"""
+"""3CD75894A1C592A9_9BAC0DDDE1CF94C6_6036_UN""","""COC1=CC=C(C=C1)C(=O)C=CN([S](CCCC)(=O)=O)C""",21,"""BD30CF5C325A2FA2"""
+"""B048ADF91E026049_AFBFEF80336FEF99_6036_UN""","""COC1=CC=C(C=C1)C(=O)C=CN2C(C(C)(C)[S]2(=O)=O)=O""",21,"""BD30CF5C325A2FA2"""
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+"""C6E95C62747DF5CC_D37C7E1C0C6F2535_6036_UN""","""CCCCC(CC1=NC=CC=C1)N([S](C)(=O)=O)C(=O)CN""",21,"""BF87C1B184677379"""
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+"""AFA45515C3612AFC_DA5DD0FC82B98EF7_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""BFE92437B7535E63"""
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+"""9616D1B7FB61CF3F_55DFB05B7556900E_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CC3=C(C=C2)CCC3""",21,"""BFE92437B7535E63"""
+"""F5CE8C59D33FF8D3_F50DF0976A3EEAAC_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CC=CC(=C2)C#CC""",21,"""BFE92437B7535E63"""
+"""8A37CBC2D6EF0325_F50974E57B56C133_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CC=CC(=C2)CSC""",21,"""BFE92437B7535E63"""
+"""D1BD04ACBAFF56DE_75E7C4CBD941ED36_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""BFE92437B7535E63"""
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+"""4657A17449E3A85B_E6BBD68CFA67551E_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""BFE92437B7535E63"""
+"""ADCF6083B8B39E95_255B63DC5B3E2409_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=C(C=C(C)C=C2F)F""",21,"""BFE92437B7535E63"""
+"""779BFFC4FB8479EF_91E01DD4EC650552_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CC=CC3=NON=C23""",21,"""BFE92437B7535E63"""
+"""31B0A9D35663598F_D69A438C816F562A_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=C(C(=C(C)C=C2)F)F""",21,"""BFE92437B7535E63"""
+"""22A45424969A4E96_9751084D8BF27BAE_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C3=C[N]2C=NN=C2C=C3""",21,"""BFE92437B7535E63"""
+"""34681D021B21E775_7967EB8509CCA802_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CC(=C(C=C2)F)OC""",21,"""BFE92437B7535E63"""
+"""2790F93784C713FC_6FBAA834CE59377E_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=C(C=C(C)C=C2C)C""",21,"""BFE92437B7535E63"""
+"""22CD3F5F328408FC_1A71F77B898D51F2_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=C(OC)C=CC=C2F""",21,"""BFE92437B7535E63"""
+"""47621C9C53D3303A_CA225778875366DE_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CC=C(C(N)=O)C=C2""",21,"""BFE92437B7535E63"""
+"""9C8FDC58EC6DAFCE_105D7E443D44836B_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CC(=C(OC)C=C2)F""",21,"""BFE92437B7535E63"""
+"""69FA6F55DD026019_48F57D816D296FB7_6006_DP""","""CN(CC(=O)O)C1=NN=C(C=C1)C3=C2[N](CCNC2)N=C3""",21,"""BFE92437B7535E63"""
+"""5E0A214991699A14_44A41FD9968F3AAC_6006_DP""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CC=CC(=C2)C(O)=O""",21,"""BFE92437B7535E63"""
+"""7C9292BEE12FF253_6D0F75EF64FD2AD7_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=CC=CC(=C2F)OC""",21,"""BFE92437B7535E63"""
+"""A7A1062E38546F5B_DA900291AC0CE8BF_6006_UN""","""CN(CC(=O)O)C1=NN=C(C=C1)C2=C(C=CC(=C2)OC)C""",21,"""BFE92437B7535E63"""
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+"""D24A8CD2E0DF14AB_414F02B2E5BD4AE7_6036_UN""","""C(COC1=CC=C(C=C1)CC#N)N2[S](=O)(=O)C3(CC2)CC3""",21,"""C22C5CACF4938E7C"""
+"""D7AE7443218AEF72_2E69948F703B02B9_6036_UN""","""C(COC1=CC=C(C=C1)CC#N)N([S](CCNC)(=O)=O)C""",21,"""C22C5CACF4938E7C"""
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+"""3628788939752AAA_7F22413D8890C089_6036_UN""","""C(COC1=CC=C(C=C1)CC#N)N2C(CN)CC[S]2(=O)=O""",21,"""C22C5CACF4938E7C"""
+"""08398626609190E2_EC759EC7F05A6DF1_6036_UN""","""C(COC1=CC=C(C=C1)CC#N)N(CC(C)C)[S](=O)(=O)C""",21,"""C22C5CACF4938E7C"""
+"""2D45D8E7A3B0E66E_707C0B6D89500026_6036_UN""","""C(COC1=CC=C(C=C1)CC#N)N2[S](=O)(CCNCC2)=O""",21,"""C22C5CACF4938E7C"""
+"""68E798AD9C2F14AD_C29B1033A2C1C08D_6036_UN""","""C(COC1=CC=C(C=C1)CC#N)N([S](C=C)(=O)=O)C2CC2""",21,"""C22C5CACF4938E7C"""
+"""A75A21C2E2BECAED_629C903074C4C972_6036_UN""","""C(COC1=CC=C(C=C1)CC#N)N2CC3(C[S]2(=O)=O)CC3""",21,"""C22C5CACF4938E7C"""
+"""5661732872EC0D5D_AED7E3017C9BD830_6036_UN""","""C(COC1=CC=C(C=C1)CC#N)N([S](C)(=O)=O)C(=O)CN""",21,"""C22C5CACF4938E7C"""
+"""1545426F6E6A75D3_4C54AD37ACEEE7FE_6036_UN""","""C(COC1=CC=C(C=C1)CC#N)N2CCCCC[S]2(=O)=O""",21,"""C22C5CACF4938E7C"""
+"""B690506DFB6C28FD_5EFF31D1AEA629A2_6036_UN""","""C(COC1=CC=C(C=C1)CC#N)N([S](C)(=O)=O)CCCBr""",21,"""C22C5CACF4938E7C"""
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+"""61054A1E541D0B50_BC4489363168E217_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](C)(=O)=O)CCCN""",21,"""C2DBB57AFC3B4536"""
+"""AF32BA5EDB7270CC_16B1BD903194ADB9_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](CC)(=O)=O)CCBr""",21,"""C2DBB57AFC3B4536"""
+"""8A130213B8A10112_183D4BBF24DF3358_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N(CCNC)[S](=O)(=O)C""",21,"""C2DBB57AFC3B4536"""
+"""7D26444C64FC4591_E44777FB2FAEFE52_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](CCCC)(=O)=O)C""",21,"""C2DBB57AFC3B4536"""
+"""531E89A97EA97BD9_D05495A6FD0E850D_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""C2DBB57AFC3B4536"""
+"""5E122C700A917EDA_C0B284144C3CDCC0_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](C)(=O)=O)CCC#C""",21,"""C2DBB57AFC3B4536"""
+"""102979448643623F_C9F08AA1A203F164_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N(C)[S](=O)(=O)CCCCl""",21,"""C2DBB57AFC3B4536"""
+"""3DC2EB0816132E33_880CC0A5A41368AF_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](CC)(=O)=O)CC#C""",21,"""C2DBB57AFC3B4536"""
+"""441D58E5525C6C06_D1DF2CF3C7D091CF_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3[S](CCCC3=O)(=O)=O""",21,"""C2DBB57AFC3B4536"""
+"""543A230FB28732CB_0321B06B3829AF99_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""C2DBB57AFC3B4536"""
+"""F3B2281FCAD6A51E_26E8D7E866C6324D_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](C)(=O)=O)C3CNC3""",21,"""C2DBB57AFC3B4536"""
+"""34FE53B89EEA68A8_FC3F381B04209D62_6036_DP""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N[S](=O)(=O)C3(CC3)C#N""",21,"""C2DBB57AFC3B4536"""
+"""71FA6A2665305BD0_EB336137DBB10B6A_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N(C)[S](=O)(=O)CCCN""",21,"""C2DBB57AFC3B4536"""
+"""AFB595023BC81D6A_422A42D366F5FF55_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N(C)[S](=O)(=O)C3COC3""",21,"""C2DBB57AFC3B4536"""
+"""A1A070843B7CD54A_220F9331BA584FCA_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N(C)[S](=O)(=O)CCOC""",21,"""C2DBB57AFC3B4536"""
+"""D62DF8AE7727A675_8CD10ED36E689DDF_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N(C)[S](=O)(=O)CC(=O)C""",21,"""C2DBB57AFC3B4536"""
+"""4E13D9541E755C68_04F96867A8E6AE92_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3CCCC(C)[S]3(=O)=O""",21,"""C2DBB57AFC3B4536"""
+"""58A25DD45FB0A921_09164E8011DF9537_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3CCC(C)(C)[S]3(=O)=O""",21,"""C2DBB57AFC3B4536"""
+"""37D75F3513DD70B6_32BEEF4110E86768_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](CC)(=O)=O)CCN""",21,"""C2DBB57AFC3B4536"""
+"""EB9037BEF62DD6BF_731373FB2EAE61DC_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N(CC)[S](=O)(=O)CCN""",21,"""C2DBB57AFC3B4536"""
+"""2CDFD8AF0A22A403_C980D80E2FB89491_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""C2DBB57AFC3B4536"""
+"""35BC87A2F8AAF061_41B8EB64ED1581AD_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""C2DBB57AFC3B4536"""
+"""320545E6B929AF2E_2E9E7D597893C9F3_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](CCNC)(=O)=O)C""",21,"""C2DBB57AFC3B4536"""
+"""320545E6B929AF2E_F26E87CF810CC2D5_6036_DP""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N(C)[S](=O)(=O)CCNC""",21,"""C2DBB57AFC3B4536"""
+"""D046B56E84727754_E3D30323FA36050E_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3[S](CCC3CI)(=O)=O""",21,"""C2DBB57AFC3B4536"""
+"""D16F870FCC97389D_7FD5A8EB80380BC3_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3C(CN)CC[S]3(=O)=O""",21,"""C2DBB57AFC3B4536"""
+"""254327A28C338D66_EC827711F8F2A6BB_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N(CC(C)C)[S](=O)(=O)C""",21,"""C2DBB57AFC3B4536"""
+"""3F0464293B4DDC73_708BE2BB81F8CB6C_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3[S](=O)(CCNCC3)=O""",21,"""C2DBB57AFC3B4536"""
+"""D4806C48230879A1_C26CF9E5AA690BC7_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](C=C)(=O)=O)C3CC3""",21,"""C2DBB57AFC3B4536"""
+"""C867CD1BB525789D_626B79E67C6C0238_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3CC4(C[S]3(=O)=O)CC4""",21,"""C2DBB57AFC3B4536"""
+"""71B17D1255C05650_AE200AD77433137A_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](C)(=O)=O)C(=O)CN""",21,"""C2DBB57AFC3B4536"""
+"""16E3C145A709CC01_4CA344E1A4462CB4_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N3CCCCC[S]3(=O)=O""",21,"""C2DBB57AFC3B4536"""
+"""023C6FD8DD5B99DD_5E08D807A60EE2E8_6036_UN""","""CC(C2=NC1=C(C=CC(=C1)C)[NH]2)N([S](C)(=O)=O)CCCBr""",21,"""C2DBB57AFC3B4536"""
+"""5FDCD996D3F378E2_0E0BD95A1F6AE63A_6003_UN""","""CC(OC1=CC=C(C=C1)C#N)C3=NC2=C(C=CC(=C2)C)[NH]3""",21,"""C2DBB57AFC3B4536"""
+"""0786DB08885ABBF2_312B23525EF25B1B_6003_UN""","""CC(OC1=CC=CC=C1[N+]#[C-])C3=NC2=C(C=CC(=C2)C)[NH]3""",21,"""C2DBB57AFC3B4536"""
+"""940A04CD78A75EE5_367CD6203FBF66B9_6003_UN""","""CC(OC1=CC=CC=C1C#N)C3=NC2=C(C=CC(=C2)C)[NH]3""",21,"""C2DBB57AFC3B4536"""
+"""7EAA423C72FF9B67_DEFC7444A1414FC5_6003_UN""","""CC(OC1=CC=C(C=C1)[N+]#[C-])C3=NC2=C(C=CC(=C2)C)[NH]3""",21,"""C2DBB57AFC3B4536"""
+"""537AE235DB199E88_50C7F1A61E6C98BB_6003_UN""","""CC(OC1=CC=CC(=C1)[N+]#[C-])C3=NC2=C(C=CC(=C2)C)[NH]3""",21,"""C2DBB57AFC3B4536"""
+"""3EA9B920ACB89715_A6B975CAE19E2961_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC(=C(C(=C2)F)F)F)N""",21,"""C30D8101D474F9F5"""
+"""521C36D39A25D46D_8BB8D25CC6681C5D_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=C(C(C)C)C=C2)N""",21,"""C30D8101D474F9F5"""
+"""338AF0FE225179B1_293B156D16713798_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC3=C(C=C2)CCC3)N""",21,"""C30D8101D474F9F5"""
+"""3F9B33C432F4D4E4_89E955A109194D3A_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=CC(=C2)C#CC)N""",21,"""C30D8101D474F9F5"""
+"""2966AD538565A412_89EDD1D3187166A5_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=CC(=C2)CSC)N""",21,"""C30D8101D474F9F5"""
+"""61A7768655687006_090361FDBA664AA0_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CN=C(C=C2)[N](=O)=O)N""",21,"""C30D8101D474F9F5"""
+"""60C0B7BDAC688603_515863D11CFEB88A_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CSC=C2C(F)(F)F)N""",21,"""C30D8101D474F9F5"""
+"""EB68735D5E59AC81_785386BBAC71BD0B_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC(=CC=C2)C(=O)O)N""",21,"""C30D8101D474F9F5"""
+"""692E49E3B893A251_9A5F73BA9940F288_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C3=C2[NH]C=CC2=CC=C3)N""",21,"""C30D8101D474F9F5"""
+"""67302D7D3EFA48A0_59BFC6EA3819839F_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=C(C=C(C)C=C2F)F)N""",21,"""C30D8101D474F9F5"""
+"""CD04E37769EF28C5_ED04B8E28F42A2C4_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=CC3=NON=C23)N""",21,"""C30D8101D474F9F5"""
+"""FE9790F63C59A6F4_AA7EE6BAE248F1BC_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=C(C(=C(C)C=C2)F)F)N""",21,"""C30D8101D474F9F5"""
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+"""1003D507C5373F01_05834EB36AEB0F94_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC(=C(C=C2)F)OC)N""",21,"""C30D8101D474F9F5"""
+"""1A5DEE2715197671_135E0D02AD7E90E8_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=C(C=C(C)C=C2C)C)N""",21,"""C30D8101D474F9F5"""
+"""8D271470BF8D2E3D_6695524DEAAAF664_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=C(OC)C=CC=C2F)N""",21,"""C30D8101D474F9F5"""
+"""3F298274DC2DA01C_B6C6F24EE474C148_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=C(C(N)=O)C=C2)N""",21,"""C30D8101D474F9F5"""
+"""0983AFB97314C240_6CB9DB725E6324FD_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)F)N""",21,"""C30D8101D474F9F5"""
+"""32B88F02FD6C98D2_3411D8B70E0EC821_6006_DP""","""CN(C)C(=O)C1=CC(=C(C=C1)C3=C2[N](CCNC2)N=C3)N""",21,"""C30D8101D474F9F5"""
+"""EB68735D5E59AC81_3840BAEFF5A89D3A_6006_DP""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=CC(=C2)C(O)=O)N""",21,"""C30D8101D474F9F5"""
+"""365E4C26BF20A014_11EBD0D907DA8D41_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=CC(=C2F)OC)N""",21,"""C30D8101D474F9F5"""
+"""7F75B2710712EA28_A674A7A7CF2B4F29_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=C(C=CC(=C2)OC)C)N""",21,"""C30D8101D474F9F5"""
+"""9D2595B9E1915C05_B72C0B40AE6F3E24_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C3=C2OC=CC2=CC=C3)N""",21,"""C30D8101D474F9F5"""
+"""05E82B80D2D9B2DF_0EDD0FE5AF110A12_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=C(OC)C=C(C=C2)F)N""",21,"""C30D8101D474F9F5"""
+"""CAEFD1941539455C_0E8013ADF1AA9CDB_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)C)N""",21,"""C30D8101D474F9F5"""
+"""2DEE2423B0B4A5D0_1EC77CE546A6F344_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=C(C(C)O)C=C2)N""",21,"""C30D8101D474F9F5"""
+"""CE300A97F387D853_16E3C05A7982B465_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=COC(=C2)C(F)(F)F)N""",21,"""C30D8101D474F9F5"""
+"""218E273EFF8417C0_081686DFC610E396_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC(=CS2)C(F)(F)F)N""",21,"""C30D8101D474F9F5"""
+"""3AF94EA9F47B6018_8B87841B47F1D58D_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CN=C(N(C)C)N=C2)N""",21,"""C30D8101D474F9F5"""
+"""608A9CAFFBF6A1AE_5E066D8F71EA0D4E_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C3=CC2=C(C=CC=N2)S3)N""",21,"""C30D8101D474F9F5"""
+"""146DBDDD58201448_E973ED3079990B36_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=C(C(=CC=C2O)F)F)N""",21,"""C30D8101D474F9F5"""
+"""B3B8418101B22F30_0E30D7BA28DF082C_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CSC3=C2C=CC=C3)N""",21,"""C30D8101D474F9F5"""
+"""7CF20317D6B06C71_71366B0FEFE87ABB_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=C[N]3N=CC=C23)N""",21,"""C30D8101D474F9F5"""
+"""24FE781632602248_C89C428E6EAE910C_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CN=C(C=C2)C(F)F)N""",21,"""C30D8101D474F9F5"""
+"""9961D4E4B99A21E8_A3879E854CC96180_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC3=C(C=C2)CCO3)N""",21,"""C30D8101D474F9F5"""
+"""95879D654B4DA2AA_F544E47178B33203_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=C(C=C2)[N](=O)=O)N""",21,"""C30D8101D474F9F5"""
+"""F179311444041B83_0E8AE0D4B7908798_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3)N""",21,"""C30D8101D474F9F5"""
+"""C9C048B2C576DD53_AA3E8354C649D5DA_6006_UN""","""CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=C(S2)C(F)(F)F)N""",21,"""C30D8101D474F9F5"""
+"""552A6CFA1B8E2037_A6A979FC9499DDDF_6006_DP""","""N1CCN(CC1)C2=NC=NC(=C2)C3=CC(=C(C(=C3)F)F)F""",21,"""C31D8D37A1730D4B"""
+"""B19EF433BDD84166_8BA8DE6AB36FE8E3_6006_DP""","""N1CCN(CC1)C2=NC=NC(=C2)C3=CC=C(C(C)C)C=C3""",21,"""C31D8D37A1730D4B"""
+"""27040AD7C72EA1A3_292B195B6376C326_6006_DP""","""N1CCN(CC1)C2=NC=NC(=C2)C3=CC4=C(C=C3)CCC4""",21,"""C31D8D37A1730D4B"""
+"""BB405690A40F84F8_89F959977C1EB984_6006_DP""","""N1CCN(CC1)C2=NC=NC(=C2)C3=CC=CC(=C3)C#CC""",21,"""C31D8D37A1730D4B"""
+"""185965111C784DA0_89FDDDE56D76921B_6006_DP""","""N1CCN(CC1)C2=NC=NC(=C2)C3=CC=CC(=C3)CSC""",21,"""C31D8D37A1730D4B"""
+"""72ECC1ECE2EC7DE5_09136DCBCF61BE1E_6006_DP""","""N1CCN(CC1)C2=NC=NC(=C2)C3=CN=C(C=C3)[N](=O)=O""",21,"""C31D8D37A1730D4B"""
+"""C50FEA8F9C5F07FE_51486FE769F94C34_6006_DP""","""N1CCN(CC1)C2=NC=NC(=C2)C3=CSC=C3C(F)(F)F""",21,"""C31D8D37A1730D4B"""
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+"""6B87254B46A2F0F9_14B0EB7B2A578658_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CC=CC(=C2F)OC""",21,"""C656BAA3F9F9F2EC"""
+"""F13F80FE5FF53BB2_A32F9C05E2A64430_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=C(C=CC(=C2)OC)C""",21,"""C656BAA3F9F9F2EC"""
+"""FBE8D40138D85440_B27730E283E2353D_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C3=C2OC=CC2=CC=C3""",21,"""C656BAA3F9F9F2EC"""
+"""728356BC74804411_0B863447829C010B_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=C(OC)C=C(C=C2)F""",21,"""C656BAA3F9F9F2EC"""
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+"""E686F203F848D39F_1B9C47476B2BF85D_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CC=C(C(C)O)C=C2""",21,"""C656BAA3F9F9F2EC"""
+"""FD2FCE426E6D0310_13B8FBF8540FBF7C_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=COC(=C2)C(F)(F)F""",21,"""C656BAA3F9F9F2EC"""
+"""179ADC389858BD13_0D4DBD7DEB9DE88F_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CC(=CS2)C(F)(F)F""",21,"""C656BAA3F9F9F2EC"""
+"""4B0BF4ABBF7537F4_8EDCBFB96A7CDE94_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CN=C(N(C)C)N=C2""",21,"""C656BAA3F9F9F2EC"""
+"""F628C172D15D9FAA_5B5D562D5C670657_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C3=CC2=C(C=CC=N2)S3""",21,"""C656BAA3F9F9F2EC"""
+"""8D4A70617B3E3AFC_EC28D6925414002F_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=C(C(=CC=C2O)F)F""",21,"""C656BAA3F9F9F2EC"""
+"""151366E0E88FB33F_0B6BEC1805520335_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CSC3=C2C=CC=C3""",21,"""C656BAA3F9F9F2EC"""
+"""E2542F0489E92ED0_746D50ADC26571A2_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CC=C[N]3N=CC=C23""",21,"""C656BAA3F9F9F2EC"""
+"""B3D7E7C97330EFDD_CDC7792C43239A15_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CN=C(C=C2)C(F)F""",21,"""C656BAA3F9F9F2EC"""
+"""618FE9B0BE814C3F_A6DCA52761446A99_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CC3=C(C=C2)CCO3""",21,"""C656BAA3F9F9F2EC"""
+"""BF97CF8CF08082EA_F01FDFD3553E391A_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CC=C(C=C2)[N](=O)=O""",21,"""C656BAA3F9F9F2EC"""
+"""C7381A10912B7DD7_0BD1DB769A1D8C81_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CC3=C(C=C2)C=N[NH]3""",21,"""C656BAA3F9F9F2EC"""
+"""A0446D268AA60F89_AF65B8F6EBC4DEC3_6006_UN""","""OC(=O)C1=C(N=CC(=C1)[N](=O)=O)C2=CC=C(S2)C(F)(F)F""",21,"""C656BAA3F9F9F2EC"""
+"""6CC036244C81278D_CAB2573861EAFFAA_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=CC=C(F)C=C3""",21,"""C6C55B74DF1F145F"""
+"""C805DCBFDA370EF4_3F36CD43B0BD9A41_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=CC=C(C)C=C3""",21,"""C6C55B74DF1F145F"""
+"""ED3B88898ED9DD0A_7676182EA1BF55EF_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=C(C)[NH]C(=C3)C""",21,"""C6C55B74DF1F145F"""
+"""8D8AECEE3B9622FA_D9596F4D445EA27B_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=CC=CC(=C3)C""",21,"""C6C55B74DF1F145F"""
+"""808D63BD83E2C734_E1E1AFAAA5D66374_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=C[N](N=C3C)C""",21,"""C6C55B74DF1F145F"""
+"""D69E4F200E7D2958_E9B28A662B5385DC_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=C(N=C(C)O3)C""",21,"""C6C55B74DF1F145F"""
+"""4FD82B552F3FF29D_ADA13887445730E8_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=CC=CC(=C3)Cl""",21,"""C6C55B74DF1F145F"""
+"""3B72C2BDBF64A213_9E2CACD96D06BF8A_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=CC=C(C=C3)Br""",21,"""C6C55B74DF1F145F"""
+"""9CFF1F32C95F3CE0_EF0613D398E5C68E_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)CCC(OCC)=O""",21,"""C6C55B74DF1F145F"""
+"""91DF61E5FCD1CC26_03D98354C8A5406C_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=CN=CC(=C3)F""",21,"""C6C55B74DF1F145F"""
+"""8550B29CF6CEB506_374ECA0B368FD474_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=NC=CC(=C3)C""",21,"""C6C55B74DF1F145F"""
+"""3FF71D8D847C760D_A6125F3B883113FA_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=C(C)N=CC=C3""",21,"""C6C55B74DF1F145F"""
+"""4DDE4580FD947FEC_C24F3DC2506D5AC1_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)CC(C)(C)C3CC3""",21,"""C6C55B74DF1F145F"""
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+"""C7E8BC6EB6314C48_03982C1D513B56EE_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=C(C)SC(=C3)C""",21,"""C6C55B74DF1F145F"""
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+"""BBC24F2CC9B7DC06_F99092E5529B0F72_1171_UN""","""CC(=O)N1CCCC(C1)C2=NC(=CS2)C3=N[N](C(=C3)C)C""",21,"""C6C55B74DF1F145F"""
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+"""8F7613B1D73DEDA7_A2E54F8631967C37_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC(=C(C(=C2)F)F)F""",21,"""C751BB4D047CACA3"""
+"""73F4427FC1923BE8_8FE4E8101660490B_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC=C(C(C)C)C=C2""",21,"""C751BB4D047CACA3"""
+"""404855597379AFFC_2D672F21C67962CE_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC3=C(C=C2)CCC3""",21,"""C751BB4D047CACA3"""
+"""09885A9D4B8E8EB7_8DB56FEDD911186C_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC=CC(=C2)C#CC""",21,"""C751BB4D047CACA3"""
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+"""0D28CD20A9A9F8B3_5504599DCCF6EDDC_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CSC=C2C(F)(F)F""",21,"""C751BB4D047CACA3"""
+"""A83A5A7B467B0889_7C0FBCF77C79E85D_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC(=CC=C2)C(=O)O""",21,"""C751BB4D047CACA3"""
+"""767AD57D1C04125C_9E0349F64948A7DE_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C3=C2[NH]C=CC2=CC=C3""",21,"""C751BB4D047CACA3"""
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+"""F9C9B8C5613065B8_AE22DCF63240A4EA_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=C(C(=C(C)C=C2)F)F""",21,"""C751BB4D047CACA3"""
+"""EA24BAB98E09DD2C_EFE9973738DD896E_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C3=C[N]2C=NN=C2C=C3""",21,"""C751BB4D047CACA3"""
+"""FC3DC79691187D93_01DF74FFBAE35AC2_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC(=C(C=C2)F)OC""",21,"""C751BB4D047CACA3"""
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+"""C6CAD06B6EBBFD67_B29AC802347C941E_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC=C(C(N)=O)C=C2""",21,"""C751BB4D047CACA3"""
+"""4D0F3065303ECC97_68E5E13E8E6B71AB_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC(=C(OC)C=C2)F""",21,"""C751BB4D047CACA3"""
+"""35864F881DDAADAE_304DE2FBDE069D77_6006_DP""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C3=C2[N](CCNC2)N=C3""",21,"""C751BB4D047CACA3"""
+"""A83A5A7B467B0889_3C1C80A325A0C86C_6006_DP""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC=CC(=C2)C(O)=O""",21,"""C751BB4D047CACA3"""
+"""1601E86E46141A94_15B7EA95D7D2D817_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC=CC(=C2F)OC""",21,"""C751BB4D047CACA3"""
+"""81754EEBE1C2B616_A2289DEB1F231A7F_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=C(C=CC(=C2)OC)C""",21,"""C751BB4D047CACA3"""
+"""3F155F88ABD66E0F_B370310C7E676B72_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C3=C2OC=CC2=CC=C3""",21,"""C751BB4D047CACA3"""
+"""8EE18208B927467B_0A8135A97F195F44_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=C(OC)C=C(C=C2)F""",21,"""C751BB4D047CACA3"""
+"""4A402C4AE15EC9A3_0ADC29E121A2C98D_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC(=C(OC)C=C2)C""",21,"""C751BB4D047CACA3"""
+"""B57F80F3EBF157AB_1A9B46A996AEA612_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC=C(C(C)O)C=C2""",21,"""C751BB4D047CACA3"""
+"""68E6BA7D779901BD_12BFFA16A98AE133_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=COC(=C2)C(F)(F)F""",21,"""C751BB4D047CACA3"""
+"""36EF100713FB96CB_0C4ABC931618B6C0_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC(=CS2)C(F)(F)F""",21,"""C751BB4D047CACA3"""
+"""0A52F7EB924D1151_8FDBBE5797F980DB_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CN=C(N(C)C)N=C2""",21,"""C751BB4D047CACA3"""
+"""BF273539082C78DE_5A5A57C3A1E25818_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C3=CC2=C(C=CC=N2)S3""",21,"""C751BB4D047CACA3"""
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+"""7D760526A1209A27_0A6CEDF6F8D75D7A_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CSC3=C2C=CC=C3""",21,"""C751BB4D047CACA3"""
+"""718A028A4A9F93AE_756A51433FE02FED_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC=C[N]3N=CC=C23""",21,"""C751BB4D047CACA3"""
+"""7D85FA4B526A76E1_CCC078C2BEA6C45A_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CN=C(C=C2)C(F)F""",21,"""C751BB4D047CACA3"""
+"""0876EDB3C4680542_A7DBA4C99CC134D6_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC3=C(C=C2)CCO3""",21,"""C751BB4D047CACA3"""
+"""B8246DC04AF3E0F1_F118DE3DA8BB6755_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC=C(C=C2)[N](=O)=O""",21,"""C751BB4D047CACA3"""
+"""49050E2DB39778A1_0AD6DA986798D2CE_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC3=C(C=C2)C=N[NH]3""",21,"""C751BB4D047CACA3"""
+"""D3782B5551D8FB02_AE62B9181641808C_6006_UN""","""NC1=C(C(=CC(=C1)C#N)[N](=O)=O)C2=CC=C(S2)C(F)(F)F""",21,"""C751BB4D047CACA3"""
+"""BEEC4D8C13595418_A2D6D74E78EB35A7_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC(=C(C(=C4)F)F)F""",21,"""C76223854D01E533"""
+"""6D173A4F825EF759_8FD770D85F1D009B_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC=C(C(C)C)C=C4""",21,"""C76223854D01E533"""
+"""B8C677EC64C5B0A5_2D54B7E98F042B5E_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC5=C(C=C4)CCC5""",21,"""C76223854D01E533"""
+"""58CFCE89FD14715B_8D86F725906C51FC_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC=CC(=C4)C#CC""",21,"""C76223854D01E533"""
+"""5A6DCB086A28D083_8D82735781047A63_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC=CC(=C4)CSC""",21,"""C76223854D01E533"""
+"""DF07DD33C9BFC580_0D6CC37923135666_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CN=C(C=C4)[N](=O)=O""",21,"""C76223854D01E533"""
+"""5BB76329061C8BE3_5537C155858BA44C_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CSC=C4C(F)(F)F""",21,"""C76223854D01E533"""
+"""9C04E74D0F7E2469_7C3C243F3504A1CD_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC(=CC=C4)C(=O)O""",21,"""C76223854D01E533"""
+"""2A167FD81E20CDAA_9E30D13E0035EE4E_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C5=C4[NH]C=CC4=CC=C5""",21,"""C76223854D01E533"""
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+"""C5542A69B199329D_01ECEC37F39E1352_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC(=C(C=C4)F)OC""",21,"""C76223854D01E533"""
+"""87E318D61AC7C36E_1731AF86340B8C2E_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=C(C=C(C)C=C4C)C""",21,"""C76223854D01E533"""
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+"""CE5F301CCF59D504_68D679F6C716383B_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC(=C(OC)C=C4)F""",21,"""C76223854D01E533"""
+"""A68FDBE70FF37817_307E7A33977BD4E7_6006_DP""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C5=C4[N](CCNC4)N=C5""",21,"""C76223854D01E533"""
+"""9C04E74D0F7E2469_3C2F186B6CDD81FC_6006_DP""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC=CC(=C4)C(O)=O""",21,"""C76223854D01E533"""
+"""184862A0C2D78648_1584725D9EAF9187_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC=CC(=C4F)OC""",21,"""C76223854D01E533"""
+"""3612A707317DF5AF_A21B0523565E53EF_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=C(C=CC(=C4)OC)C""",21,"""C76223854D01E533"""
+"""11B89544DC7E2F0F_B343A9C4371A22E2_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C5=C4OC=CC4=CC=C5""",21,"""C76223854D01E533"""
+"""D49D76AD23DEA359_0AB2AD61366416D4_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=C(OC)C=C(C=C4)F""",21,"""C76223854D01E533"""
+"""A00C97BB373BA75E_0AEFB12968DF801D_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC(=C(OC)C=C4)C""",21,"""C76223854D01E533"""
+"""69FAB693AFA1EFEA_1AA8DE61DFD3EF82_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=CC=C(C(C)O)C=C4""",21,"""C76223854D01E533"""
+"""D53A4A15F03EC506_128C62DEE0F7A8A3_6006_UN""","""C1(=NC=NC2=CC(=N[N]12)C3CC3)C4=COC(=C4)C(F)(F)F""",21,"""C76223854D01E533"""
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+"""1C300350C50D8377_1B36BAE4C5EBE01E_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=CC=CC(=C2F)OC""",21,"""C9D0EB3C164594AA"""
+"""447A3A67038F7EE9_ACA9CD9A0D1A2276_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=C(C=CC(=C2)OC)C""",21,"""C9D0EB3C164594AA"""
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+"""819C816F1523E762_040065D86D20674D_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=C(OC)C=C(C=C2)F""",21,"""C9D0EB3C164594AA"""
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+"""634B3A250B34C0DA_141A16D884979E1B_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=CC=C(C(C)O)C=C2""",21,"""C9D0EB3C164594AA"""
+"""10695395EF70EAFB_1C3EAA67BBB3D93A_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=COC(=C2)C(F)(F)F""",21,"""C9D0EB3C164594AA"""
+"""EE0E98FC3CDD623F_02CBECE204218EC9_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=CC(=CS2)C(F)(F)F""",21,"""C9D0EB3C164594AA"""
+"""10E668A2CAD1A1C8_815AEE2685C0B8D2_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=CN=C(N(C)C)N=C2""",21,"""C9D0EB3C164594AA"""
+"""98543480192FD497_54DB07B2B3DB6011_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C3=CC2=C(C=CC=N2)S3""",21,"""C9D0EB3C164594AA"""
+"""CBF6AB816E6DAF9E_E3AE870DBBA86669_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=C(C(=CC=C2O)F)F""",21,"""C9D0EB3C164594AA"""
+"""5BD79A56847EE454_04EDBD87EAEE6573_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=CSC3=C2C=CC=C3""",21,"""C9D0EB3C164594AA"""
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+"""0B816F80DF731B6A_C24128B3AC9FFC53_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=CN=C(C=C2)C(F)F""",21,"""C9D0EB3C164594AA"""
+"""D11FF5B0DA5AF1CD_A95AF4B88EF80CDF_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=CC3=C(C=C2)CCO3""",21,"""C9D0EB3C164594AA"""
+"""14A5804F08B641F6_FF998E4CBA825F5C_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""C9D0EB3C164594AA"""
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+"""C6EA7B6E12D0B097_A0E3E9690478B885_6006_UN""","""FC(F)C(F)(F)C1=CN=C(C=C1)C2=CC=C(S2)C(F)(F)F""",21,"""C9D0EB3C164594AA"""
+"""7F03466521CB2A3D_AC5DFBFB3BE66C70_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC(=C(C(=C3)F)F)F""",21,"""C9E90F300E0CBCE4"""
+"""FD93B306DBEBDAF3_815C5C6D1C10594C_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=C(C(C)C)C=C3""",21,"""C9E90F300E0CBCE4"""
+"""6E771A78BD5569E5_23DF9B5CCC097289_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC4=C(C=C3)CCC4""",21,"""C9E90F300E0CBCE4"""
+"""1A415E3986A8D346_830DDB90D361082B_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=CC(=C3)C#CC""",21,"""C9E90F300E0CBCE4"""
+"""347FC32DC513285D_83095FE2C20923B4_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=CC(=C3)CSC""",21,"""C9E90F300E0CBCE4"""
+"""F53155F156EBFEC1_03E7EFCC601E0FB1_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CN=C(C=C3)[N](=O)=O""",21,"""C9E90F300E0CBCE4"""
+"""DF3938B18EAD894D_5BBCEDE0C686FD9B_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CSC=C3C(F)(F)F""",21,"""C9E90F300E0CBCE4"""
+"""BB5ADD3BD7A85B37_72B7088A7609F81A_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC(=CC=C3)C(=O)O""",21,"""C9E90F300E0CBCE4"""
+"""90F366D468B7035E_90BBFD8B4338B799_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C4=C3[NH]C=CC3=CC=C4""",21,"""C9E90F300E0CBCE4"""
+"""642BC237CF4418AE_535B48DBE261C68E_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=C(C=C(C)C=C3F)F""",21,"""C9E90F300E0CBCE4"""
+"""BF7735B1624A8CFC_E7E036D3553AE7D5_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=CC4=NON=C34""",21,"""C9E90F300E0CBCE4"""
+"""493B8C28EE2F2442_A09A688B3830B4AD_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=C(C(=C(C)C=C3)F)F""",21,"""C9E90F300E0CBCE4"""
+"""722E90EF2EFBE27C_E151234A32AD9929_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C4=C[N]3C=NN=C3C=C4""",21,"""C9E90F300E0CBCE4"""
+"""C801B0F6F6302164_0F67C082B0934A85_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC(=C(C=C3)F)OC""",21,"""C9E90F300E0CBCE4"""
+"""57388C1EE5611315_19BA83337706D5F9_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=C(C=C(C)C=C3C)C""",21,"""C9E90F300E0CBCE4"""
+"""3A6EFBFACAAB9417_6C71DC7C30D2B375_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=C(OC)C=CC=C3F""",21,"""C9E90F300E0CBCE4"""
+"""4796071D1F6FCC31_BC227C7F3E0C8459_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=C(C(N)=O)C=C3""",21,"""C9E90F300E0CBCE4"""
+"""76E9370CC7B560F5_665D5543841B61EC_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC(=C(OC)C=C3)F""",21,"""C9E90F300E0CBCE4"""
+"""1568949BE130F246_3EF55686D4768D30_6006_DP""","""CC1=CC=C(C=C1)C2=CSC(=N2)C4=C3[N](CCNC3)N=C4""",21,"""C9E90F300E0CBCE4"""
+"""BB5ADD3BD7A85B37_32A434DE2FD0D82B_6006_DP""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=CC(=C3)C(O)=O""",21,"""C9E90F300E0CBCE4"""
+"""3F7AE391E39522CC_1B0F5EE8DDA2C850_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=CC(=C3F)OC""",21,"""C9E90F300E0CBCE4"""
+"""40762D275492B40F_AC90299615530A38_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=C(C=CC(=C3)OC)C""",21,"""C9E90F300E0CBCE4"""
+"""AA682B8314878040_BDC8857174177B35_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C4=C3OC=CC3=CC=C4""",21,"""C9E90F300E0CBCE4"""
+"""38712D92FC8FAD08_043981D475694F03_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=C(OC)C=C(C=C3)F""",21,"""C9E90F300E0CBCE4"""
+"""E9E3C9A2BECF9457_04649D9C2BD2D9CA_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC(=C(OC)C=C3)C""",21,"""C9E90F300E0CBCE4"""
+"""7526ABF2210D30B5_1423F2D49CDEB655_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=C(C(C)O)C=C3""",21,"""C9E90F300E0CBCE4"""
+"""2DEE0A866800FAE1_1C074E6BA3FAF174_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=COC(=C3)C(F)(F)F""",21,"""C9E90F300E0CBCE4"""
+"""FDC4E1CE9B92225E_02F208EE1C68A687_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC(=CS3)C(F)(F)F""",21,"""C9E90F300E0CBCE4"""
+"""BD8FCD05DBBC7329_81630A2A9D89909C_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CN=C(N(C)C)N=C3""",21,"""C9E90F300E0CBCE4"""
+"""4E1CE6B722A6B807_54E2E3BEAB92485F_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C4=CC3=C(C=CC=N3)S4""",21,"""C9E90F300E0CBCE4"""
+"""569399D67705C94B_E3976301A3E14E27_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=C(C(=CC=C3O)F)F""",21,"""C9E90F300E0CBCE4"""
+"""EDF748EA27A733A1_04D4598BF2A74D3D_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CSC4=C3C=CC=C4""",21,"""C9E90F300E0CBCE4"""
+"""ADDCCCCFB763B19C_7BD2E53E35903FAA_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=C[N]4N=CC=C34""",21,"""C9E90F300E0CBCE4"""
+"""9BCE46A79E2D9D19_C278CCBFB4D6D41D_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CN=C(C=C3)C(F)F""",21,"""C9E90F300E0CBCE4"""
+"""2C677575D6169226_A96310B496B12491_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC4=C(C=C3)CCO4""",21,"""C9E90F300E0CBCE4"""
+"""CB318185E5052596_FFA06A40A2CB7712_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=C(C=C3)[N](=O)=O""",21,"""C9E90F300E0CBCE4"""
+"""E85EDCF48FFD3020_046E6EE56DE8C289_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""C9E90F300E0CBCE4"""
+"""367146E6CF33A9C3_A0DA0D651C3190CB_6006_UN""","""CC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=C(S3)C(F)(F)F""",21,"""C9E90F300E0CBCE4"""
+"""A42E3C4E35F3ADB8_B774B792FAA253D5_6036_UN""","""CC(C1=CC(=CC=C1)NC(=O)C)N([S](C)(=O)=O)CCCN""",21,"""C9EB8BDE37F1F4F4"""
+"""C9644DF602247205_1D818334FA5E1C7B_6036_UN""","""CC(C1=CC(=CC=C1)NC(=O)C)N([S](CC)(=O)=O)CCBr""",21,"""C9EB8BDE37F1F4F4"""
+"""38D9ADB4437C5441_130D751BEF15829A_6036_UN""","""CC(C1=CC(=CC=C1)NC(=O)C)N(CCNC)[S](=O)(=O)C""",21,"""C9EB8BDE37F1F4F4"""
+"""14A8E41D98A69BB5_EF77495FE4644F90_6036_UN""","""CC(C1=CC(=CC=C1)NC(=O)C)N([S](CCCC)(=O)=O)C""",21,"""C9EB8BDE37F1F4F4"""
+"""540B383529B8851D_DB64AB0236C434CF_6036_UN""","""CC(C1=CC(=CC=C1)NC(=O)C)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""C9EB8BDE37F1F4F4"""
+"""A3CA738D660755B5_CB82BAB087F66D02_6036_UN""","""CC(C1=CC(=CC=C1)NC(=O)C)N([S](C)(=O)=O)CCC#C""",21,"""C9EB8BDE37F1F4F4"""
+"""74C847295D3FD2BA_C2C0B40569C940A6_6036_UN""","""CC(C1=CC(=CC=C1)NC(=O)C)N(C)[S](=O)(=O)CCCCl""",21,"""C9EB8BDE37F1F4F4"""
+"""127ED70C894B50B7_833CFE016FD9D96D_6036_UN""","""CC(C1=CC(=CC=C1)NC(=O)C)N([S](CC)(=O)=O)CC#C""",21,"""C9EB8BDE37F1F4F4"""
+"""9F289D36EAC2419A_DAEF12570C1A200D_6036_UN""","""CC(C1=CC(=CC=C1)NC(=O)C)N2[S](CCCC2=O)(=O)=O""",21,"""C9EB8BDE37F1F4F4"""
+"""CD448B17E6220639_08118ECFF3E31E5B_6036_UN""","""CC(C1=CC(=CC=C1)NC(=O)C)N2C(C(N)C[S]2(=O)=O)=O""",21,"""C9EB8BDE37F1F4F4"""
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+"""B9CF469F89EA6B9A_07DB7FB83CEC116D_6006_UN""","""N[S](=O)(=O)CCC1=CN=C(C=C1)C2=C(OC)C=C(C=C2)F""",21,"""CA0BF15C4789E28A"""
+"""987174B28EEDA3A2_078663F0625787A4_6006_UN""","""N[S](=O)(=O)CCC1=CN=C(C=C1)C2=CC(=C(OC)C=C2)C""",21,"""CA0BF15C4789E28A"""
+"""953C344FBCFACCF9_17C10CB8D55BE83B_6006_UN""","""N[S](=O)(=O)CCC1=CN=C(C=C1)C2=CC=C(C(C)O)C=C2""",21,"""CA0BF15C4789E28A"""
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+"""367EDDDA45772300_49282E03DED00A8F_6036_UN""","""CCOC1=CC(=CC=C1)C(CC)N2[S](=O)(=O)C3(CC2)CC3""",21,"""CA4B701DCFFECE14"""
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+"""553C5388F9FA482D_069B1C3D2CAF6D18_6003_UN""","""CCOC1=CC(=CC=C1)C(OC2=CC=C(C=C2)C#N)CC""",21,"""CA4B701DCFFECE14"""
+"""D06CBD9E5B35B88D_39BBE6356D37D039_6003_UN""","""CCOC1=CC(=CC=C1)C(OC2=CC=CC=C2[N+]#[C-])CC""",21,"""CA4B701DCFFECE14"""
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+"""39E67FD876AFAA1E_D66CB1239284C4E7_6003_UN""","""CCOC1=CC(=CC=C1)C(OC2=CC=C(C=C2)[N+]#[C-])CC""",21,"""CA4B701DCFFECE14"""
+"""E5C62BCD75A21E04_585734C12DA91399_6003_UN""","""CCOC1=CC(=CC=C1)C(OC2=CC=CC(=C2)[N+]#[C-])CC""",21,"""CA4B701DCFFECE14"""
+"""C4064B9211D702E6_AF1A63A6EBC2CF6B_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""CAAE976DDE281FFF"""
+"""7FED2546BBBD82B1_821BC430CC34FA57_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC=C(C(C)C)C=C2""",21,"""CAAE976DDE281FFF"""
+"""1F9D3F0FFD182C8E_209803011C2DD192_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC3=C(C=C2)CCC3""",21,"""CAAE976DDE281FFF"""
+"""1BB1ED289D676A06_804A43CD0345AB30_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC=CC(=C2)C#CC""",21,"""CAAE976DDE281FFF"""
+"""B04D7E7E93EC9C42_804EC7BF122D80AF_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC=CC(=C2)CSC""",21,"""CAAE976DDE281FFF"""
+"""B1C6F787D0A5926F_00A07791B03AACAA_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""CAAE976DDE281FFF"""
+"""A30B04129EA88832_58FB75BD16A25E80_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CSC=C2C(F)(F)F""",21,"""CAAE976DDE281FFF"""
+"""0C1A053B0621F8E2_71F090D7A62D5B01_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC(=CC=C2)C(=O)O""",21,"""CAAE976DDE281FFF"""
+"""8D441F10E3602D38_93FC65D6931C1482_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""CAAE976DDE281FFF"""
+"""EC2CAA12A5427B0A_501CD08632456595_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=C(C=C(C)C=C2F)F""",21,"""CAAE976DDE281FFF"""
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+"""760C558A32C918FB_E216BB17E2893A32_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C3=C[N]2C=NN=C2C=C3""",21,"""CAAE976DDE281FFF"""
+"""5467AC5FC203937A_0C2058DF60B7E99E_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC(=C(C=C2)F)OC""",21,"""CAAE976DDE281FFF"""
+"""D5504BD15EAF531D_1AFD1B6EA72276E2_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=C(C=C(C)C=C2C)C""",21,"""CAAE976DDE281FFF"""
+"""C31C998B4E54D405_6F364421E0F6106E_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=C(OC)C=CC=C2F""",21,"""CAAE976DDE281FFF"""
+"""8D19CD7501E02B70_BF65E422EE282742_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC=C(C(N)=O)C=C2""",21,"""CAAE976DDE281FFF"""
+"""C3A31AEFF5C01A81_651ACD1E543FC2F7_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC(=C(OC)C=C2)F""",21,"""CAAE976DDE281FFF"""
+"""011B1594C8F6BFE7_3DB2CEDB04522E2B_6006_DP""","""COC(=O)C#CC1=NC=C(C=C1)C3=C2[N](CCNC2)N=C3""",21,"""CAAE976DDE281FFF"""
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+"""7DC298C19E5CDEAB_1848C6B50D866B4B_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC=CC(=C2F)OC""",21,"""CAAE976DDE281FFF"""
+"""B1AA9E248C6E95A2_AFD7B1CBC577A923_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=C(C=CC(=C2)OC)C""",21,"""CAAE976DDE281FFF"""
+"""DD3804EA220700C0_BE8F1D2CA433D82E_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C3=C2OC=CC2=CC=C3""",21,"""CAAE976DDE281FFF"""
+"""01F3BA8C4EBEAA86_077E1989A54DEC18_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=C(OC)C=C(C=C2)F""",21,"""CAAE976DDE281FFF"""
+"""46CAE2BAD66DC605_072305C1FBF67AD1_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC(=C(OC)C=C2)C""",21,"""CAAE976DDE281FFF"""
+"""40182979C2B77C81_17646A894CFA154E_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC=C(C(C)O)C=C2""",21,"""CAAE976DDE281FFF"""
+"""1FA0416C1E9C5B39_1F40D63673DE526F_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=COC(=C2)C(F)(F)F""",21,"""CAAE976DDE281FFF"""
+"""58D2979279C7F9F6_01B590B3CC4C059C_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC(=CS2)C(F)(F)F""",21,"""CAAE976DDE281FFF"""
+"""9DD4885655F0567E_822492774DAD3387_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CN=C(N(C)C)N=C2""",21,"""CAAE976DDE281FFF"""
+"""780E90C33FB6CAEB_57A57BE37BB6EB44_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C3=CC2=C(C=CC=N2)S3""",21,"""CAAE976DDE281FFF"""
+"""36C82A1BEBA29108_E0D0FB5C73C5ED3C_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=C(C(=CC=C2O)F)F""",21,"""CAAE976DDE281FFF"""
+"""92621B05092721C4_0793C1D62283EE26_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CSC3=C2C=CC=C3""",21,"""CAAE976DDE281FFF"""
+"""00502748790B9CF2_78957D63E5B49CB1_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC=C[N]3N=CC=C23""",21,"""CAAE976DDE281FFF"""
+"""D7A32BC9AC3BEA5F_C13F54E264F27706_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CN=C(C=C2)C(F)F""",21,"""CAAE976DDE281FFF"""
+"""CB2741450A9FC0A5_AA2488E94695878A_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC3=C(C=C2)CCO3""",21,"""CAAE976DDE281FFF"""
+"""A59AC4CFF8AAED90_FCE7F21D72EFD409_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""CAAE976DDE281FFF"""
+"""6CAB040779ED8B6A_0729F6B8BDCC6192_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""CAAE976DDE281FFF"""
+"""9D155DD78344AEE2_A39D9538CC1533D0_6006_UN""","""COC(=O)C#CC1=NC=C(C=C1)C2=CC=C(S2)C(F)(F)F""",21,"""CAAE976DDE281FFF"""
+"""37D63E03D7AB5AC0_AE231240E6537347_6006_UN""","""C1(=NC(=CC=N1)N2CCOCC2)C3=CC(=C(C(=C3)F)F)F""",21,"""CB97E68BD3B9A3D3"""
+"""4E1C542F66433060_8322B5D6C1A5467B_6006_UN""","""C1(=NC(=CC=N1)N2CCOCC2)C3=CC=C(C(C)C)C=C3""",21,"""CB97E68BD3B9A3D3"""
+"""A3F4E03B5E65A419_21A172E711BC6DBE_6006_UN""","""C1(=NC(=CC=N1)N2CCOCC2)C3=CC4=C(C=C3)CCC4""",21,"""CB97E68BD3B9A3D3"""
+"""36C44DCB16D559B4_8173322B0ED4171C_6006_UN""","""C1(=NC(=CC=N1)N2CCOCC2)C3=CC=CC(=C3)C#CC""",21,"""CB97E68BD3B9A3D3"""
+"""2A4B1DF0664CA1E5_8177B6591FBC3C83_6006_UN""","""C1(=NC(=CC=N1)N2CCOCC2)C3=CC=CC(=C3)CSC""",21,"""CB97E68BD3B9A3D3"""
+"""D77AEF7A7438572D_01990677BDAB1086_6006_UN""","""C1(=NC(=CC=N1)N2CCOCC2)C3=CN=C(C=C3)[N](=O)=O""",21,"""CB97E68BD3B9A3D3"""
+"""62694DA381F65AA3_59C2045B1B33E2AC_6006_UN""","""C1(=NC(=CC=N1)N2CCOCC2)C3=CSC=C3C(F)(F)F""",21,"""CB97E68BD3B9A3D3"""
+"""4D6960AB5FDE733C_70C9E131ABBCE72D_6006_UN""","""C1(=NC(=CC=N1)N2CCOCC2)C3=CC(=CC=C3)C(=O)O""",21,"""CB97E68BD3B9A3D3"""
+"""4677111973E870B7_92C514309E8DA8AE_6006_UN""","""C1(=NC(=CC=N1)N2CCOCC2)C4=C3[NH]C=CC3=CC=C4""",21,"""CB97E68BD3B9A3D3"""
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+"""EBA999DB07DF955F_5728E2050F6EA574_6036_UN""","""CC(CC1=CC2=C(C=C1)OCO2)N([S](C)(=O)=O)CCCBr""",21,"""CBFB8F78555B02AA"""
+"""D0E024157D0B1704_072BE358B60AA1A6_6003_UN""","""CC(OC1=CC=C(C=C1)C#N)CC2=CC3=C(C=C2)OCO3""",21,"""CBFB8F78555B02AA"""
+"""F370C4B0BF550039_380B1950F7921C87_6003_UN""","""CC(OC1=CC=CC=C1[N+]#[C-])CC2=CC3=C(C=C2)OCO3""",21,"""CBFB8F78555B02AA"""
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+"""86F67D0B6003B41D_D7DC4E4608210859_6003_UN""","""CC(OC1=CC=C(C=C1)[N+]#[C-])CC2=CC3=C(C=C2)OCO3""",21,"""CBFB8F78555B02AA"""
+"""655C296199B968F6_59E7CBA4B70CDF27_6003_UN""","""CC(OC1=CC=CC(=C1)[N+]#[C-])CC2=CC3=C(C=C2)OCO3""",21,"""CBFB8F78555B02AA"""
+"""911364A3CCD4414B_A9B4056A624C7CC8_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC(=C(C(=C3)F)F)F""",21,"""CC00F1A157A6AC5C"""
+"""AAF8E957BA1D76AC_84B5A2FC45BA49F4_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC=C(C(C)C)C=C3""",21,"""CC00F1A157A6AC5C"""
+"""0F4A5E62B709AABB_263665CD95A36231_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC4=C(C=C3)CCC4""",21,"""CC00F1A157A6AC5C"""
+"""0AC963830D8B1644_86E425018ACB1893_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC=CC(=C3)C#CC""",21,"""CC00F1A157A6AC5C"""
+"""1DFB34E710969C41_86E0A1739BA3330C_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC=CC(=C3)CSC""",21,"""CC00F1A157A6AC5C"""
+"""ABBA72192FDE1C94_060E115D39B41F09_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CN=C(C=C3)[N](=O)=O""",21,"""CC00F1A157A6AC5C"""
+"""3E7F4C037B5AF39C_5E5513719F2CED23_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CSC=C3C(F)(F)F""",21,"""CC00F1A157A6AC5C"""
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+"""645D604871A2D0ED_9552031A1A92A721_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C4=C3[NH]C=CC3=CC=C4""",21,"""CC00F1A157A6AC5C"""
+"""4A8CF72EA0DEB705_56B2B64ABBCBD636_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=C(C=C(C)C=C3F)F""",21,"""CC00F1A157A6AC5C"""
+"""53302FE3126013F7_E209C8420C90F76D_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC=CC4=NON=C34""",21,"""CC00F1A157A6AC5C"""
+"""79C9633B5241E9A9_A573961A619AA415_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=C(C(=C(C)C=C3)F)F""",21,"""CC00F1A157A6AC5C"""
+"""F8B2653AC15CD0A6_E4B8DDDB6B078991_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C4=C[N]3C=NN=C3C=C4""",21,"""CC00F1A157A6AC5C"""
+"""E0BB0611F723F6DD_0A8E3E13E9395A3D_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC(=C(C=C3)F)OC""",21,"""CC00F1A157A6AC5C"""
+"""72A622EE8D8E3B3F_1C537DA22EACC541_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=C(C=C(C)C=C3C)C""",21,"""CC00F1A157A6AC5C"""
+"""15093CD55665D135_699822ED6978A3CD_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=C(OC)C=CC=C3F""",21,"""CC00F1A157A6AC5C"""
+"""2578569648C81A53_B9CB82EE67A694E1_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC=C(C(N)=O)C=C3""",21,"""CC00F1A157A6AC5C"""
+"""BAB7CAA3FB401A92_63B4ABD2DDB17154_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC(=C(OC)C=C3)F""",21,"""CC00F1A157A6AC5C"""
+"""566544822F212C5E_3B1CA8178DDC9D88_6006_DP""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C4=C3[N](CCNC3)N=C4""",21,"""CC00F1A157A6AC5C"""
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+"""A7FF2FFE3C1FA74C_1EE6A0798408D8E8_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC=CC(=C3F)OC""",21,"""CC00F1A157A6AC5C"""
+"""2484D23846CDBC2D_A979D7074CF91A80_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=C(C=CC(=C3)OC)C""",21,"""CC00F1A157A6AC5C"""
+"""00D217E27B49D7A4_B8217BE02DBD6B8D_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C4=C3OC=CC3=CC=C4""",21,"""CC00F1A157A6AC5C"""
+"""EADC4A7DD9C10719_01D07F452CC35FBB_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=C(OC)C=C(C=C3)F""",21,"""CC00F1A157A6AC5C"""
+"""652E494A4147C79A_018D630D7278C972_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC(=C(OC)C=C3)C""",21,"""CC00F1A157A6AC5C"""
+"""D888E88D021B879E_11CA0C45C574A6ED_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC=C(C(C)O)C=C3""",21,"""CC00F1A157A6AC5C"""
+"""68DF7E8FEC638749_19EEB0FAFA50E1CC_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=COC(=C3)C(F)(F)F""",21,"""CC00F1A157A6AC5C"""
+"""9464B10D5FF0A7E1_071BF67F45C2B63F_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC(=CS3)C(F)(F)F""",21,"""CC00F1A157A6AC5C"""
+"""643AE3D8296688B2_848AF4BBC4238024_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CN=C(N(C)C)N=C3""",21,"""CC00F1A157A6AC5C"""
+"""699321EEB23B39E9_510B1D2FF23858E7_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C4=CC3=C(C=CC=N3)S4""",21,"""CC00F1A157A6AC5C"""
+"""50EF41571C807DC8_E67E9D90FA4B5E9F_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=C(C(=CC=C3O)F)F""",21,"""CC00F1A157A6AC5C"""
+"""D963DB1464AA4FC8_013DA71AAB0D5D85_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CSC4=C3C=CC=C4""",21,"""CC00F1A157A6AC5C"""
+"""F9F34C2C501535B4_7E3B1BAF6C3A2F12_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC=C[N]4N=CC=C34""",21,"""CC00F1A157A6AC5C"""
+"""D814330280919E9D_C791322EED7CC4A5_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CN=C(C=C3)C(F)F""",21,"""CC00F1A157A6AC5C"""
+"""C9065A066525C891_AC8AEE25CF1B3429_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC4=C(C=C3)CCO4""",21,"""CC00F1A157A6AC5C"""
+"""EE085A7E1C582AB5_FA4994D1FB6167AA_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC=C(C=C3)[N](=O)=O""",21,"""CC00F1A157A6AC5C"""
+"""2A126B4E231ABE96_018790743442D231_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""CC00F1A157A6AC5C"""
+"""0D8688690CBF81EE_A533F3F4459B8073_6006_UN""","""OC(=O)C1=C([N]2C(=N1)CCCC2)C3=CC=C(S3)C(F)(F)F""",21,"""CC00F1A157A6AC5C"""
+"""52CFB1347DED544C_A9B6E74134D8C85B_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC(=C(C(=C2)F)F)F""",21,"""CC02138A013218CF"""
+"""9C53E8505CA759EE_84B740D7132EFD67_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=C(C(C)C)C=C2""",21,"""CC02138A013218CF"""
+"""3CCFBB2873391C48_263487E6C337D6A2_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC3=C(C=C2)CCC3""",21,"""CC02138A013218CF"""
+"""9ED49CCFD6AC6EA7_86E6C72ADC5FAC00_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=CC(=C2)C#CC""",21,"""CC02138A013218CF"""
+"""205927009FEBA8D4_86E24358CD37879F_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=CC(=C2)CSC""",21,"""CC02138A013218CF"""
+"""6DDD9C658A719C64_060CF3766F20AB9A_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CN=C(C=C2)[N](=O)=O""",21,"""CC02138A013218CF"""
+"""2EDF439950952347_5E57F15AC9B859B0_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CSC=C2C(F)(F)F""",21,"""CC02138A013218CF"""
+"""768EC6F239AB4F33_775C143079375C31_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC(=CC=C2)C(=O)O""",21,"""CC02138A013218CF"""
+"""6AB98DAF27DEA302_9550E1314C0613B2_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C3=C2[NH]C=CC2=CC=C3""",21,"""CC02138A013218CF"""
+"""4F8F5A76BF1312D8_56B05461ED5F62A5_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=C(C=C(C)C=C2F)F""",21,"""CC02138A013218CF"""
+"""5781CAE33698B764_E20B2A695A0443FE_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=CC3=NON=C23""",21,"""CC02138A013218CF"""
+"""1B7B4CAEBFF2B274_A5717431370E1086_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=C(C(=C(C)C=C2)F)F""",21,"""CC02138A013218CF"""
+"""10F196C24AAD1F92_E4BA3FF03D933D02_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C3=C[N]2C=NN=C2C=C3""",21,"""CC02138A013218CF"""
+"""CB0D4167B79AD099_0A8CDC38BFADEEAE_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC(=C(C=C2)F)OC""",21,"""CC02138A013218CF"""
+"""BD5D771F5B978C88_1C519F89783871D2_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=C(C=C(C)C=C2C)C""",21,"""CC02138A013218CF"""
+"""0C310F798BF4D008_699AC0C63FEC175E_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=C(OC)C=CC=C2F""",21,"""CC02138A013218CF"""
+"""DED025BD0D56FB07_B9C960C531322072_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=C(C(N)=O)C=C2""",21,"""CC02138A013218CF"""
+"""FC0E6DB3D3D3A2C1_63B649F98B25C5C7_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC(=C(OC)C=C2)F""",21,"""CC02138A013218CF"""
+"""36D7EE60BE5DF144_3B1E4A3CDB48291B_6006_DP""","""COC(=O)C1=C(C=C(C=C1N)F)C3=C2[N](CCNC2)N=C3""",21,"""CC02138A013218CF"""
+"""768EC6F239AB4F33_374F286420EE7C00_6006_DP""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=CC(=C2)C(O)=O""",21,"""CC02138A013218CF"""
+"""291DC8735C0BF6C1_1EE44252D29C6C7B_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=CC(=C2F)OC""",21,"""CC02138A013218CF"""
+"""09DE565FDC41D59E_A97B352C1A6DAE13_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=C(C=CC(=C2)OC)C""",21,"""CC02138A013218CF"""
+"""E71B8BD24EB5B124_B82399CB7B29DF1E_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C3=C2OC=CC2=CC=C3""",21,"""CC02138A013218CF"""
+"""C6FFC838BC1DE154_01D29D6E7A57EB28_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=C(OC)C=C(C=C2)F""",21,"""CC02138A013218CF"""
+"""22A535DBF63C55DB_018F812624EC7DE1_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC(=C(OC)C=C2)C""",21,"""CC02138A013218CF"""
+"""F8BCB74455037D60_11C8EE6E93E0127E_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=C(C(C)O)C=C2""",21,"""CC02138A013218CF"""
+"""C7CF7F836B4EB02F_19EC52D1ACC4555F_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=COC(=C2)C(F)(F)F""",21,"""CC02138A013218CF"""
+"""4A0A1341A96B7032_07191454135602AC_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC(=CS2)C(F)(F)F""",21,"""CC02138A013218CF"""
+"""F6CCB2BD4F053F2F_8488169092B734B7_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CN=C(N(C)C)N=C2""",21,"""CC02138A013218CF"""
+"""7351731B559907E0_5109FF04A4ACEC74_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C3=CC2=C(C=CC=N2)S3""",21,"""CC02138A013218CF"""
+"""112AF729C01FD238_E67C7FBBACDFEA0C_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=C(C(=CC=C2O)F)F""",21,"""CC02138A013218CF"""
+"""21E1BB0BBC52C424_013F4531FD99E916_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CSC3=C2C=CC=C3""",21,"""CC02138A013218CF"""
+"""A97AB34A21273EFE_7E39F9843AAE9B81_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=C[N]3N=CC=C23""",21,"""CC02138A013218CF"""
+"""C55C7B13A7ABBD79_C793D005BBE87036_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CN=C(C=C2)C(F)F""",21,"""CC02138A013218CF"""
+"""714A9B01B26EF868_AC880C0E998F80BA_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC3=C(C=C2)CCO3""",21,"""CC02138A013218CF"""
+"""345D31F4554C470A_FA4B76FAADF5D339_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=C(C=C2)[N](=O)=O""",21,"""CC02138A013218CF"""
+"""452AC9D40A431D1C_0185725F62D666A2_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC3=C(C=C2)C=N[NH]3""",21,"""CC02138A013218CF"""
+"""5C648EC7642087E7_A53111DF130F34E0_6006_UN""","""COC(=O)C1=C(C=C(C=C1N)F)C2=CC=C(S2)C(F)(F)F""",21,"""CC02138A013218CF"""
+"""98226CBB0D9A5B83_A978CB67BA418D2F_6006_UN""","""COC(=O)CCC1=CN=C(C=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""CCCC3FAC8FAB5DBB"""
+"""A56A89C2C4E4BE5A_84796CF19DB7B813_6006_UN""","""COC(=O)CCC1=CN=C(C=C1)C2=CC=C(C(C)C)C=C2""",21,"""CCCC3FAC8FAB5DBB"""
+"""07F1C1C85019200F_26FAABC04DAE93D6_6006_UN""","""COC(=O)CCC1=CN=C(C=C1)C2=CC3=C(C=C2)CCC3""",21,"""CCCC3FAC8FAB5DBB"""
+"""7AAD6B64645FCE2F_8628EB0C52C6E974_6006_UN""","""COC(=O)CCC1=CN=C(C=C1)C2=CC=CC(=C2)C#CC""",21,"""CCCC3FAC8FAB5DBB"""
+"""D230A5A0066FE365_862C6F7E43AEC2EB_6006_UN""","""COC(=O)CCC1=CN=C(C=C1)C2=CC=CC(=C2)CSC""",21,"""CCCC3FAC8FAB5DBB"""
+"""5598F62809A0A53E_06C2DF50E1B9EEEE_6006_UN""","""COC(=O)CCC1=CN=C(C=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""CCCC3FAC8FAB5DBB"""
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+"""3722B46478D61336_55F967B27E70352E_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=C(C=C(C)C=C3F)F)F""",21,"""CF4B2059921D4F44"""
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+"""91CDF1C605A62134_A63847E2A421470D_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=C(C(=C(C)C=C3)F)F)F""",21,"""CF4B2059921D4F44"""
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+"""B1417B9C6225BB92_BA805316A21D77F9_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=CC=C(C(N)=O)C=C3)F""",21,"""CF4B2059921D4F44"""
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+"""95DBE1B4806A2CFB_1DAD718141B33BF0_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=CC=CC(=C3F)OC)F""",21,"""CF4B2059921D4F44"""
+"""BD727FBF968F9E42_AA3206FF8942F998_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=C(C=CC(=C3)OC)C)F""",21,"""CF4B2059921D4F44"""
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+"""5554314F5073426B_029BAEBDE978BCA3_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=C(OC)C=C(C=C3)F)F""",21,"""CF4B2059921D4F44"""
+"""53778312D00FF824_02C6B2F5B7C32A6A_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=CC(=C(OC)C=C3)C)F""",21,"""CF4B2059921D4F44"""
+"""555E98AA18A94A2B_1281DDBD00CF45F5_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=CC=C(C(C)O)C=C3)F""",21,"""CF4B2059921D4F44"""
+"""58865683FFB12424_1AA561023FEB02D4_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=COC(=C3)C(F)(F)F)F""",21,"""CF4B2059921D4F44"""
+"""1C3DF678E57EC342_0450278780795527_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=CC(=CS3)C(F)(F)F)F""",21,"""CF4B2059921D4F44"""
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+"""FADD79323040CDAE_5240CCD73783BBFF_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C4=CC3=C(C=CC=N3)S4)F""",21,"""CF4B2059921D4F44"""
+"""7527B5C79A2705A2_E5354C683FF0BD87_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=C(C(=CC=C3O)F)F)F""",21,"""CF4B2059921D4F44"""
+"""393805705DA92E58_027676E26EB6BE9D_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=CSC4=C3C=CC=C4)F""",21,"""CF4B2059921D4F44"""
+"""79820D511C4ED2B7_7D70CA57A981CC0A_6006_UN""","""FC2=C(C=C1C(=NC=CC1=C2)C3=CC=C[N]4N=CC=C34)F""",21,"""CF4B2059921D4F44"""
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+"""8D95500C12B91D02_A7D3176A3E876801_1171_UN""","""CNC1=C(C=C(C=C1)C2=NC(=CS2)C3=C[N](CC)N=C3)Cl""",21,"""D20FE48ED1E34689"""
+"""B014BD5857B36412_FCC9767FB4660CA8_1171_UN""","""CNC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=N[N]3C)C)Cl""",21,"""D20FE48ED1E34689"""
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+"""7A827595C6BDCE03_5EBB8DDEA6CE3018_1171_UN""","""CNC1=C(C=C(C=C1)C2=NC(=CS2)C3=C(C)C=CC=C3)Cl""",21,"""D20FE48ED1E34689"""
+"""8A548A4BF44E0869_A4AAB4BACFF56244_1171_UN""","""CNC1=C(C=C(C=C1)C2=NC(=CS2)C3=NN=C(Cl)C=C3)Cl""",21,"""D20FE48ED1E34689"""
+"""AEE9806D873BA447_F6BF6F0BF97399C7_1171_UN""","""CNC1=C(C=C(C=C1)C2=NC(=CS2)C3=C(C)[N](N=C3)C)Cl""",21,"""D20FE48ED1E34689"""
+"""F252532B8F225A26_B7044B011AB6976D_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC(=C(C(=C2)F)F)F""",21,"""D2B0BFCA2F5C47F9"""
+"""387E4B24768FD9F9_9A05EC973D40A251_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=C(C(C)C)C=C2""",21,"""D2B0BFCA2F5C47F9"""
+"""444ABC4ECD4373DE_38862BA6ED598994_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC3=C(C=C2)CCC3""",21,"""D2B0BFCA2F5C47F9"""
+"""E598A1A54C960B90_98546B6AF231F336_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=CC(=C2)C#CC""",21,"""D2B0BFCA2F5C47F9"""
+"""8882ED7657538AD3_9850EF18E359D8A9_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=CC(=C2)CSC""",21,"""D2B0BFCA2F5C47F9"""
+"""77AD35A991BB63AC_18BE5F36414EF4AC_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CN=C(C=C2)[N](=O)=O""",21,"""D2B0BFCA2F5C47F9"""
+"""ED794466C9F2C4BD_40E55D1AE7D60686_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CSC=C2C(F)(F)F""",21,"""D2B0BFCA2F5C47F9"""
+"""D0A02AEC8641C934_69EEB87057590307_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC(=CC=C2)C(=O)O""",21,"""D2B0BFCA2F5C47F9"""
+"""8CB885A17BB5FEE3_8BE24D7162684C84_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C3=C2[NH]C=CC2=CC=C3""",21,"""D2B0BFCA2F5C47F9"""
+"""16020391467A6532_4802F821C3313D93_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=C(C=C(C)C=C2F)F""",21,"""D2B0BFCA2F5C47F9"""
+"""F46096D8A12D0E29_FCB98629746A1CC8_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=CC3=NON=C23""",21,"""D2B0BFCA2F5C47F9"""
+"""BB2A5D78B95D72E6_BBC3D87119604FB0_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=C(C(=C(C)C=C2)F)F""",21,"""D2B0BFCA2F5C47F9"""
+"""5B0767BEB43B8906_FA0893B013FD6234_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C3=C[N]2C=NN=C2C=C3""",21,"""D2B0BFCA2F5C47F9"""
+"""980CCF37569CBFAE_143E707891C3B198_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC(=C(C=C2)F)OC""",21,"""D2B0BFCA2F5C47F9"""
+"""381B3D385EFE40B1_02E333C956562EE4_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=C(C=C(C)C=C2C)C""",21,"""D2B0BFCA2F5C47F9"""
+"""E882E77828738089_77286C8611824868_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=C(OC)C=CC=C2F""",21,"""D2B0BFCA2F5C47F9"""
+"""3BD47C3713860BDC_A77BCC851F5C7F44_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=C(C(N)=O)C=C2""",21,"""D2B0BFCA2F5C47F9"""
+"""3E3485E258A2E933_7D04E5B9A54B9AF1_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC(=C(OC)C=C2)F""",21,"""D2B0BFCA2F5C47F9"""
+"""F048EBA97912A2ED_25ACE67CF526762D_6006_DP""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C3=C2[N](CCNC2)N=C3""",21,"""D2B0BFCA2F5C47F9"""
+"""D0A02AEC8641C934_29FD84240E802336_6006_DP""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=CC(=C2)C(O)=O""",21,"""D2B0BFCA2F5C47F9"""
+"""DF9AE6DB01F39AAA_0056EE12FCF2334D_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=CC(=C2F)OC""",21,"""D2B0BFCA2F5C47F9"""
+"""15127CE96D10842A_B7C9996C3403F125_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=C(C=CC(=C2)OC)C""",21,"""D2B0BFCA2F5C47F9"""
+"""687A7CB91904FF16_A691358B55478028_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C3=C2OC=CC2=CC=C3""",21,"""D2B0BFCA2F5C47F9"""
+"""4451FC713A66953A_1F60312E5439B41E_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=C(OC)C=C(C=C2)F""",21,"""D2B0BFCA2F5C47F9"""
+"""E86B23BC00D4FBB6_1F3D2D660A8222D7_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC(=C(OC)C=C2)C""",21,"""D2B0BFCA2F5C47F9"""
+"""BDC8412CE9789F12_0F7A422EBD8E4D48_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=C(C(C)O)C=C2""",21,"""D2B0BFCA2F5C47F9"""
+"""0787D6DDFDD4914E_075EFE9182AA0A69_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=COC(=C2)C(F)(F)F""",21,"""D2B0BFCA2F5C47F9"""
+"""E5CB85845E75D3B2_19ABB8143D385D9A_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC(=CS2)C(F)(F)F""",21,"""D2B0BFCA2F5C47F9"""
+"""52C902522CE27309_9A3ABAD0BCD96B81_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CN=C(N(C)C)N=C2""",21,"""D2B0BFCA2F5C47F9"""
+"""355E6D5608FEA543_4FBB53448AC2B342_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C3=CC2=C(C=CC=N2)S3""",21,"""D2B0BFCA2F5C47F9"""
+"""CB093AD734130416_F8CED3FB82B1B53A_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=C(C(=CC=C2O)F)F""",21,"""D2B0BFCA2F5C47F9"""
+"""E65AEB3887F4A36D_1F8DE971D3F7B620_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CSC3=C2C=CC=C3""",21,"""D2B0BFCA2F5C47F9"""
+"""A704EA238570BF9D_608B55C414C0C4B7_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=C[N]3N=CC=C23""",21,"""D2B0BFCA2F5C47F9"""
+"""FF026236E204EAEC_D9217C4595862F00_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CN=C(C=C2)C(F)F""",21,"""D2B0BFCA2F5C47F9"""
+"""12C4D2D4F95062CE_B23AA04EB7E1DF8C_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC3=C(C=C2)CCO3""",21,"""D2B0BFCA2F5C47F9"""
+"""A767480C0478B938_E4F9DABA839B8C0F_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=C(C=C2)[N](=O)=O""",21,"""D2B0BFCA2F5C47F9"""
+"""1BF25EEB329F9044_1F37DE1F4CB83994_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC3=C(C=C2)C=N[NH]3""",21,"""D2B0BFCA2F5C47F9"""
+"""831A37CFD60E34E6_BB83BD9F3D616BD6_6006_UN""","""FC(F)(F)C1=CC(=C(C=C1)C#N)C2=CC=C(S2)C(F)(F)F""",21,"""D2B0BFCA2F5C47F9"""
+"""8DC79C358224CEC8_B777785D2F6112CB_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC(=C(C(=C2)F)F)F)N""",21,"""D2C38C961A8BC25F"""
+"""CAFC6827B21F7A2A_9A76DFCB089727F7_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=C(C(C)C)C=C2)N""",21,"""D2C38C961A8BC25F"""
+"""E31187E029C4B148_38F518FAD88E0C32_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC3=C(C=C2)CCC3)N""",21,"""D2C38C961A8BC25F"""
+"""26B0A82024657EC0_98275836C7E67690_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=CC(=C2)C#CC)N""",21,"""D2C38C961A8BC25F"""
+"""9F3B7425520D57D5_9823DC44D68E5D0F_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=CC(=C2)CSC)N""",21,"""D2C38C961A8BC25F"""
+"""76532CB924D79993_18CD6C6A7499710A_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CN=C(C=C2)[N](=O)=O)N""",21,"""D2C38C961A8BC25F"""
+"""78F4045A8C42190B_40966E46D2018320_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CSC=C2C(F)(F)F)N""",21,"""D2C38C961A8BC25F"""
+"""B28564D7327CBA15_699D8B2C628E86A1_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC(=CC=C2)C(=O)O)N""",21,"""D2C38C961A8BC25F"""
+"""7D39A595F545F069_8B917E2D57BFC922_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C3=C2[NH]C=CC2=CC=C3)N""",21,"""D2C38C961A8BC25F"""
+"""EE1A5DD1C4D77318_4871CB7DF6E6B835_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=C(C=C(C)C=C2F)F)N""",21,"""D2C38C961A8BC25F"""
+"""BFB02756CA61C38A_FCCAB57541BD996E_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=CC3=NON=C23)N""",21,"""D2C38C961A8BC25F"""
+"""8750CC053052BFDB_BBB0EB2D2CB7CA16_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=C(C(=C(C)C=C2)F)F)N""",21,"""D2C38C961A8BC25F"""
+"""0C332F5A69CCB3CB_FA7BA0EC262AE792_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C3=C[N]2C=NN=C2C=C3)N""",21,"""D2C38C961A8BC25F"""
+"""096DA0CC290C6450_144D4324A414343E_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC(=C(C=C2)F)OC)N""",21,"""D2C38C961A8BC25F"""
+"""6569D993884B9A6F_029000956381AB42_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=C(C=C(C)C=C2C)C)N""",21,"""D2C38C961A8BC25F"""
+"""03C7959CEB9A9BB0_775B5FDA2455CDCE_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=C(OC)C=CC=C2F)N""",21,"""D2C38C961A8BC25F"""
+"""C10F50D5D5A6100D_A708FFD92A8BFAE2_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=C(C(N)=O)C=C2)N""",21,"""D2C38C961A8BC25F"""
+"""FCA6C23B6C4CB6F7_7D77D6E5909C1F57_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC(=C(OC)C=C2)F)N""",21,"""D2C38C961A8BC25F"""
+"""18682BCA86F60A8B_25DFD520C0F1F38B_6006_DP""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C3=C2[N](CCNC2)N=C3)N""",21,"""D2C38C961A8BC25F"""
+"""B28564D7327CBA15_298EB7783B57A690_6006_DP""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=CC(=C2)C(O)=O)N""",21,"""D2C38C961A8BC25F"""
+"""9F5183DAA0C67AD8_0025DD4EC925B6EB_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=CC(=C2F)OC)N""",21,"""D2C38C961A8BC25F"""
+"""968B7BCFB683C2DD_B7BAAA3001D47483_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=C(C=CC(=C2)OC)C)N""",21,"""D2C38C961A8BC25F"""
+"""F7FCBA65336A9E72_A6E206D76090058E_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C3=C2OC=CC2=CC=C3)N""",21,"""D2C38C961A8BC25F"""
+"""7BBF8B04BAC24612_1F13027261EE31B8_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=C(OC)C=C(C=C2)F)N""",21,"""D2C38C961A8BC25F"""
+"""977D9A4FB16AB340_1F4E1E3A3F55A771_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC(=C(OC)C=C2)C)N""",21,"""D2C38C961A8BC25F"""
+"""834D9625B43F2E85_0F0971728859C8EE_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=C(C(C)O)C=C2)N""",21,"""D2C38C961A8BC25F"""
+"""D7A6132A35B3D76D_072DCDCDB77D8FCF_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=COC(=C2)C(F)(F)F)N""",21,"""D2C38C961A8BC25F"""
+"""88D27F2EA3DA7900_19D88B4808EFD83C_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC(=CS2)C(F)(F)F)N""",21,"""D2C38C961A8BC25F"""
+"""3ACB3BEA686BE03A_9A49898C890EEE27_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CN=C(N(C)C)N=C2)N""",21,"""D2C38C961A8BC25F"""
+"""8AB46607C1ABCFD0_4FC86018BF1536E4_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C3=CC2=C(C=CC=N2)S3)N""",21,"""D2C38C961A8BC25F"""
+"""1C0CA9BAAC4E65C5_F8BDE0A7B766309C_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=C(C(=CC=C2O)F)F)N""",21,"""D2C38C961A8BC25F"""
+"""50B4F43E836310D1_1FFEDA2DE6203386_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CSC3=C2C=CC=C3)N""",21,"""D2C38C961A8BC25F"""
+"""18F5B15D6A69CA0D_60F8669821174111_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=C[N]3N=CC=C23)N""",21,"""D2C38C961A8BC25F"""
+"""27BE90221D98FE93_D9524F19A051AAA6_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CN=C(C=C2)C(F)F)N""",21,"""D2C38C961A8BC25F"""
+"""59946D79C8AAB000_B249931282365A2A_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC3=C(C=C2)CCO3)N""",21,"""D2C38C961A8BC25F"""
+"""40A5E76A2B824CA5_E48AE9E6B64C09A9_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=C(C=C2)[N](=O)=O)N""",21,"""D2C38C961A8BC25F"""
+"""522B840BDBD84539_1F44ED43796FBC32_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC3=C(C=C2)C=N[NH]3)N""",21,"""D2C38C961A8BC25F"""
+"""0A9CF9F13EDEEC58_BBF08EC308B6EE70_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C(=C1)F)C2=CC=C(S2)C(F)(F)F)N""",21,"""D2C38C961A8BC25F"""
+"""85C3CD923DB4622E_B6EB08F87B985476_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC(=C(C(=C2)F)F)F)N""",21,"""D35FFC334E7284E2"""
+"""796B181FEFEDF323_9BEAAF6E5C6E614A_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=C(C(C)C)C=C2)N""",21,"""D35FFC334E7284E2"""
+"""F95A79374D7D4BA5_3969685F8C774A8F_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC3=C(C=C2)CCC3)N""",21,"""D35FFC334E7284E2"""
+"""3FA72419C4786318_99BB2893931F302D_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=CC(=C2)C#CC)N""",21,"""D35FFC334E7284E2"""
+"""049D2DD94ED1F6BC_99BFACE182771BB2_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=CC(=C2)CSC)N""",21,"""D35FFC334E7284E2"""
+"""580D9EFF2A4A7085_19511CCF206037B7_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CN=C(C=C2)[N](=O)=O)N""",21,"""D35FFC334E7284E2"""
+"""4F2C73414B76582D_410A1EE386F8C59D_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CSC=C2C(F)(F)F)N""",21,"""D35FFC334E7284E2"""
+"""78EBCEB52A66C660_6801FB893677C01C_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC(=CC=C2)C(=O)O)N""",21,"""D35FFC334E7284E2"""
+"""AFD719D482AB07CD_8A0D0E8803468F9F_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C3=C2[NH]C=CC2=CC=C3)N""",21,"""D35FFC334E7284E2"""
+"""8FACC70ABF90FB1D_49EDBBD8A21FFE88_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=C(C=C(C)C=C2F)F)N""",21,"""D35FFC334E7284E2"""
+"""9FC1CEA1BE225CFC_FD56C5D01544DFD3_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=CC3=NON=C23)N""",21,"""D35FFC334E7284E2"""
+"""2980DF4C82D43118_BA2C9B88784E8CAB_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=C(C(=C(C)C=C2)F)F)N""",21,"""D35FFC334E7284E2"""
+"""F73D3FAAFDE9E769_FBE7D04972D3A12F_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C3=C[N]2C=NN=C2C=C3)N""",21,"""D35FFC334E7284E2"""
+"""D5578EC398F23D6F_15D13381F0ED7283_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC(=C(C=C2)F)OC)N""",21,"""D35FFC334E7284E2"""
+"""460DF5FBE8DA17AA_030C70303778EDFF_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=C(C=C(C)C=C2C)C)N""",21,"""D35FFC334E7284E2"""
+"""FE5C580C4861F743_76C72F7F70AC8B73_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=C(OC)C=CC=C2F)N""",21,"""D35FFC334E7284E2"""
+"""A03F7726FA133F15_A6948F7C7E72BC5F_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=C(C(N)=O)C=C2)N""",21,"""D35FFC334E7284E2"""
+"""BC3317877E81E430_7CEBA640C46559EA_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC(=C(OC)C=C2)F)N""",21,"""D35FFC334E7284E2"""
+"""0F53C9CC27AD773E_2443A5859408B536_6006_DP""","""COC(=O)C1=C(C(=NC(=C1)C)C3=C2[N](CCNC2)N=C3)N""",21,"""D35FFC334E7284E2"""
+"""78EBCEB52A66C660_2812C7DD6FAEE02D_6006_DP""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=CC(=C2)C(O)=O)N""",21,"""D35FFC334E7284E2"""
+"""616E11076E45011C_01B9ADEB9DDCF056_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=CC(=C2F)OC)N""",21,"""D35FFC334E7284E2"""
+"""6BAF71DD6F5CCF00_B626DA95552D323E_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=C(C=CC(=C2)OC)C)N""",21,"""D35FFC334E7284E2"""
+"""ACD3322952676D2E_A77E767234694333_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C3=C2OC=CC2=CC=C3)N""",21,"""D35FFC334E7284E2"""
+"""76833E5A9ABB8338_1E8F72D735177705_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=C(OC)C=C(C=C2)F)N""",21,"""D35FFC334E7284E2"""
+"""945D5A81A5FA5047_1ED26E9F6BACE1CC_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC(=C(OC)C=C2)C)N""",21,"""D35FFC334E7284E2"""
+"""AFCA7E9C26BA88F0_0E9501D7DCA08E53_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=C(C(C)O)C=C2)N""",21,"""D35FFC334E7284E2"""
+"""F813C1BE1B8187A0_06B1BD68E384C972_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=COC(=C2)C(F)(F)F)N""",21,"""D35FFC334E7284E2"""
+"""49AD28F6852ECF52_1844FBED5C169E81_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC(=CS2)C(F)(F)F)N""",21,"""D35FFC334E7284E2"""
+"""4405ADF25A7E1ADE_9BD5F929DDF7A89A_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CN=C(N(C)C)N=C2)N""",21,"""D35FFC334E7284E2"""
+"""39D0BE110AB914D0_4E5410BDEBEC7059_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C3=CC2=C(C=CC=N2)S3)N""",21,"""D35FFC334E7284E2"""
+"""DF81BD373594F5C4_F9219002E39F7621_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=C(C(=CC=C2O)F)F)N""",21,"""D35FFC334E7284E2"""
+"""4AFB4E60365C7182_1E62AA88B2D9753B_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CSC3=C2C=CC=C3)N""",21,"""D35FFC334E7284E2"""
+"""560A7AE25D6E96E7_6164163D75EE07AC_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=C[N]3N=CC=C23)N""",21,"""D35FFC334E7284E2"""
+"""49F2B445EAE4EAA9_D8CE3FBCF4A8EC1B_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CN=C(C=C2)C(F)F)N""",21,"""D35FFC334E7284E2"""
+"""093ED659D96769C9_B3D5E3B7D6CF1C97_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC3=C(C=C2)CCO3)N""",21,"""D35FFC334E7284E2"""
+"""A351D385060BE0D8_E5169943E2B54F14_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=C(C=C2)[N](=O)=O)N""",21,"""D35FFC334E7284E2"""
+"""FC25DB47F41378A2_1ED89DE62D96FA8F_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC3=C(C=C2)C=N[NH]3)N""",21,"""D35FFC334E7284E2"""
+"""5EBE6C625CF8FB75_BA6CFE665C4FA8CD_6006_UN""","""COC(=O)C1=C(C(=NC(=C1)C)C2=CC=C(S2)C(F)(F)F)N""",21,"""D35FFC334E7284E2"""
+"""14E5A82E4746A3F0_B6DF2DA78D3B333A_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=CC(=C(C(=C2)F)F)F""",21,"""D36BD96CB8D1E3AE"""
+"""15FC4AB07BE63EB1_9BDE8A31AACD0606_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=CC=C(C(C)C)C=C2""",21,"""D36BD96CB8D1E3AE"""
+"""2994DD4758921488_395D4D007AD42DC3_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=CC3=C(C=C2)CCC3""",21,"""D36BD96CB8D1E3AE"""
+"""2980C9642D7F0659_998F0DCC65BC5761_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=CC=CC(=C2)C#CC""",21,"""D36BD96CB8D1E3AE"""
+"""9CD4D9A8E30A166A_998B89BE74D47CFE_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=CC=CC(=C2)CSC""",21,"""D36BD96CB8D1E3AE"""
+"""F23971CC5418581B_19653990D6C350FB_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=CN=C(C=C2)[N](=O)=O""",21,"""D36BD96CB8D1E3AE"""
+"""F1CE2DC329295C3B_413E3BBC705BA2D1_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=CSC=C2C(F)(F)F""",21,"""D36BD96CB8D1E3AE"""
+"""E70CD42F48529494_6835DED6C0D4A750_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=CC(=CC=C2)C(=O)O""",21,"""D36BD96CB8D1E3AE"""
+"""FE498E2ABDD138BF_8A392BD7F5E5E8D3_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C3=C2[NH]C=CC2=CC=C3""",21,"""D36BD96CB8D1E3AE"""
+"""4A415210DBB69902_49D99E8754BC99C4_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=C(C=C(C)C=C2F)F""",21,"""D36BD96CB8D1E3AE"""
+"""C517E87185E8B096_FD62E08FE3E7B89F_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=CC=CC3=NON=C23""",21,"""D36BD96CB8D1E3AE"""
+"""2686CECABEE5D59A_BA18BED78EEDEBE7_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=C(C(=C(C)C=C2)F)F""",21,"""D36BD96CB8D1E3AE"""
+"""3E870ED64DBCEB2E_FBD3F5168470C663_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C3=C[N]2C=NN=C2C=C3""",21,"""D36BD96CB8D1E3AE"""
+"""E5EABC20A408AE32_15E516DE064E15CF_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=CC(=C(C=C2)F)OC""",21,"""D36BD96CB8D1E3AE"""
+"""CC2E99878E381A68_0338556FC1DB8AB3_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=C(C=C(C)C=C2C)C""",21,"""D36BD96CB8D1E3AE"""
+"""4B4D3C849861F8D1_76F30A20860FEC3F_6006_UN""","""CC1=NC(=C(C(=C1)C)C(F)(F)F)C2=C(OC)C=CC=C2F""",21,"""D36BD96CB8D1E3AE"""
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+"""EE8C0F42F14B32E7_612C52C1CB41BF4B_6036_UN""","""C(C1=CN=N[N]1C2=CC=CC=C2)N3[S](=O)(CCNCC3)=O""",21,"""D37C0500B6823111"""
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+"""B5C388F5105297A8_73CCC99C36D5761F_6036_UN""","""C(C1=CN=N[N]1C2=CC=CC=C2)N3CC4(C[S]3(=O)=O)CC4""",21,"""D37C0500B6823111"""
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+"""FDB6038328A74F0D_EB24C89CA0610C8A_6036_DP""","""CC1=C(C(=C(N=C1)CN[S](=O)(=O)C2(CC2)C#N)C)[N](=O)=O""",21,"""D5C045FD587AD4DE"""
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+"""F501D8E3FE2B7B46_6408837C8AEFF034_6036_UN""","""CC1=C(C(=C(N=C1)CN(CC)[S](=O)(=O)CCN)C)[N](=O)=O""",21,"""D5C045FD587AD4DE"""
+"""D9A9B1559A296548_DE9B28898BF90579_6036_UN""","""CC1=C(C(=C(N=C1)CN(C)[S](=O)(=O)C(C)(C)C)C)[N](=O)=O""",21,"""D5C045FD587AD4DE"""
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+"""4F48384F12847973_39858DDEDCD2581B_6036_UN""","""CC1=C(C(=C(N=C1)CN([S](CCNC)(=O)=O)C)C)[N](=O)=O""",21,"""D5C045FD587AD4DE"""
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+"""E2C5F8AD5E51E93A_75708961D82D93D0_6036_UN""","""CC1=C(C(=C(N=C1)CN2CC3(C[S]2(=O)=O)CC3)C)[N](=O)=O""",21,"""D5C045FD587AD4DE"""
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+"""556304D89600EC42_5BB8B4660007BD5C_6036_UN""","""CC1=C(C(=C(N=C1)CN2CCCCC[S]2(=O)=O)C)[N](=O)=O""",21,"""D5C045FD587AD4DE"""
+"""ACAE4AB1C8D2C36E_49132880024F7300_6036_UN""","""CC1=C(C(=C(N=C1)CN([S](C)(=O)=O)CCCBr)C)[N](=O)=O""",21,"""D5C045FD587AD4DE"""
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+"""9ED77B6B25D63807_1C0BD910E8A52C48_6006_UN""","""CN(C)C1=CC(=C(C=C1)C(=N)N)C2=CN=C(C=C2)[N](=O)=O""",21,"""D60539EC86B79F1D"""
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+"""A8D3BF7E4C9EF3C0_BF765E57B08B9754_6006_UN""","""CN(C)C1=CC(=C(C=C1)C(=N)N)C2=C(C(=C(C)C=C2)F)F""",21,"""D60539EC86B79F1D"""
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+"""834AA16BAD770444_0656B5EFFFBDF600_6006_UN""","""CN(C)C1=CC(=C(C=C1)C(=N)N)C2=C(C=C(C)C=C2C)C""",21,"""D60539EC86B79F1D"""
+"""B5A73B8CBA2D140D_739DEAA0B869908C_6006_UN""","""CN(C)C1=CC(=C(C=C1)C(=N)N)C2=C(OC)C=CC=C2F""",21,"""D60539EC86B79F1D"""
+"""1CDF8770EB24CAED_A3CE4AA3B6B7A7A0_6006_UN""","""CN(C)C1=CC(=C(C=C1)C(=N)N)C2=CC=C(C(N)=O)C=C2""",21,"""D60539EC86B79F1D"""
+"""231D598ED2A2904B_79B1639F0CA04215_6006_UN""","""CN(C)C1=CC(=C(C=C1)C(=N)N)C2=CC(=C(OC)C=C2)F""",21,"""D60539EC86B79F1D"""
+"""9D02B56BAF60D38A_2119605A5CCDAEC9_6006_DP""","""CN(C)C1=CC(=C(C=C1)C(=N)N)C3=C2[N](CCNC2)N=C3""",21,"""D60539EC86B79F1D"""
+"""CD8519387237A3D7_2D480202A76BFBD2_6006_DP""","""CN(C)C1=CC(=C(C=C1)C(=N)N)C2=CC=CC(=C2)C(O)=O""",21,"""D60539EC86B79F1D"""
+"""EC706F7584877CC3_04E368345519EBA9_6006_UN""","""CN(C)C1=CC(=C(C=C1)C(=N)N)C2=CC=CC(=C2F)OC""",21,"""D60539EC86B79F1D"""
+"""8A8900EE52645CBB_B37C1F4A9DE829C1_6006_UN""","""CN(C)C1=CC(=C(C=C1)C(=N)N)C2=C(C=CC(=C2)OC)C""",21,"""D60539EC86B79F1D"""
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+"""23DBC1E35AC0D6C3_0A59146F57CF0293_6006_UN""","""NC1=C(N=CN=C1C2=CC=C(C(C)O)C=C2)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""7EEE702F895DF312_027DA8D068EB45B2_6006_UN""","""NC1=C(N=CN=C1C2=COC(=C2)C(F)(F)F)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""CECBBC8F71EF764A_1C88EE55D7791241_6006_UN""","""NC1=C(N=CN=C1C2=CC(=CS2)C(F)(F)F)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""754343DBF5AAA3F0_9F19EC915698245A_6006_UN""","""NC1=C(N=CN=C1C2=CN=C(N(C)C)N=C2)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""EE1FC62C21A50DC4_4A9805056083FC99_6006_UN""","""NC1=C(N=CN=C1C3=CC2=C(C=CC=N2)S3)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""1C9B19850A1AC835_FDED85BA68F0FAE1_6006_UN""","""NC1=C(N=CN=C1C2=C(C(=CC=C2O)F)F)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""3F0E5456F8E2C6CD_1AAEBF3039B6F9FB_6006_UN""","""NC1=C(N=CN=C1C2=CSC3=C2C=CC=C3)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""8BD358DB8D2ED23C_65A80385FE818B6C_6006_UN""","""NC1=C(N=CN=C1C2=CC=C[N]3N=CC=C23)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""CB7B4FA3F64850E6_DC022A047FC760DB_6006_UN""","""NC1=C(N=CN=C1C2=CN=C(C=C2)C(F)F)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""F88E50A28B6B4103_B719F60F5DA09057_6006_UN""","""NC1=C(N=CN=C1C2=CC3=C(C=C2)CCO3)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""01C6E637F84577B5_E1DA8CFB69DAC3D4_6006_UN""","""NC1=C(N=CN=C1C2=CC=C(C=C2)[N](=O)=O)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""3D547BECA31CC44F_1A14885EA6F9764F_6006_UN""","""NC1=C(N=CN=C1C2=CC3=C(C=C2)C=N[NH]3)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""6F69C24D89F82921_BEA0EBDED720240D_6006_UN""","""NC1=C(N=CN=C1C2=CC=C(S2)C(F)(F)F)NCC(=O)O""",21,"""D793E98BC51D0822"""
+"""966BB1F7F06AE636_B20C8B36EB194F5A_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC(=C(C(=C2)F)F)F""",21,"""D7B87FFDDEF39FCE"""
+"""E4D4EB048C615355_9F0D2CA0CCEF7A66_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=C(C(C)C)C=C2""",21,"""D7B87FFDDEF39FCE"""
+"""0AA5D7CA8B5D987E_3D8EEB911CF651A3_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC3=C(C=C2)CCC3""",21,"""D7B87FFDDEF39FCE"""
+"""F30F1402C9E5BD9B_9D5CAB5D039E2B01_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=CC(=C2)C#CC""",21,"""D7B87FFDDEF39FCE"""
+"""CB149ACC14BAFD58_9D582F2F12F6009E_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=CC(=C2)CSC""",21,"""D7B87FFDDEF39FCE"""
+"""9118DBB02DBF87E9_1DB69F01B0E12C9B_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CN=C(C=C2)[N](=O)=O""",21,"""D7B87FFDDEF39FCE"""
+"""CB4C86A64148E4A5_45ED9D2D1679DEB1_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CSC=C2C(F)(F)F""",21,"""D7B87FFDDEF39FCE"""
+"""3BE438A140117FA0_6CE67847A6F6DB30_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC(=CC=C2)C(=O)O""",21,"""D7B87FFDDEF39FCE"""
+"""ADB19CF451EE83B7_8EEA8D4693C794B3_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C3=C2[NH]C=CC2=CC=C3""",21,"""D7B87FFDDEF39FCE"""
+"""E8D340F53529D0ED_4D0A3816329EE5A4_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=C(C=C(C)C=C2F)F""",21,"""D7B87FFDDEF39FCE"""
+"""1690EEBF096D3657_F9B1461E85C5C4FF_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=CC3=NON=C23""",21,"""D7B87FFDDEF39FCE"""
+"""46E91C62F5070EE2_BECB1846E8CF9787_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=C(C(=C(C)C=C2)F)F""",21,"""D7B87FFDDEF39FCE"""
+"""3A0D54D47F39FFF3_FF005387E252BA03_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C3=C[N]2C=NN=C2C=C3""",21,"""D7B87FFDDEF39FCE"""
+"""99D65E1B050C1964_1136B04F606C69AF_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC(=C(C=C2)F)OC""",21,"""D7B87FFDDEF39FCE"""
+"""7A5609433EEB2152_07EBF3FEA7F9F6D3_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=C(C=C(C)C=C2C)C""",21,"""D7B87FFDDEF39FCE"""
+"""0DB279E9CAB29806_7220ACB1E02D905F_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=C(OC)C=CC=C2F""",21,"""D7B87FFDDEF39FCE"""
+"""22B74DD44E31B28D_A2730CB2EEF3A773_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=C(C(N)=O)C=C2""",21,"""D7B87FFDDEF39FCE"""
+"""18DDD65C42F8BE44_780C258E54E442C6_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC(=C(OC)C=C2)F""",21,"""D7B87FFDDEF39FCE"""
+"""70EFAE5B66AD9A7A_20A4264B0489AE1A_6006_DP""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C3=C2[N](CCNC2)N=C3""",21,"""D7B87FFDDEF39FCE"""
+"""3BE438A140117FA0_2CF54413FF2FFB01_6006_DP""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=CC(=C2)C(O)=O""",21,"""D7B87FFDDEF39FCE"""
+"""350D160BDBB77B86_055E2E250D5DEB7A_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=CC(=C2F)OC""",21,"""D7B87FFDDEF39FCE"""
+"""D63A5EB9D539F6F8_B2C1595BC5AC2912_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=C(C=CC(=C2)OC)C""",21,"""D7B87FFDDEF39FCE"""
+"""C5D920B838270936_A399F5BCA4E8581F_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C3=C2OC=CC2=CC=C3""",21,"""D7B87FFDDEF39FCE"""
+"""2148385575BE9BC5_1A68F119A5966C29_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=C(OC)C=C(C=C2)F""",21,"""D7B87FFDDEF39FCE"""
+"""CF32DBA04AEF84D3_1A35ED51FB2DFAE0_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC(=C(OC)C=C2)C""",21,"""D7B87FFDDEF39FCE"""
+"""B690DF1642FDD300_0A7282194C21957F_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=C(C(C)O)C=C2""",21,"""D7B87FFDDEF39FCE"""
+"""0CB5665F99CA6F1D_02563EA67305D25E_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=COC(=C2)C(F)(F)F""",21,"""D7B87FFDDEF39FCE"""
+"""0929809BDFB8A5B8_1CA37823CC9785AD_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC(=CS2)C(F)(F)F""",21,"""D7B87FFDDEF39FCE"""
+"""D50E7D5F1CCB9BCF_9F327AE74D76B3B6_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CN=C(N(C)C)N=C2""",21,"""D7B87FFDDEF39FCE"""
+"""F7BDF9F7AD708625_4AB393737B6D6B75_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C3=CC2=C(C=CC=N2)S3""",21,"""D7B87FFDDEF39FCE"""
+"""95F25021C196120C_FDC613CC731E6D0D_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=C(C(=CC=C2O)F)F""",21,"""D7B87FFDDEF39FCE"""
+"""9A19523A2A2FCFDC_1A85294622586E17_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CSC3=C2C=CC=C3""",21,"""D7B87FFDDEF39FCE"""
+"""75594EC292025C08_658395F3E56F1C80_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=C[N]3N=CC=C23""",21,"""D7B87FFDDEF39FCE"""
+"""3B3EAF1F4DD7C016_DC29BC726429F737_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CN=C(C=C2)C(F)F""",21,"""D7B87FFDDEF39FCE"""
+"""DF02FF58BAB4E623_B7326079464E07BB_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC3=C(C=C2)CCO3""",21,"""D7B87FFDDEF39FCE"""
+"""690B35071276CC17_E1F11A8D72345438_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=C(C=C2)[N](=O)=O""",21,"""D7B87FFDDEF39FCE"""
+"""64B5226E57937573_1A3F1E28BD17E1A3_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC3=C(C=C2)C=N[NH]3""",21,"""D7B87FFDDEF39FCE"""
+"""23DAA69F00B7A803_BE8B7DA8CCCEB3E1_6006_UN""","""C1(=C(C=CC=C1C#N)[S](=O)(=O)Cl)C2=CC=C(S2)C(F)(F)F""",21,"""D7B87FFDDEF39FCE"""
+"""18E0D43B19C70263_A68B30CCE260BE1D_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](C)(=O)=O)CCCN""",21,"""D8140C802F33193C"""
+"""95E96B6607CC80C7_0C7E046AE29CF1B3_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](CC)(=O)=O)CCBr""",21,"""D8140C802F33193C"""
+"""047C36CC1892C08D_02F2F245F7D76F52_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N(CCNC)[S](=O)(=O)C""",21,"""D8140C802F33193C"""
+"""ABF088E13A776679_FE88CE01FCA6A258_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](CCCC)(=O)=O)C""",21,"""D8140C802F33193C"""
+"""0E48AA64A4E6A126_CA9B2C5C2E06D907_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""D8140C802F33193C"""
+"""5167C0E18CCF04EE_DA7D3DEE9F3480CA_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](C)(=O)=O)CCC#C""",21,"""D8140C802F33193C"""
+"""103068D942E0D255_D33F335B710BAD6E_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N(C)[S](=O)(=O)CCCCl""",21,"""D8140C802F33193C"""
+"""9C3FD46D38D2A425_92C3795F771B34A5_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](CC)(=O)=O)CC#C""",21,"""D8140C802F33193C"""
+"""47AF1A00BEAA59FD_CB10950914D8CDC5_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3[S](CCCC3=O)(=O)=O""",21,"""D8140C802F33193C"""
+"""54151AECBD8BC165_19EE0991EB21F393_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""D8140C802F33193C"""
+"""3663755A6A4AFE57_3C276E12B5CE6E47_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](C)(=O)=O)C3CNC3""",21,"""D8140C802F33193C"""
+"""E1B4B79074C4A52A_E6F081E1D728C168_6036_DP""","""C(C1=C(C=CC=C1)N2CCCC2)N[S](=O)(=O)C3(CC3)C#N""",21,"""D8140C802F33193C"""
+"""4B97104D58FBC926_F1FCD8CD08B95760_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N(C)[S](=O)(=O)CCCN""",21,"""D8140C802F33193C"""
+"""2A6C8962FB40017A_58E5FB29B5FDA35F_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N(C)[S](=O)(=O)C3COC3""",21,"""D8140C802F33193C"""
+"""7E2C02EC1CF21AC6_38C02ACB695013C0_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N(C)[S](=O)(=O)CCOC""",21,"""D8140C802F33193C"""
+"""83D5239F47BF0E59_961EB729BD60C1D5_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N(C)[S](=O)(=O)CC(=O)C""",21,"""D8140C802F33193C"""
+"""B2FC21FA69C59C6C_1E36D19D7BEEF298_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3CCCC(C)[S]3(=O)=O""",21,"""D8140C802F33193C"""
+"""12C4190ECA188078_13D9F77AC2D7C93D_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3CCC(C)(C)[S]3(=O)=O""",21,"""D8140C802F33193C"""
+"""CDA1901A0E6763A2_287156BBC3E03B62_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](CC)(=O)=O)CCN""",21,"""D8140C802F33193C"""
+"""9B6BF0F0408F78D4_69DCCA01FDA63DD6_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N(CC)[S](=O)(=O)CCN""",21,"""D8140C802F33193C"""
+"""B5A6CC842B7FA3DA_D34F61F4FCB0C89B_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""D8140C802F33193C"""
+"""0A8D69660BEB4CA5_5B77529E3E1DDDA7_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""D8140C802F33193C"""
+"""D26540DB171AA7DC_3451C4A3AB9B95F9_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](CCNC)(=O)=O)C""",21,"""D8140C802F33193C"""
+"""D26540DB171AA7DC_E8A13E3552049EDF_6036_DP""","""C(C1=C(C=CC=C1)N2CCCC2)N(C)[S](=O)(=O)CCNC""",21,"""D8140C802F33193C"""
+"""9FCCF12C81B4C4E7_F91CBAD9293E5904_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3[S](CCC3CI)(=O)=O""",21,"""D8140C802F33193C"""
+"""D0D9CC5C15B9ED44_651A1111533057C9_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3C(CN)CC[S]3(=O)=O""",21,"""D8140C802F33193C"""
+"""52ED76F3663907CB_F64DCEEB2BFAFAB1_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N(CC(C)C)[S](=O)(=O)C""",21,"""D8140C802F33193C"""
+"""7FF9C76106BD99B7_6A445B4152F09766_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3[S](=O)(CCNCC3)=O""",21,"""D8140C802F33193C"""
+"""1C45E95A84E7314C_D8A3401F796157CD_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](C=C)(=O)=O)C3CC3""",21,"""D8140C802F33193C"""
+"""8C637CBE07699D70_78A4C01CAF645E32_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3CC4(C[S]3(=O)=O)CC4""",21,"""D8140C802F33193C"""
+"""4FCA3C7FBA93B57B_B4EFB32DA73B4F70_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](C)(=O)=O)C(=O)CN""",21,"""D8140C802F33193C"""
+"""B7FB3477024E7337_566CFD1B774E70BE_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N3CCCCC[S]3(=O)=O""",21,"""D8140C802F33193C"""
+"""3B5770CCF79D67E4_44C761FD7506BEE2_6036_UN""","""C(C1=C(C=CC=C1)N2CCCC2)N([S](C)(=O)=O)CCCBr""",21,"""D8140C802F33193C"""
+"""04D0BB51F277F05D_14C460A0CC62BA30_6003_UN""","""O(CC1=C(C=CC=C1)N2CCCC2)C3=CC=C(C=C3)C#N""",21,"""D8140C802F33193C"""
+"""50E569DA544E05D6_2BE49AA88DFA0711_6003_UN""","""O(CC1=C(C=CC=C1)N2CCCC2)C3=CC=CC=C3[N+]#[C-]""",21,"""D8140C802F33193C"""
+"""37CEB80FC42FFEF3_2CB36FDAECB73AB3_6003_UN""","""O(CC1=C(C=CC=C1)N2CCCC2)C3=CC=CC=C3C#N""",21,"""D8140C802F33193C"""
+"""F653128125993FF0_C433CDBE724913CF_6003_UN""","""O(CC1=C(C=CC=C1)N2CCCC2)C3=CC=C(C=C3)[N+]#[C-]""",21,"""D8140C802F33193C"""
+"""808739F8EB4878CD_4A08485CCD64C4B1_6003_UN""","""O(CC1=C(C=CC=C1)N2CCCC2)C3=CC=CC(=C3)[N+]#[C-]""",21,"""D8140C802F33193C"""
+"""4CD2CC2BDEAB627A_BD88E71A0EF3032F_6006_UN""","""C1(=C(C=C(C=C1)C#N)[S](=O)(=O)Cl)C2=CC(=C(C(=C2)F)F)F""",21,"""D83C13D13B19D3BB"""
+"""D01D71DFB9C3BF93_9089408C29053613_6006_UN""","""C1(=C(C=C(C=C1)C#N)[S](=O)(=O)Cl)C2=CC=C(C(C)C)C=C2""",21,"""D83C13D13B19D3BB"""
+"""79BF0369265A49A3_320A87BDF91C1DD6_6006_UN""","""C1(=C(C=C(C=C1)C#N)[S](=O)(=O)Cl)C2=CC3=C(C=C2)CCC3""",21,"""D83C13D13B19D3BB"""
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+"""7886CCF5B287967D_147EC18CBE4DC2CA_6006_UN""","""CCC1=NC4=C(C(=N1)C2=CSC3=C2C=CC=C3)SC=C4C""",21,"""D943973742E63313"""
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+"""680B6C6103F25067_EF0AF247EE21F8E5_6006_UN""","""CCC1=NC3=C(C(=N1)C2=CC=C(C=C2)[N](=O)=O)SC=C3C""",21,"""D943973742E63313"""
+"""17232E2D27EC01CE_14C4F6E221024D7E_6006_UN""","""CCC1=NC4=C(C(=N1)C2=CC3=C(C=C2)C=N[NH]3)SC=C4C""",21,"""D943973742E63313"""
+"""A250F08CB61273F8_B070956250DB1F3C_6006_UN""","""CCC1=NC3=C(C(=N1)C2=CC=C(S2)C(F)(F)F)SC=C3C""",21,"""D943973742E63313"""
+"""6E916A98FA164D79_BC007D02A7DFC4EF_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC(=C(C(=C2)F)F)F""",21,"""D9B489C99235147B"""
+"""D8B3EF3F59FED232_9101DA948029F1D3_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=C(C(C)C)C=C2""",21,"""D9B489C99235147B"""
+"""23606245F5A64E50_33821DA55030DA16_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC3=C(C=C2)CCC3""",21,"""D9B489C99235147B"""
+"""3882BC10F05760BA_93505D694F58A0B4_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=CC(=C2)C#CC""",21,"""D9B489C99235147B"""
+"""17982723F1DA4EFB_9354D91B5E308B2B_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=CC(=C2)CSC""",21,"""D9B489C99235147B"""
+"""0B2D1E19C6E82452_13BA6935FC27A72E_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CN=C(C=C2)[N](=O)=O""",21,"""D9B489C99235147B"""
+"""8AB4699545E3B847_4BE16B195ABF5504_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CSC=C2C(F)(F)F""",21,"""D9B489C99235147B"""
+"""87FCBB66348EA07A_62EA8E73EA305085_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC(=CC=C2)C(=O)O""",21,"""D9B489C99235147B"""
+"""7C2EE362C934A172_80E67B72DF011F06_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C3=C2[NH]C=CC2=CC=C3""",21,"""D9B489C99235147B"""
+"""A83D6F383964D3F1_4306CE227E586E11_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=C(C=C(C)C=C2F)F""",21,"""D9B489C99235147B"""
+"""9A1316DFF2CA6E2A_F7BDB02AC9034F4A_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=CC3=NON=C23""",21,"""D9B489C99235147B"""
+"""4E9C0F716A52918E_B0C7EE72A4091C32_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=C(C(=C(C)C=C2)F)F""",21,"""D9B489C99235147B"""
+"""83BE0290DD37643A_F10CA5B3AE9431B6_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C3=C[N]2C=NN=C2C=C3""",21,"""D9B489C99235147B"""
+"""041262B079C8C87C_1F3A467B2CAAE21A_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC(=C(C=C2)F)OC""",21,"""D9B489C99235147B"""
+"""1CBDB224683C0806_09E705CAEB3F7D66_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=C(C=C(C)C=C2C)C""",21,"""D9B489C99235147B"""
+"""86601F9184403C3D_7C2C5A85ACEB1BEA_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=C(OC)C=CC=C2F""",21,"""D9B489C99235147B"""
+"""169D98CE0F5CFDE9_AC7FFA86A2352CC6_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=C(C(N)=O)C=C2""",21,"""D9B489C99235147B"""
+"""70477B24C89E858A_7600D3BA1822C973_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC(=C(OC)C=C2)F""",21,"""D9B489C99235147B"""
+"""54E49283D13190D9_2EA8D07F484F25AF_6006_DP""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C3=C2[N](CCNC2)N=C3""",21,"""D9B489C99235147B"""
+"""87FCBB66348EA07A_22F9B227B3E970B4_6006_DP""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=CC(=C2)C(O)=O""",21,"""D9B489C99235147B"""
+"""E4E513E8F0A64BB9_0B52D811419B60CF_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=CC(=C2F)OC""",21,"""D9B489C99235147B"""
+"""FE695163099847CD_BCCDAF6F896AA2A7_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=C(C=CC(=C2)OC)C""",21,"""D9B489C99235147B"""
+"""F78D25DEAF3E7A8E_AD950388E82ED3AA_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C3=C2OC=CC2=CC=C3""",21,"""D9B489C99235147B"""
+"""372D0F5A91EF7F06_1464072DE950E79C_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=C(OC)C=C(C=C2)F""",21,"""D9B489C99235147B"""
+"""53B1D25776518C8D_14391B65B7EB7155_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC(=C(OC)C=C2)C""",21,"""D9B489C99235147B"""
+"""0C1FF41EFB7D6A10_047E742D00E71ECA_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=C(C(C)O)C=C2""",21,"""D9B489C99235147B"""
+"""C44795E24159DBE3_0C5AC8923FC359EB_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=COC(=C2)C(F)(F)F""",21,"""D9B489C99235147B"""
+"""7F8168E37A1C5C2B_12AF8E1780510E18_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC(=CS2)C(F)(F)F""",21,"""D9B489C99235147B"""
+"""14758D020EF61D6F_913E8CD301B03803_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CN=C(N(C)C)N=C2""",21,"""D9B489C99235147B"""
+"""192DAD4F7481ECEE_44BF654737ABE0C0_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C3=CC2=C(C=CC=N2)S3""",21,"""D9B489C99235147B"""
+"""22950925B0CC887B_F3CAE5F83FD8E6B8_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=C(C(=CC=C2O)F)F""",21,"""D9B489C99235147B"""
+"""D197372C4B34F238_1489DF726E9EE5A2_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CSC3=C2C=CC=C3""",21,"""D9B489C99235147B"""
+"""750234F3B3696C37_6B8F63C7A9A99735_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=C[N]3N=CC=C23""",21,"""D9B489C99235147B"""
+"""720B0E6E76D1FA44_D2254A4628EF7C82_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CN=C(C=C2)C(F)F""",21,"""D9B489C99235147B"""
+"""0F4232B93324DCA0_B93E964D0A888C0E_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC3=C(C=C2)CCO3""",21,"""D9B489C99235147B"""
+"""8656315346350D3C_EFFDECB93EF2DF8D_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=C(C=C2)[N](=O)=O""",21,"""D9B489C99235147B"""
+"""52F7AC89A4AE5CF7_1433E81CF1D16A16_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC3=C(C=C2)C=N[NH]3""",21,"""D9B489C99235147B"""
+"""2DB3E2026B2D85D5_B0878B9C80083854_6006_UN""","""NCC[N]1C=C(C(=N1)C(F)(F)F)C2=CC=C(S2)C(F)(F)F""",21,"""D9B489C99235147B"""
+"""D0690DEF18B8DB7E_A74BEDD65728D02B_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](C)(=O)=O)CCCN""",21,"""D9D4D19A9A7B770A"""
+"""B59387E2B4A55307_0DBED97057D49F85_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](CC)(=O)=O)CCBr""",21,"""D9D4D19A9A7B770A"""
+"""9E4000BB3F89607E_03322F5F429F0164_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N(CCNC)[S](=O)(=O)C""",21,"""D9D4D19A9A7B770A"""
+"""2FE98680C5C87B88_FF48131B49EECC6E_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](CCCC)(=O)=O)C""",21,"""D9D4D19A9A7B770A"""
+"""228A8C3DCE466396_CB5BF1469B4EB731_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""D9D4D19A9A7B770A"""
+"""F1333568A93E852E_DBBDE0F42A7CEEFC_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](C)(=O)=O)CCC#C""",21,"""D9D4D19A9A7B770A"""
+"""726AADAE03ECA2FF_D2FFEE41C443C358_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N(C)[S](=O)(=O)CCCCl""",21,"""D9D4D19A9A7B770A"""
+"""8B3009D7C743C244_9303A445C2535A93_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](CC)(=O)=O)CC#C""",21,"""D9D4D19A9A7B770A"""
+"""EE783976EFD4DFFB_CAD04813A190A3F3_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2[S](CCCC2=O)(=O)=O""",21,"""D9D4D19A9A7B770A"""
+"""1A78803E4E9E98A3_182ED48B5E699DA5_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2C(C(N)C[S]2(=O)=O)=O""",21,"""D9D4D19A9A7B770A"""
+"""7332EDC38359778E_3DE7B30800860071_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](C)(=O)=O)C2CNC2""",21,"""D9D4D19A9A7B770A"""
+"""9CC17BC047E3AEB8_E7305CFB6260AF5E_6036_DP""","""CC(C)OC(=O)N1CCC(CC1)N[S](=O)(=O)C2(CC2)C#N""",21,"""D9D4D19A9A7B770A"""
+"""B19D8FA3FB7CF280_F03C05D7BDF13956_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N(C)[S](=O)(=O)CCCN""",21,"""D9D4D19A9A7B770A"""
+"""60BBD53061ABDAB2_5925263300B5CD69_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N(C)[S](=O)(=O)C2COC2""",21,"""D9D4D19A9A7B770A"""
+"""AA0DA52651C09704_3900F7D1DC187DF6_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N(C)[S](=O)(=O)CCOC""",21,"""D9D4D19A9A7B770A"""
+"""5968F1CA334EDB70_97DE6A330828AFE3_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N(C)[S](=O)(=O)CC(=O)C""",21,"""D9D4D19A9A7B770A"""
+"""0840ADCF24E45EDF_1FF60C87CEA69CAE_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2CCCC(C)[S]2(=O)=O""",21,"""D9D4D19A9A7B770A"""
+"""391ADD9CF66A4A35_12192A60779FA70B_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2CCC(C)(C)[S]2(=O)=O""",21,"""D9D4D19A9A7B770A"""
+"""BA22B88A22D24873_29B18BA176A85554_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](CC)(=O)=O)CCN""",21,"""D9D4D19A9A7B770A"""
+"""B2D0760CEFF6CA6F_681C171B48EE53E0_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N(CC)[S](=O)(=O)CCN""",21,"""D9D4D19A9A7B770A"""
+"""527EAD690FDDFB88_D28FBCEE49F8A6AD_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N(C)[S](=O)(=O)C(C)(C)C""",21,"""D9D4D19A9A7B770A"""
+"""8AF624AEE1CD56FE_5AB78F848B55B391_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2[S](=O)(=O)C3(CC2)CC3""",21,"""D9D4D19A9A7B770A"""
+"""14E0972BEFFA116E_359119B91ED3FBCF_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](CCNC)(=O)=O)C""",21,"""D9D4D19A9A7B770A"""
+"""14E0972BEFFA116E_E961E32FE74CF0E9_6036_DP""","""CC(C)OC(=O)N1CCC(CC1)N(C)[S](=O)(=O)CCNC""",21,"""D9D4D19A9A7B770A"""
+"""852E46C1C9B4C6BA_F8DC67C39C763732_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2[S](CCC2CI)(=O)=O""",21,"""D9D4D19A9A7B770A"""
+"""05AEC247895343BD_64DACC0BE67839FF_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2C(CN)CC[S]2(=O)=O""",21,"""D9D4D19A9A7B770A"""
+"""F368D93A3040DE3C_F78D13F19EB29487_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N(CC(C)C)[S](=O)(=O)C""",21,"""D9D4D19A9A7B770A"""
+"""84B1755AB4EC4A40_6B84865BE7B8F950_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2[S](=O)(CCNCC2)=O""",21,"""D9D4D19A9A7B770A"""
+"""E234112D07E23CB1_D9639D05CC2939FB_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](C=C)(=O)=O)C2CC2""",21,"""D9D4D19A9A7B770A"""
+"""E3FDF7BD1D001711_79641D061A2C3004_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2CC3(C[S]2(=O)=O)CC3""",21,"""D9D4D19A9A7B770A"""
+"""FA309F29D5530BEC_B52F6E3712732146_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](C)(=O)=O)C(=O)CN""",21,"""D9D4D19A9A7B770A"""
+"""FBB481E280D314B1_57AC2001C2061E88_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N2CCCCC[S]2(=O)=O""",21,"""D9D4D19A9A7B770A"""
+"""F678E1BBC25F8EBA_4507BCE7C04ED0D4_6036_UN""","""CC(C)OC(=O)N1CCC(CC1)N([S](C)(=O)=O)CCCBr""",21,"""D9D4D19A9A7B770A"""
+"""32DF8AEBAB820BF7_1504BDBA792AD406_6003_UN""","""CC(C)OC(=O)N2CCC(OC1=CC=C(C=C1)C#N)CC2""",21,"""D9D4D19A9A7B770A"""
+"""58C02F3E405B1303_2A2447B238B26927_6003_UN""","""CC(C)OC(=O)N2CCC(OC1=CC=CC=C1[N+]#[C-])CC2""",21,"""D9D4D19A9A7B770A"""
+"""E39518636830343E_2D73B2C059FF5485_6003_UN""","""CC(C)OC(=O)N2CCC(OC1=CC=CC=C1C#N)CC2""",21,"""D9D4D19A9A7B770A"""
+"""A822828B5E8127F1_C5F310A4C7017DF9_6003_UN""","""CC(C)OC(=O)N2CCC(OC1=CC=C(C=C1)[N+]#[C-])CC2""",21,"""D9D4D19A9A7B770A"""
+"""FC1DD0BCC8B45AAB_4BC89546782CAA87_6003_UN""","""CC(C)OC(=O)N2CCC(OC1=CC=CC(=C1)[N+]#[C-])CC2""",21,"""D9D4D19A9A7B770A"""
+"""ABD7063A05108EF8_BF139A789328B278_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=CC(=C(C(=C2)F)F)F""",21,"""DAA76EB3A6C262EC"""
+"""AF4A076370286633_92123DEEB4DE8744_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=CC=C(C(C)C)C=C2""",21,"""DAA76EB3A6C262EC"""
+"""7E0542E91ABA5E0E_3091FADF64C7AC81_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=CC3=C(C=C2)CCC3""",21,"""DAA76EB3A6C262EC"""
+"""1074FB040EB3F825_9043BA137BAFD623_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=CC=CC(=C2)C#CC""",21,"""DAA76EB3A6C262EC"""
+"""B090BEC02F4B3968_90473E616AC7FDBC_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=CC=CC(=C2)CSC""",21,"""DAA76EB3A6C262EC"""
+"""620B23E2819D0A61_10A98E4FC8D0D1B9_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=CN=C(C=C2)[N](=O)=O""",21,"""DAA76EB3A6C262EC"""
+"""995B7A2B526D364D_48F28C636E482393_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=CSC=C2C(F)(F)F""",21,"""DAA76EB3A6C262EC"""
+"""63F8A1E4FF5C5CD8_61F96909DEC72612_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=CC(=CC=C2)C(=O)O""",21,"""DAA76EB3A6C262EC"""
+"""4030DEE6CE38F26D_83F59C08EBF66991_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C3=C2[NH]C=CC2=CC=C3""",21,"""DAA76EB3A6C262EC"""
+"""F4A2D6945F905291_401529584AAF1886_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=C(C=C(C)C=C2F)F""",21,"""DAA76EB3A6C262EC"""
+"""F5829C85E0981847_F4AE5750FDF439DD_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=CC=CC3=NON=C23""",21,"""DAA76EB3A6C262EC"""
+"""844FE4EEA18B6177_B3D4090890FE6AA5_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=C(C(=C(C)C=C2)F)F""",21,"""DAA76EB3A6C262EC"""
+"""3EA55B462C3C9833_F21F42C99A634721_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C3=C[N]2C=NN=C2C=C3""",21,"""DAA76EB3A6C262EC"""
+"""A65B917FE84320F3_1C29A101185D948D_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=CC(=C(C=C2)F)OC""",21,"""DAA76EB3A6C262EC"""
+"""C70E7447E356AA12_0AF4E2B0DFC80BF1_6006_UN""","""C1(=C(C=CC=N1)C(=O)NCC#C)C2=C(C=C(C)C=C2C)C""",21,"""DAA76EB3A6C262EC"""
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+"""D3D2D2B0771F1A75_0EC0838AB6EF2B73_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=CC=CC(=C3F)OC""",21,"""DC26D25265415FC7"""
+"""532486BEE0FF1A19_B95FF4F47E1EE91B_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=C(C=CC(=C3)OC)C""",21,"""DC26D25265415FC7"""
+"""197247CC4C163012_A80758131F5A9816_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C4=C3OC=CC3=CC=C4""",21,"""DC26D25265415FC7"""
+"""5CD3AAB51AEC3986_11F65CB61E24AC20_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=C(OC)C=C(C=C3)F""",21,"""DC26D25265415FC7"""
+"""A02C3DD7CFDE38AD_11AB40FE409F3AE9_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=CC(=C(OC)C=C3)C""",21,"""DC26D25265415FC7"""
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+"""6FDD1C6671E17126_09C89309C8B71257_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=COC(=C3)C(F)(F)F""",21,"""DC26D25265415FC7"""
+"""27CEE834081F0565_173DD58C772545A4_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=CC(=CS3)C(F)(F)F""",21,"""DC26D25265415FC7"""
+"""09D318A7CD2BBE56_94ACD748F6C473BF_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=CN=C(N(C)C)N=C3""",21,"""DC26D25265415FC7"""
+"""4A325783EB4A06EF_412D3EDCC0DFAB7C_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C4=CC3=C(C=CC=N3)S4""",21,"""DC26D25265415FC7"""
+"""223F6CC1BF2426CE_F658BE63C8ACAD04_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=C(C(=CC=C3O)F)F""",21,"""DC26D25265415FC7"""
+"""108CE37DB336B675_111B84E999EAAE1E_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=CSC4=C3C=CC=C4""",21,"""DC26D25265415FC7"""
+"""71217A473A48D08E_6E1D385C5EDDDC89_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=CC=C[N]4N=CC=C34""",21,"""DC26D25265415FC7"""
+"""ED6574437898EFAA_D7B711DDDF9B373E_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=CN=C(C=C3)C(F)F""",21,"""DC26D25265415FC7"""
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+"""A619EA1492A4A7EA_EA6FB722C9869431_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=CC=C(C=C3)[N](=O)=O""",21,"""DC26D25265415FC7"""
+"""C2EC29DD84AA4690_11A1B38706A521AA_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=CC4=C(C=C3)C=N[NH]4""",21,"""DC26D25265415FC7"""
+"""0905FCB8B34CEB57_B515D007777C73E8_6006_UN""","""CC1=CC(=C[N]2C=C(CN)N=C12)C3=CC=C(S3)C(F)(F)F""",21,"""DC26D25265415FC7"""
+"""32F654132A647184_B9860A80702D0269_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC(=C(C(=C2)F)F)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""7EC5E114987EAB74_9487AD1657DB3755_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(C(C)C)C=C2)N""",21,"""DC32FE4B45C7D2FD"""
+"""78C6D57C354F0FCC_36046A2787C21C90_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC3=C(C=C2)CCC3)N""",21,"""DC32FE4B45C7D2FD"""
+"""E00989ACF6A7818B_96D62AEB98AA6632_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=CC(=C2)C#CC)N""",21,"""DC32FE4B45C7D2FD"""
+"""D97A89DF312C8301_96D2AE9989C24DAD_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=CC(=C2)CSC)N""",21,"""DC32FE4B45C7D2FD"""
+"""1BAEB4C152592CE1_163C1EB72BD561A8_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CN=C(C=C2)[N](=O)=O)N""",21,"""DC32FE4B45C7D2FD"""
+"""4987F92E702AC7E8_4E671C9B8D4D9382_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CSC=C2C(F)(F)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""9E9DB1DFC7494500_676CF9F13DC29603_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC(=CC=C2)C(=O)O)N""",21,"""DC32FE4B45C7D2FD"""
+"""E9CE5C3C2D05E7BA_85600CF008F3D980_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C3=C2[NH]C=CC2=CC=C3)N""",21,"""DC32FE4B45C7D2FD"""
+"""12B7D317B99DFD32_4680B9A0A9AAA897_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C=C(C)C=C2F)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""7FB2C37076436B06_F23BC7A81EF189CC_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=CC3=NON=C23)N""",21,"""DC32FE4B45C7D2FD"""
+"""4D705B7BBB8B7DB5_B54199F073FBDAB4_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C(=C(C)C=C2)F)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""16F507455964C397_F48AD2317966F730_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C3=C[N]2C=NN=C2C=C3)N""",21,"""DC32FE4B45C7D2FD"""
+"""69300FF278952FCC_1ABC31F9FB58249C_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC(=C(C=C2)F)OC)N""",21,"""DC32FE4B45C7D2FD"""
+"""2FA6C7C06E69F61F_0C6172483CCDBBE0_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C=C(C)C=C2C)C)N""",21,"""DC32FE4B45C7D2FD"""
+"""32F3DDAD9C56DFBC_79AA2D077B19DD6C_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=C(OC)C=CC=C2F)N""",21,"""DC32FE4B45C7D2FD"""
+"""9B83368E7A28C7D0_A9F98D0475C7EA40_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(C(N)=O)C=C2)N""",21,"""DC32FE4B45C7D2FD"""
+"""659BB2153ACB59FD_7386A438CFD00FF5_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC(=C(OC)C=C2)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""AAF58D00AD148931_2B2EA7FD9FBDE329_6006_DP""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C3=C2[N](CCNC2)N=C3)N""",21,"""DC32FE4B45C7D2FD"""
+"""9E9DB1DFC7494500_277FC5A5641BB632_6006_DP""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=CC(=C2)C(O)=O)N""",21,"""DC32FE4B45C7D2FD"""
+"""EEED54B428DE63C4_0ED4AF939669A649_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=CC(=C2F)OC)N""",21,"""DC32FE4B45C7D2FD"""
+"""83E5B086F1096670_B94BD8ED5E986421_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C=CC(=C2)OC)C)N""",21,"""DC32FE4B45C7D2FD"""
+"""CDA374D5DF6F4A73_A813740A3FDC152C_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C3=C2OC=CC2=CC=C3)N""",21,"""DC32FE4B45C7D2FD"""
+"""DDA6B1B754FB5FB9_11E270AF3EA2211A_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=C(OC)C=C(C=C2)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""855929390D20E289_11BF6CE76019B7D3_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC(=C(OC)C=C2)C)N""",21,"""DC32FE4B45C7D2FD"""
+"""6E9AF42947F58DB8_01F803AFD715D84C_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(C(C)O)C=C2)N""",21,"""DC32FE4B45C7D2FD"""
+"""6858106329CD3254_09DCBF10E8319F6D_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=COC(=C2)C(F)(F)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""8523C1E4921A5258_1729F99557A3C89E_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC(=CS2)C(F)(F)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""2CC4B9493C00EE71_94B8FB51D642FE85_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CN=C(N(C)C)N=C2)N""",21,"""DC32FE4B45C7D2FD"""
+"""F550933BA91B1DD7_413912C5E0592646_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C3=CC2=C(C=CC=N2)S3)N""",21,"""DC32FE4B45C7D2FD"""
+"""8ACB446CEF9E5111_F64C927AE82A203E_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C(=CC=C2O)F)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""D339E06AF3491B0B_110FA8F0B96C2324_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CSC3=C2C=CC=C3)N""",21,"""DC32FE4B45C7D2FD"""
+"""6DC7894ADB514734_6E0914457E5B51B3_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C[N]3N=CC=C23)N""",21,"""DC32FE4B45C7D2FD"""
+"""EDB69DC6A74E7DAA_D7A33DC4FF1DBA04_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CN=C(C=C2)C(F)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""98A8B2B732B8E50E_BCB8E1CFDD7A4A88_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC3=C(C=C2)CCO3)N""",21,"""DC32FE4B45C7D2FD"""
+"""6AC0142FDCA13696_EA7B9B3BE900190B_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(C=C2)[N](=O)=O)N""",21,"""DC32FE4B45C7D2FD"""
+"""3A12BB68AAFDEBC3_11B59F9E2623AC90_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3)N""",21,"""DC32FE4B45C7D2FD"""
+"""84005A0A4E663DF5_B501FC1E57FAFED2_6006_UN""","""CC[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(S2)C(F)(F)F)N""",21,"""DC32FE4B45C7D2FD"""
+"""CCFA7C65CC800E2F_B9E7BBBA55F2D0BB_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC(=C(C(=C3)F)F)F""",21,"""DC534F716018002F"""
+"""0F7753FFE6A15FBF_94E61C2C7204E587_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC=C(C(C)C)C=C3""",21,"""DC534F716018002F"""
+"""21FD360BC683B79C_3665DB1DA21DCE42_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)CCC4""",21,"""DC534F716018002F"""
+"""6B54A05DCD8FD345_96B79BD1BD75B4E0_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC=CC(=C3)C#CC""",21,"""DC534F716018002F"""
+"""689D3F82369705AD_96B31FA3AC1D9F7F_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC=CC(=C3)CSC""",21,"""DC534F716018002F"""
+"""81F53E420D62437B_165DAF8D0E0AB37A_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CN=C(C=C3)[N](=O)=O""",21,"""DC534F716018002F"""
+"""3E553300B12784EE_4E06ADA1A8924150_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CSC=C3C(F)(F)F""",21,"""DC534F716018002F"""
+"""FEF1B4751D5F1C1F_670D48CB181D44D1_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC(=CC=C3)C(=O)O""",21,"""DC534F716018002F"""
+"""9FBD54F19F37606C_8501BDCA2D2C0B52_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C4=C3[NH]C=CC3=CC=C4""",21,"""DC534F716018002F"""
+"""DB86D19C7446131E_46E1089A8C757A45_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=C(C=C(C)C=C3F)F""",21,"""DC534F716018002F"""
+"""DDD1931E10F5C8ED_F25A76923B2E5B1E_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC=CC4=NON=C34""",21,"""DC534F716018002F"""
+"""228CE809833A0C6E_B52028CA56240866_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=C(C(=C(C)C=C3)F)F""",21,"""DC534F716018002F"""
+"""F97B87C4A55407BE_F4EB630B5CB925E2_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C4=C[N]3C=NN=C3C=C4""",21,"""DC534F716018002F"""
+"""282BA53E1C819BEC_1ADD80C3DE87F64E_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)F)OC""",21,"""DC534F716018002F"""
+"""D058798977F518E8_0C00C37219126932_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=C(C=C(C)C=C3C)C""",21,"""DC534F716018002F"""
+"""316D7183E7ADB98E_79CB9C3D5EC60FBE_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=C(OC)C=CC=C3F""",21,"""DC534F716018002F"""
+"""EFA7E1876ACC7883_A9983C3E50183892_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC=C(C(N)=O)C=C3""",21,"""DC534F716018002F"""
+"""A04C269187ED8F41_73E71502EA0FDD27_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC(=C(OC)C=C3)F""",21,"""DC534F716018002F"""
+"""8E9D36CDD1C6A7CC_2B4F16C7BA6231FB_6006_DP""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C4=C3[N](CCNC3)N=C4""",21,"""DC534F716018002F"""
+"""FEF1B4751D5F1C1F_271E749F41C464E0_6006_DP""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC=CC(=C3)C(O)=O""",21,"""DC534F716018002F"""
+"""56036FDD26CB9B4E_0EB51EA9B3B6749B_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC=CC(=C3F)OC""",21,"""DC534F716018002F"""
+"""ADC16E598D59854D_B92A69D77B47B6F3_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=C(C=CC(=C3)OC)C""",21,"""DC534F716018002F"""
+"""BAFC4EAF8D7FA3C1_A872C5301A03C7FE_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C4=C3OC=CC3=CC=C4""",21,"""DC534F716018002F"""
+"""0C433D77386EEE28_1183C1951B7DF3C8_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=C(OC)C=C(C=C3)F""",21,"""DC534F716018002F"""
+"""8492C5369E6CB479_11DEDDDD45C66501_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC(=C(OC)C=C3)C""",21,"""DC534F716018002F"""
+"""63ACF80459DD0384_0199B295F2CA0A9E_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=CC=C(C(C)O)C=C3""",21,"""DC534F716018002F"""
+"""DE2D87010660DD6D_09BD0E2ACDEE4DBF_6006_UN""","""O=[N](=O)C1=CC2=C(C=C1)N=C(S2)C3=COC(=C3)C(F)(F)F""",21,"""DC534F716018002F"""
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+"""D4851C854EFCD150_12E37DDD5685781C_6003_UN""","""CCC(C)(C)C1=CC=C(C=C1)COC2=CC=C(C=C2)C#N""",21,"""DE3311FDB5D4DB10"""
+"""DA435EE6A3B6CFF7_2DC387D5171DC53D_6003_UN""","""CCC(C)(C)C1=CC=C(C=C1)COC2=CC=CC=C2[N+]#[C-]""",21,"""DE3311FDB5D4DB10"""
+"""F845454F2229512A_2A9472A77650F89F_6003_UN""","""CCC(C)(C)C1=CC=C(C=C1)COC2=CC=CC=C2C#N""",21,"""DE3311FDB5D4DB10"""
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+"""2C7317B625177175_4C2F55215783069D_6003_UN""","""CCC(C)(C)C1=CC=C(C=C1)COC2=CC=CC(=C2)[N+]#[C-]""",21,"""DE3311FDB5D4DB10"""
+"""7233B58F46F1EBE8_BBFE3E7AA89C1D8A_6006_UN""","""CCC1=C(C(=C(N=N1)C2=CC(=C(C(=C2)F)F)F)C#N)CC""",21,"""DE4ACAB19D76CD1E"""
+"""F4D7CF849056510B_96FF99EC8F6A28B6_6006_UN""","""CCC1=C(C(=C(N=N1)C2=CC=C(C(C)C)C=C2)C#N)CC""",21,"""DE4ACAB19D76CD1E"""
+"""C218F64DA7147D2F_347C5EDD5F730373_6006_UN""","""CCC1=C(C(=C(N=N1)C2=CC3=C(C=C2)CCC3)C#N)CC""",21,"""DE4ACAB19D76CD1E"""
+"""7F4FB5D011E18D83_94AE1E11401B79D1_6006_UN""","""CCC1=C(C(=C(N=N1)C2=CC=CC(=C2)C#CC)C#N)CC""",21,"""DE4ACAB19D76CD1E"""
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+"""FA34D4690AF6354E_420093121ACABEC6_6036_UN""","""COC1=C(C=C(C(=C1)C)C(C)N([S](C)(=O)=O)CCCBr)C""",21,"""DED3FE6F40FF1918"""
+"""3CC5BE1FD853EA5F_1203924FA3AEBA14_6003_UN""","""COC1=C(C=C(C(=C1)C)C(C)OC2=CC=C(C=C2)C#N)C""",21,"""DED3FE6F40FF1918"""
+"""E477BCB7C361CD9B_2D236847E2360735_6003_UN""","""COC1=C(C=C(C(=C1)C)C(C)OC2=CC=CC=C2[N+]#[C-])C""",21,"""DED3FE6F40FF1918"""
+"""7C96A207CDB6FF24_2A749D35837B3A97_6003_UN""","""COC1=C(C=C(C(=C1)C)C(C)OC2=CC=CC=C2C#N)C""",21,"""DED3FE6F40FF1918"""
+"""56AE532F5C851C37_C2F43F511D8513EB_6003_UN""","""COC1=C(C=C(C(=C1)C)C(C)OC2=CC=C(C=C2)[N+]#[C-])C""",21,"""DED3FE6F40FF1918"""
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+"""C69E8DE804EC3B42_2B18B4985AA33236_6006_UN""","""NCC2=C(N=C1C=CC=CC1=C2)C3=CC(=CS3)C(F)(F)F""",21,"""E003B34648C72855"""
+"""441C870FD83B90DC_A889B65CDB42042D_6006_UN""","""NCC2=C(N=C1C=CC=CC1=C2)C3=CN=C(N(C)C)N=C3""",21,"""E003B34648C72855"""
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+"""D63D62760D40215C_52385948735BAB1B_6006_UN""","""NCC2=C(N=C1C=CC=CC1=C2)C3=CC=C[N]4N=CC=C34""",21,"""E003B34648C72855"""
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+"""34BE1C7FB0B820BE_8089ACC2D07AB020_6006_UN""","""NCC2=C(N=C1C=CC=CC1=C2)C3=CC4=C(C=C3)CCO4""",21,"""E003B34648C72855"""
+"""9DB4F1FA7F22E5D2_D64AD636E400E3A3_6006_UN""","""NCC2=C(N=C1C=CC=CC1=C2)C3=CC=C(C=C3)[N](=O)=O""",21,"""E003B34648C72855"""
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+"""5F578DEBCCCB526A_9E95A49548E9D326_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)CCCN""",21,"""E00A98D985BA7407"""
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+"""B1E9CCE9A75FF5A4_3AEC661C5D5E0269_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N(CCNC)[S](=O)(=O)C""",21,"""E00A98D985BA7407"""
+"""099589B48839BEEB_C6965A58562FCF63_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N([S](CCCC)(=O)=O)C""",21,"""E00A98D985BA7407"""
+"""6FE789C77002F554_F285B805848FB43C_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""E00A98D985BA7407"""
+"""259EC407FA4E46C4_E263A9B735BDEDF1_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)CCC#C""",21,"""E00A98D985BA7407"""
+"""690404428895DE8E_EB21A702DB82C055_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)CCCCl""",21,"""E00A98D985BA7407"""
+"""3AAD766597DF1D83_AADDED06DD92599E_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N([S](CC)(=O)=O)CC#C""",21,"""E00A98D985BA7407"""
+"""A8F8EEB296EF0118_F30E0150BE51A0FE_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2[S](CCCC2=O)(=O)=O""",21,"""E00A98D985BA7407"""
+"""CF180315711713E3_21F09DC841A89EA8_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2C(C(N)C[S]2(=O)=O)=O""",21,"""E00A98D985BA7407"""
+"""15D2455776140F4E_0439FA4B1F47037C_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)C2CNC2""",21,"""E00A98D985BA7407"""
+"""F04A5325355EE3DA_DEEE15B87DA1AC53_6036_DP""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N[S](=O)(=O)C2(CC2)C#N""",21,"""E00A98D985BA7407"""
+"""AE6B4815C314E2D6_C9E24C94A2303A5B_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)CCCN""",21,"""E00A98D985BA7407"""
+"""D44580DF7308EE7A_60FB6F701F74CE64_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)C2COC2""",21,"""E00A98D985BA7407"""
+"""BEAFE718BC05168A_00DEBE92C3D97EFB_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)CCOC""",21,"""E00A98D985BA7407"""
+"""B2118BF998E43491_AE00237017E9ACEE_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)CC(=O)C""",21,"""E00A98D985BA7407"""
+"""21F6BD8C6085665D_262845C4D1679FA3_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2CCCC(C)[S]2(=O)=O""",21,"""E00A98D985BA7407"""
+"""966B04A7861183F4_2BC76323685EA406_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2CCC(C)(C)[S]2(=O)=O""",21,"""E00A98D985BA7407"""
+"""0AF920EF2EC8A959_106FC2E269695659_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N([S](CC)(=O)=O)CCN""",21,"""E00A98D985BA7407"""
+"""85922A1BB96E381A_51C25E58572F50ED_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N(CC)[S](=O)(=O)CCN""",21,"""E00A98D985BA7407"""
+"""6A0ED14ED7FBEE45_EB51F5AD5639A5A0_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)C(C)(C)C""",21,"""E00A98D985BA7407"""
+"""A40561B4E5B3AACA_6369C6C79494B09C_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2[S](=O)(=O)C3(CC2)CC3""",21,"""E00A98D985BA7407"""
+"""51CD34F4BEA06B0A_0C4F50FA0112F8C2_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N([S](CCNC)(=O)=O)C""",21,"""E00A98D985BA7407"""
+"""51CD34F4BEA06B0A_D0BFAA6CF88DF3E4_6036_DP""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)CCNC""",21,"""E00A98D985BA7407"""
+"""AB6A8CBB9F516209_C1022E8083B7343F_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2[S](CCC2CI)(=O)=O""",21,"""E00A98D985BA7407"""
+"""0FBBF417F1F7123A_5D048548F9B93AF2_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2C(CN)CC[S]2(=O)=O""",21,"""E00A98D985BA7407"""
+"""5926EC6F61DBAA54_CE535AB28173978A_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N(CC(C)C)[S](=O)(=O)C""",21,"""E00A98D985BA7407"""
+"""B168EAFABC4FED3F_525ACF18F879FA5D_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2[S](=O)(CCNCC2)=O""",21,"""E00A98D985BA7407"""
+"""D3423FAB5E83623A_E0BDD446D3E83AF6_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N([S](C=C)(=O)=O)C2CC2""",21,"""E00A98D985BA7407"""
+"""2EF3B96FE40C2BD8_40BA544505ED3309_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2CC3(C[S]2(=O)=O)CC3""",21,"""E00A98D985BA7407"""
+"""8BD46A250AB3C8A8_8CF127740DB2224B_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)C(=O)CN""",21,"""E00A98D985BA7407"""
+"""8CA4C6979DC0DFDD_6E726942DDC71D85_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N2CCCCC[S]2(=O)=O""",21,"""E00A98D985BA7407"""
+"""1CA6A3CEC44BE668_7CD9F5A4DF8FD3D9_6036_UN""","""C(C(=O)NC1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)CCCBr""",21,"""E00A98D985BA7407"""
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+"""50E41EE4AC707BA1_A85613A5DD70C9B5_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC=C(C(C)C)C=C3""",21,"""E0E340F8CF6C2C1D"""
+"""5FD12C6379200C81_0AD5D4940D69E270_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC4=C(C=C3)CCC4""",21,"""E0E340F8CF6C2C1D"""
+"""F7D40C8F277E8099_AA079458120198D2_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC=CC(=C3)C#CC""",21,"""E0E340F8CF6C2C1D"""
+"""F363E94CB2DC3C1C_AA03102A0369B34D_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC=CC(=C3)CSC""",21,"""E0E340F8CF6C2C1D"""
+"""F9A9AAB1CA4CD92D_2AEDA004A17E9F48_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CN=C(C=C3)[N](=O)=O""",21,"""E0E340F8CF6C2C1D"""
+"""00668E4835EB0217_72B6A22807E66D62_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CSC=C3C(F)(F)F""",21,"""E0E340F8CF6C2C1D"""
+"""27AC725AD8CC0E5A_5BBD4742B76968E3_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC(=CC=C3)C(=O)O""",21,"""E0E340F8CF6C2C1D"""
+"""98CDC46524BF55FD_B9B1B24382582760_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C4=C3[NH]C=CC3=CC=C4""",21,"""E0E340F8CF6C2C1D"""
+"""895665F64784CFB2_7A51071323015677_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=C(C=C(C)C=C3F)F""",21,"""E0E340F8CF6C2C1D"""
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+"""D075EA2D0A4F25D3_89902743F9502454_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=C(C(=C(C)C=C3)F)F""",21,"""E0E340F8CF6C2C1D"""
+"""6A16E74FFFB1FD62_C85B6C82F3CD09D0_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C4=C[N]3C=NN=C3C=C4""",21,"""E0E340F8CF6C2C1D"""
+"""83344410885F21E4_266D8F4A71F3DA7C_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC(=C(C=C3)F)OC""",21,"""E0E340F8CF6C2C1D"""
+"""7CA849CE8DF682D4_30B0CCFBB6664500_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=C(C=C(C)C=C3C)C""",21,"""E0E340F8CF6C2C1D"""
+"""6B85C2E64BA223DD_457B93B4F1B2238C_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=C(OC)C=CC=C3F""",21,"""E0E340F8CF6C2C1D"""
+"""8F39FC7EBADA58C5_952833B7FF6C14A0_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC=C(C(N)=O)C=C3""",21,"""E0E340F8CF6C2C1D"""
+"""EECA0B4457DC5BED_4F571A8B457BF115_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC(=C(OC)C=C3)F""",21,"""E0E340F8CF6C2C1D"""
+"""E57BAE5097C815E1_17FF194E15161DC9_6006_DP""","""CC1(NCCC1)CC2=CC=C(S2)C4=C3[N](CCNC3)N=C4""",21,"""E0E340F8CF6C2C1D"""
+"""27AC725AD8CC0E5A_1BAE7B16EEB048D2_6006_DP""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC=CC(=C3)C(O)=O""",21,"""E0E340F8CF6C2C1D"""
+"""809386B7AFE4E332_320511201CC258A9_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC=CC(=C3F)OC""",21,"""E0E340F8CF6C2C1D"""
+"""DD46E1B19A1DB29C_859A665ED4339AC1_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=C(C=CC(=C3)OC)C""",21,"""E0E340F8CF6C2C1D"""
+"""04DA3DBA8947DABB_94C2CAB9B577EBCC_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C4=C3OC=CC3=CC=C4""",21,"""E0E340F8CF6C2C1D"""
+"""BEEF8AE54153D3C9_2D33CE1CB409DFFA_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=C(OC)C=C(C=C3)F""",21,"""E0E340F8CF6C2C1D"""
+"""EF9439BB854FEF00_2D6ED254EAB24933_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC(=C(OC)C=C3)C""",21,"""E0E340F8CF6C2C1D"""
+"""2578D9A3D15B37EA_3D29BD1C5DBE26AC_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC=C(C(C)O)C=C3""",21,"""E0E340F8CF6C2C1D"""
+"""C3B627DF56D3E293_350D01A3629A618D_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=COC(=C3)C(F)(F)F""",21,"""E0E340F8CF6C2C1D"""
+"""082D0A5F8B9BD743_2BF84726DD08367E_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC(=CS3)C(F)(F)F""",21,"""E0E340F8CF6C2C1D"""
+"""C68149A6238AA861_A86945E25CE90065_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CN=C(N(C)C)N=C3""",21,"""E0E340F8CF6C2C1D"""
+"""83C0A38DA3F217A6_7DE8AC766AF2D8A6_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C4=CC3=C(C=CC=N3)S4""",21,"""E0E340F8CF6C2C1D"""
+"""44BF04D85D6B2A1E_CA9D2CC96281DEDE_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=C(C(=CC=C3O)F)F""",21,"""E0E340F8CF6C2C1D"""
+"""9D96C1B5F24EDE54_2DDE164333C7DDC4_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CSC4=C3C=CC=C4""",21,"""E0E340F8CF6C2C1D"""
+"""DF08D263713AADEF_52D8AAF6F4F0AF53_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC=C[N]4N=CC=C34""",21,"""E0E340F8CF6C2C1D"""
+"""C9FEAD58BEBF5B52_EB72837775B644E4_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CN=C(C=C3)C(F)F""",21,"""E0E340F8CF6C2C1D"""
+"""5BF833B704C71FE1_80695F7C57D1B468_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC4=C(C=C3)CCO4""",21,"""E0E340F8CF6C2C1D"""
+"""A5D87F19C167E3E8_D6AA258863ABE7EB_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC=C(C=C3)[N](=O)=O""",21,"""E0E340F8CF6C2C1D"""
+"""30C346505D6E9DB2_2D64212DAC885270_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""E0E340F8CF6C2C1D"""
+"""AA8CB32F0E4437DE_89D042ADDD510032_6006_UN""","""CC1(NCCC1)CC2=CC=C(S2)C3=CC=C(S3)C(F)(F)F""",21,"""E0E340F8CF6C2C1D"""
+"""B563F5C1D3886A68_9F07A33E686E1316_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](C)(=O)=O)CCCN""",21,"""E1989F72A53DB437"""
+"""9B440DA5B8BFBC51_35F2979868925CB8_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](CC)(=O)=O)CCBr""",21,"""E1989F72A53DB437"""
+"""99D4C319F92F4FE7_3B7E61B77DD9C259_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N(CCNC)[S](=O)(=O)C""",21,"""E1989F72A53DB437"""
+"""43A6441BBD44638A_C7045DF376A80F53_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](CCCC)(=O)=O)C""",21,"""E1989F72A53DB437"""
+"""4230197E73EC6EC2_F317BFAEA408740C_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""E1989F72A53DB437"""
+"""26B2F80E8568ECC5_E3F1AE1C153A2DC1_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](C)(=O)=O)CCC#C""",21,"""E1989F72A53DB437"""
+"""0F99C5A2DEF34448_EAB3A0A9FB050065_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N(C)[S](=O)(=O)CCCCl""",21,"""E1989F72A53DB437"""
+"""AED605DC8FBE08BF_AB4FEAADFD1599AE_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](CC)(=O)=O)CC#C""",21,"""E1989F72A53DB437"""
+"""12866A36FAA1293C_F29C06FB9ED660CE_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3[S](CCCC3=O)(=O)=O""",21,"""E1989F72A53DB437"""
+"""D5CFDF3662F76856_20629A63612F5E98_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3C(C(N)C[S]3(=O)=O)=O""",21,"""E1989F72A53DB437"""
+"""0CC7925A3768BFBD_05ABFDE03FC0C34C_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](C)(=O)=O)C3CNC3""",21,"""E1989F72A53DB437"""
+"""2288EBFA0BA71B27_DF7C12135D266C63_6036_DP""","""COC1=CC2=C(C=C1)OCC[C@H]2N[S](=O)(=O)C3(CC3)C#N""",21,"""E1989F72A53DB437"""
+"""9B6D0F497DC52119_C8704B3F82B7FA6B_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N(C)[S](=O)(=O)CCCN""",21,"""E1989F72A53DB437"""
+"""201AC2528F91BFAE_616968DB3FF30E54_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N(C)[S](=O)(=O)C3COC3""",21,"""E1989F72A53DB437"""
+"""9B1CD678DA2FEBD3_014CB939E35EBECB_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N(C)[S](=O)(=O)CCOC""",21,"""E1989F72A53DB437"""
+"""A99E746AF38543BB_AF9224DB376E6CDE_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N(C)[S](=O)(=O)CC(=O)C""",21,"""E1989F72A53DB437"""
+"""1A9F3699FDC53BC0_27BA426FF1E05F93_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3CCCC(C)[S]3(=O)=O""",21,"""E1989F72A53DB437"""
+"""1CA10E86266DA9E0_2A55648848D96436_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3CCC(C)(C)[S]3(=O)=O""",21,"""E1989F72A53DB437"""
+"""7D467950C2C8857A_11FDC54949EE9669_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](CC)(=O)=O)CCN""",21,"""E1989F72A53DB437"""
+"""C91E87DBD06B3DA7_505059F377A890DD_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N(CC)[S](=O)(=O)CCN""",21,"""E1989F72A53DB437"""
+"""DEC01491F3392C4E_EAC3F20676BE6590_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N(C)[S](=O)(=O)C(C)(C)C""",21,"""E1989F72A53DB437"""
+"""E52207A3D525C32F_62FBC16CB41370AC_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3[S](=O)(=O)C4(CC3)CC4""",21,"""E1989F72A53DB437"""
+"""1EFF567DC0E8261D_0DDD5751219538F2_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](CCNC)(=O)=O)C""",21,"""E1989F72A53DB437"""
+"""1EFF567DC0E8261D_D12DADC7D80A33D4_6036_DP""","""COC1=CC2=C(C=C1)OCC[C@H]2N(C)[S](=O)(=O)CCNC""",21,"""E1989F72A53DB437"""
+"""E6F16E630EF53428_C090292BA330F40F_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3[S](CCC3CI)(=O)=O""",21,"""E1989F72A53DB437"""
+"""E53BA8CE1DCC3FB4_5C9682E3D93EFAC2_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3C(CN)CC[S]3(=O)=O""",21,"""E1989F72A53DB437"""
+"""2A6A9BA990E99B98_CFC15D19A1F457BA_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N(CC(C)C)[S](=O)(=O)C""",21,"""E1989F72A53DB437"""
+"""9D8ED77FDFF3705D_53C8C8B3D8FE3A6D_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3[S](=O)(CCNCC3)=O""",21,"""E1989F72A53DB437"""
+"""33719B59AB9CF54E_E12FD3EDF36FFAC6_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](C=C)(=O)=O)C3CC3""",21,"""E1989F72A53DB437"""
+"""F8043E28B740A89C_412853EE256AF339_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3CC4(C[S]3(=O)=O)CC4""",21,"""E1989F72A53DB437"""
+"""95CAA82C2F521943_8D6320DF2D35E27B_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](C)(=O)=O)C(=O)CN""",21,"""E1989F72A53DB437"""
+"""9C6CCB70055D760F_6FE06EE9FD40DDB5_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N3CCCCC[S]3(=O)=O""",21,"""E1989F72A53DB437"""
+"""ABE71DDF638C6DD2_7D4BF20FFF0813E9_6036_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2N([S](C)(=O)=O)CCCBr""",21,"""E1989F72A53DB437"""
+"""EC3F61C5F2C6421C_2D48F352466C173B_6003_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2OC3=CC=C(C=C3)C#N""",21,"""E1989F72A53DB437"""
+"""55069AB65958CBCA_1268095A07F4AA1A_6003_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2OC3=CC=CC=C3[N+]#[C-]""",21,"""E1989F72A53DB437"""
+"""8B91B8A7843E9AC6_153FFC2866B997B8_6003_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2OC3=CC=CC=C3C#N""",21,"""E1989F72A53DB437"""
+"""52E4BB2F97930AA5_FDBF5E4CF847BEC4_6003_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2OC3=CC=C(C=C3)[N+]#[C-]""",21,"""E1989F72A53DB437"""
+"""F5CA2D2EBC5DE72E_7384DBAE476A69BA_6003_UN""","""COC1=CC2=C(C=C1)OCC[C@H]2OC3=CC=CC(=C3)[N+]#[C-]""",21,"""E1989F72A53DB437"""
+"""B250A94944A66A96_840C91DA1F05F574_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=CC(=C(C(=C3)F)F)F""",21,"""E1B865112AEF25E0"""
+"""9C6ABF9A21D1007D_A90D364C38F3C048_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=CC=C(C(C)C)C=C3""",21,"""E1B865112AEF25E0"""
+"""EEDAABF7FBA6EBB3_0B8EF17DE8EAEB8D_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=CC4=C(C=C3)CCC4""",21,"""E1B865112AEF25E0"""
+"""C36923B107BD277D_AB5CB1B1F782912F_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=CC=CC(=C3)C#CC""",21,"""E1B865112AEF25E0"""
+"""168D37BE202C3F3F_AB5835C3E6EABAB0_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=CC=CC(=C3)CSC""",21,"""E1B865112AEF25E0"""
+"""C89CDF14A01A1F25_2BB685ED44FD96B5_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=CN=C(C=C3)[N](=O)=O""",21,"""E1B865112AEF25E0"""
+"""D8FED0CCC3873A2D_73ED87C1E265649F_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=CSC=C3C(F)(F)F""",21,"""E1B865112AEF25E0"""
+"""2C4B26F489E36F84_5AE662AB52EA611E_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=CC(=CC=C3)C(=O)O""",21,"""E1B865112AEF25E0"""
+"""097E4AB5B17293D5_B8EA97AA67DB2E9D_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C4=C3[NH]C=CC3=CC=C4""",21,"""E1B865112AEF25E0"""
+"""D0ECABB23D9ACE4F_7B0A22FAC6825F8A_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=C(C=C(C)C=C3F)F""",21,"""E1B865112AEF25E0"""
+"""A2985C19E41D39E4_CFB15CF271D97ED1_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=CC=CC4=NON=C34""",21,"""E1B865112AEF25E0"""
+"""DCBC583B532879B8_88CB02AA1CD32DA9_6006_UN""","""CC(=O)C1=C(N=C2C=CC=C[N]12)C3=C(C(=C(C)C=C3)F)F""",21,"""E1B865112AEF25E0"""
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+"""E8B155E934A8E4EE_E96024CB5059FD85_6036_UN""","""C1(CCC(CC1)C2CCCCC2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""E23B49BF83DA2C22"""
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+"""D6C808BCF080F380_0E7E819C0772A0E7_6036_UN""","""C1(CCC(CC1)C2CCCCC2)N([S](CCNC)(=O)=O)C""",21,"""E23B49BF83DA2C22"""
+"""D6C808BCF080F380_D28E7B0AFEEDABC1_6036_DP""","""C1(CCC(CC1)C2CCCCC2)N(C)[S](=O)(=O)CCNC""",21,"""E23B49BF83DA2C22"""
+"""F5447F761F626DCF_C333FFE685D76C1A_6036_UN""","""C1(CCC(CC1)C2CCCCC2)N3[S](CCC3CI)(=O)=O""",21,"""E23B49BF83DA2C22"""
+"""5EBE5DC8F55CCFA7_5F35542EFFD962D7_6036_UN""","""C1(CCC(CC1)C2CCCCC2)N3C(CN)CC[S]3(=O)=O""",21,"""E23B49BF83DA2C22"""
+"""CBB343E108F6BF5B_CC628BD48713CFAF_6036_UN""","""C1(CCC(CC1)C2CCCCC2)N(CC(C)C)[S](=O)(=O)C""",21,"""E23B49BF83DA2C22"""
+"""3CA8EA0D37EB6540_506B1E7EFE19A278_6036_UN""","""C1(CCC(CC1)C2CCCCC2)N3[S](=O)(CCNCC3)=O""",21,"""E23B49BF83DA2C22"""
+"""088795E2F249822B_E28C0520D58862D3_6036_UN""","""C1(CCC(CC1)C2CCCCC2)N([S](C=C)(=O)=O)C3CC3""",21,"""E23B49BF83DA2C22"""
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+"""026198655021CE76_ABC6562D63687FFD_6006_UN""","""NC1=NC(=NS1)C2=C(N=CC=C2)C3=CN=C(N(C)C)N=C3""",21,"""E34C5337F0ED5385"""
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+"""88BACE89FCDC4396_ABE11D402E78F576_6006_UN""","""CCOC(=O)CC1=CN=C(N=C1)C2=CC=C(C(C)C)C=C2""",21,"""E3544E1D3C6410DE"""
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+"""172CBD8B8A00B9CA_295AAEE15276A38B_6006_UN""","""CCOC(=O)CC1=CN=C(N=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""E3544E1D3C6410DE"""
+"""14DDC447A639BF35_7101ACCDF4EE51A1_6006_UN""","""CCOC(=O)CC1=CN=C(N=C1)C2=CSC=C2C(F)(F)F""",21,"""E3544E1D3C6410DE"""
+"""882DDC2F9ACB9774_580A49A744615420_6006_UN""","""CCOC(=O)CC1=CN=C(N=C1)C2=CC(=CC=C2)C(=O)O""",21,"""E3544E1D3C6410DE"""
+"""3482D7627B9957FB_BA06BCA671501BA3_6006_UN""","""CCOC(=O)CC1=CN=C(N=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""E3544E1D3C6410DE"""
+"""120D1E4376CAA5B2_79E609F6D0096AB4_6006_UN""","""CCOC(=O)CC1=CN=C(N=C1)C2=C(C=C(C)C=C2F)F""",21,"""E3544E1D3C6410DE"""
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+"""CD05A533707760DB_25DA9D2E65A05626_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC(=C(C=C3)F)OC""",21,"""E354529CDB3FA047"""
+"""C9CDBB5C25FB7CA8_3307DE9FA235C95A_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=C(C=C(C)C=C3C)C""",21,"""E354529CDB3FA047"""
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+"""EE066BEF9A5DDBE7_969F21D3EB3F98FA_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC=C(C(N)=O)C=C3""",21,"""E354529CDB3FA047"""
+"""F37F1BEECA4388B7_4CE008EF51287D4F_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC(=C(OC)C=C3)F""",21,"""E354529CDB3FA047"""
+"""C771AC587E188D1B_14480B2A01459193_6006_DP""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C4=C3[N](CCNC3)N=C4""",21,"""E354529CDB3FA047"""
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+"""A6D095228D60A93D_31B203440891D4F3_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC=CC(=C3F)OC""",21,"""E354529CDB3FA047"""
+"""8E2AC3577869079E_862D743AC060169B_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=C(C=CC(=C3)OC)C""",21,"""E354529CDB3FA047"""
+"""40E04F49EFB56614_9775D8DDA1246796_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C4=C3OC=CC3=CC=C4""",21,"""E354529CDB3FA047"""
+"""244F080D64BB1FE1_2E84DC78A05A53A0_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=C(OC)C=C(C=C3)F""",21,"""E354529CDB3FA047"""
+"""5A97EB52422849EF_2ED9C030FEE1C569_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC(=C(OC)C=C3)C""",21,"""E354529CDB3FA047"""
+"""F8F65ECB2FB6115F_3E9EAF7849EDAAF6_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC=C(C(C)O)C=C3""",21,"""E354529CDB3FA047"""
+"""B6F0CA943E364D14_36BA13C776C9EDD7_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=COC(=C3)C(F)(F)F""",21,"""E354529CDB3FA047"""
+"""D66356E29708975E_284F5542C95BBA24_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC(=CS3)C(F)(F)F""",21,"""E354529CDB3FA047"""
+"""C10DF11BF269BCDA_ABDE578648BA8C3F_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CN=C(N(C)C)N=C3""",21,"""E354529CDB3FA047"""
+"""727CFC15AA54E9E0_7E5FBE127EA154FC_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C4=CC3=C(C=CC=N3)S4""",21,"""E354529CDB3FA047"""
+"""E2D96807AE21B1E9_C92A3EAD76D25284_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=C(C(=CC=C3O)F)F""",21,"""E354529CDB3FA047"""
+"""76D9742FCE0F6845_2E6904272794519E_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CSC4=C3C=CC=C4""",21,"""E354529CDB3FA047"""
+"""495DCE51443A695B_516FB892E0A32309_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC=C[N]4N=CC=C34""",21,"""E354529CDB3FA047"""
+"""8D85BF36341A9916_E8C5911361E5C8BE_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CN=C(C=C3)C(F)F""",21,"""E354529CDB3FA047"""
+"""631A6878E81BD4A5_83DE4D1843823832_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC4=C(C=C3)CCO4""",21,"""E354529CDB3FA047"""
+"""764643358DA8A75E_D51D37EC77F86BB1_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC=C(C=C3)[N](=O)=O""",21,"""E354529CDB3FA047"""
+"""CE070E3E8C80E8F6_2ED33349B8DBDE2A_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC4=C(C=C3)C=N[NH]4""",21,"""E354529CDB3FA047"""
+"""8BB7DE8BB17F0F88_8A6750C9C9028C68_6006_UN""","""NC1=C(C2=C(N=C1)C(=CC=C2)F)C3=CC=C(S3)C(F)(F)F""",21,"""E354529CDB3FA047"""
+"""BDF2C3D7B7791065_86E15F386C439476_6006_UN""","""C[N]1C(=NC=C1C2=CC(=C(C(=C2)F)F)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""3138C36CE699084E_ABE0F8AE4BB5A14A_6006_UN""","""C[N]1C(=NC=C1C2=CC=C(C(C)C)C=C2)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""CB3A02BEF4F2F69D_09633F9F9BAC8A8F_6006_UN""","""C[N]1C(=NC=C1C2=CC3=C(C=C2)CCC3)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""8BBDA4405ABFFFBD_A9B17F5384C4F02D_6006_UN""","""C[N]1C(=NC=C1C2=CC=CC(=C2)C#CC)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""6B263FD883D63B6D_A9B5FB2195ACDBB2_6006_UN""","""C[N]1C(=NC=C1C2=CC=CC(=C2)CSC)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""9E979508A7A79ABA_295B4B0F37BBF7B7_6006_UN""","""C[N]1C(=NC=C1C2=CN=C(C=C2)[N](=O)=O)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""83324A5C08013264_710049239123059D_6006_UN""","""C[N]1C(=NC=C1C2=CSC=C2C(F)(F)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""A85604904E74E00C_580BAC4921AC001C_6006_UN""","""C[N]1C(=NC=C1C2=CC(=CC=C2)C(=O)O)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""A4DA9B02DC261015_BA075948149D4F9F_6006_UN""","""C[N]1C(=NC=C1C3=C2[NH]C=CC2=CC=C3)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""6404B0990B3B3FBB_79E7EC18B5C43E88_6006_UN""","""C[N]1C(=NC=C1C2=C(C=C(C)C=C2F)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""6DB337E6CCAAEC06_CD5C9210029F1FD3_6006_UN""","""C[N]1C(=NC=C1C2=CC=CC3=NON=C23)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""BE29BEDED26E87FF_8A26CC486F954CAB_6006_UN""","""C[N]1C(=NC=C1C2=C(C(=C(C)C=C2)F)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""516E8C2D4E8EB4E6_CBED87896508612F_6006_UN""","""C[N]1C(=NC=C1C3=C[N]2C=NN=C2C=C3)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""113488E47949D927_25DB6441E736B283_6006_UN""","""C[N]1C(=NC=C1C2=CC(=C(C=C2)F)OC)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""E803C3122205CE9C_330627F020A32DFF_6006_UN""","""C[N]1C(=NC=C1C2=C(C=C(C)C=C2C)C)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""805A514A77CDCCAB_46CD78BF67774B73_6006_UN""","""C[N]1C(=NC=C1C2=C(OC)C=CC=C2F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""7577883A83C33F59_969ED8BC69A97C5F_6006_UN""","""C[N]1C(=NC=C1C2=CC=C(C(N)=O)C=C2)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""476BA3FD6ECC4FAC_4CE1F180D3BE99EA_6006_UN""","""C[N]1C(=NC=C1C2=CC(=C(OC)C=C2)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""4186A4109401BF22_1449F24583D37536_6006_DP""","""C[N]1C(=NC=C1C3=C2[N](CCNC2)N=C3)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""A85604904E74E00C_1818901D7875202D_6006_DP""","""C[N]1C(=NC=C1C2=CC=CC(=C2)C(O)=O)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""B0FD3E75A9B66787_31B3FA2B8A073056_6006_UN""","""C[N]1C(=NC=C1C2=CC=CC(=C2F)OC)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""2DDA31256D7CC671_862C8D5542F6F23E_6006_UN""","""C[N]1C(=NC=C1C2=C(C=CC(=C2)OC)C)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""018A552D3349FCB4_977421B223B28333_6006_UN""","""C[N]1C(=NC=C1C3=C2OC=CC2=CC=C3)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""F32464DA9FD1D171_2E85251722CCB705_6006_UN""","""C[N]1C(=NC=C1C2=C(OC)C=C(C=C2)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""709ECF82EEFDEB96_2ED8395F7C7721CC_6006_UN""","""C[N]1C(=NC=C1C2=CC(=C(OC)C=C2)C)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""65C8BFD8426AB2A6_3E9F5617CB7B4E53_6006_UN""","""C[N]1C(=NC=C1C2=CC=C(C(C)O)C=C2)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""875AA5CDBCBA0D70_36BBEAA8F45F0972_6006_UN""","""C[N]1C(=NC=C1C2=COC(=C2)C(F)(F)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""631DFEADA7EED77A_284EAC2D4BCD5E81_6006_UN""","""C[N]1C(=NC=C1C2=CC(=CS2)C(F)(F)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""8A668E43675B0C95_ABDFAEE9CA2C689A_6006_UN""","""C[N]1C(=NC=C1C2=CN=C(N(C)C)N=C2)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""C41A8150E2B32BED_7E5E477DFC37B059_6006_UN""","""C[N]1C(=NC=C1C3=CC2=C(C=CC=N2)S3)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""3194FF115308F635_C92BC7C2F444B621_6006_UN""","""C[N]1C(=NC=C1C2=C(C(=CC=C2O)F)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""FEC39D08569F1DEC_2E68FD48A502B53B_6006_UN""","""C[N]1C(=NC=C1C2=CSC3=C2C=CC=C3)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""5E269A76EB0FB546_516E41FD6235C7AC_6006_UN""","""C[N]1C(=NC=C1C2=CC=C[N]3N=CC=C23)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""24864E6ABC817259_E8C4687CE3732C1B_6006_UN""","""C[N]1C(=NC=C1C2=CN=C(C=C2)C(F)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""006A42986CF484E7_83DFB477C114DC97_6006_UN""","""C[N]1C(=NC=C1C2=CC3=C(C=C2)CCO3)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""DD1A65846D2DB430_D51CCE83F56E8F14_6006_UN""","""C[N]1C(=NC=C1C2=CC=C(C=C2)[N](=O)=O)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""0B9F264F5072173D_2ED2CA263A4D3A8F_6006_UN""","""C[N]1C(=NC=C1C2=CC3=C(C=C2)C=N[NH]3)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""25D6752D2440F468_8A66A9A64B9468CD_6006_UN""","""C[N]1C(=NC=C1C2=CC=C(S2)C(F)(F)F)C(F)(F)C(=O)O""",21,"""E355ABF359A944E2"""
+"""8B9184C383F9FEAF_9A5CEC9759AE6266_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](C)(=O)=O)CCCN""",21,"""E4C3D0DB94FDC547"""
+"""35FAAC085BDC3648_30A9D83159522DC8_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](CC)(=O)=O)CCBr""",21,"""E4C3D0DB94FDC547"""
+"""622B9C66C0B9AC34_3E252E1E4C19B329_6036_UN""","""CN1CCN(CC1)C2CCCC2N(CCNC)[S](=O)(=O)C""",21,"""E4C3D0DB94FDC547"""
+"""DC028F085E3503E4_C25F125A47687E23_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](CCCC)(=O)=O)C""",21,"""E4C3D0DB94FDC547"""
+"""30C7826146A738FF_F64CF00795C8057C_6036_UN""","""CN1CCN(CC1)C2CCCC2N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""E4C3D0DB94FDC547"""
+"""29A4BF751AD0B499_E6AAE1B524FA5CB1_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](C)(=O)=O)CCC#C""",21,"""E4C3D0DB94FDC547"""
+"""8AED21FA3DBDF9B7_EFE8EF00CAC57115_6036_UN""","""CN1CCN(CC1)C2CCCC2N(C)[S](=O)(=O)CCCCl""",21,"""E4C3D0DB94FDC547"""
+"""0CB54740757693DA_AE14A504CCD5E8DE_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](CC)(=O)=O)CC#C""",21,"""E4C3D0DB94FDC547"""
+"""5F128E63B95778C8_F7C74952AF1611BE_6036_UN""","""CN1CCN(CC1)C2CCCC2N3[S](CCCC3=O)(=O)=O""",21,"""E4C3D0DB94FDC547"""
+"""AF5B8F1F789E9EF3_2539D5CA50EF2FE8_6036_UN""","""CN1CCN(CC1)C2CCCC2N3C(C(N)C[S]3(=O)=O)=O""",21,"""E4C3D0DB94FDC547"""
+"""6633767E344AD5BE_00F0B2490E00B23C_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](C)(=O)=O)C3CNC3""",21,"""E4C3D0DB94FDC547"""
+"""AAD1FF671EB4B083_DA275DBA6CE61D13_6036_DP""","""CN1CCN(CC1)C2CCCC2N[S](=O)(=O)C3(CC3)C#N""",21,"""E4C3D0DB94FDC547"""
+"""801483D862EAACE5_CD2B0496B3778B1B_6036_UN""","""CN1CCN(CC1)C2CCCC2N(C)[S](=O)(=O)CCCN""",21,"""E4C3D0DB94FDC547"""
+"""AC8417E8DC87B5D9_643227720E337F24_6036_UN""","""CN1CCN(CC1)C2CCCC2N(C)[S](=O)(=O)C3COC3""",21,"""E4C3D0DB94FDC547"""
+"""484C0AD754A889CA_0417F690D29ECFBB_6036_UN""","""CN1CCN(CC1)C2CCCC2N(C)[S](=O)(=O)CCOC""",21,"""E4C3D0DB94FDC547"""
+"""7CAA8371F67F641F_AAC96B7206AE1DAE_6036_UN""","""CN1CCN(CC1)C2CCCC2N(C)[S](=O)(=O)CC(=O)C""",21,"""E4C3D0DB94FDC547"""
+"""402DF2FEA4F5DF9F_22E10DC6C0202EE3_6036_UN""","""CN1CCN(CC1)C2CCCC2N3CCCC(C)[S]3(=O)=O""",21,"""E4C3D0DB94FDC547"""
+"""B215F41FC7B21713_2F0E2B2179191546_6036_UN""","""CN1CCN(CC1)C2CCCC2N3CCC(C)(C)[S]3(=O)=O""",21,"""E4C3D0DB94FDC547"""
+"""F8FE8A65B5519BF1_14A68AE0782EE719_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](CC)(=O)=O)CCN""",21,"""E4C3D0DB94FDC547"""
+"""E0A49581B53E9AAF_550B165A4668E1AD_6036_UN""","""CN1CCN(CC1)C2CCCC2N(CC)[S](=O)(=O)CCN""",21,"""E4C3D0DB94FDC547"""
+"""8BBEEAEE5A4166D8_EF98BDAF477E14E0_6036_UN""","""CN1CCN(CC1)C2CCCC2N(C)[S](=O)(=O)C(C)(C)C""",21,"""E4C3D0DB94FDC547"""
+"""ED90E863CC5FB185_67A08EC585D301DC_6036_UN""","""CN1CCN(CC1)C2CCCC2N3[S](=O)(=O)C4(CC3)CC4""",21,"""E4C3D0DB94FDC547"""
+"""F0FC06448E628E58_088618F810554982_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](CCNC)(=O)=O)C""",21,"""E4C3D0DB94FDC547"""
+"""F0FC06448E628E58_D476E26EE9CA42A4_6036_DP""","""CN1CCN(CC1)C2CCCC2N(C)[S](=O)(=O)CCNC""",21,"""E4C3D0DB94FDC547"""
+"""2066FF20FED5B8A5_C5CB668292F0857F_6036_UN""","""CN1CCN(CC1)C2CCCC2N3[S](CCC3CI)(=O)=O""",21,"""E4C3D0DB94FDC547"""
+"""A3A971C80185EF1C_59CDCD4AE8FE8BB2_6036_UN""","""CN1CCN(CC1)C2CCCC2N3C(CN)CC[S]3(=O)=O""",21,"""E4C3D0DB94FDC547"""
+"""AB5DFE2DA1537AFE_CA9A12B0903426CA_6036_UN""","""CN1CCN(CC1)C2CCCC2N(CC(C)C)[S](=O)(=O)C""",21,"""E4C3D0DB94FDC547"""
+"""16301F43BA04D668_5693871AE93E4B1D_6036_UN""","""CN1CCN(CC1)C2CCCC2N3[S](=O)(CCNCC3)=O""",21,"""E4C3D0DB94FDC547"""
+"""81B4817B2D6FD2C4_E4749C44C2AF8BB6_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](C=C)(=O)=O)C3CC3""",21,"""E4C3D0DB94FDC547"""
+"""CC2C1AF2D2F79B20_44731C4714AA8249_6036_UN""","""CN1CCN(CC1)C2CCCC2N3CC4(C[S]3(=O)=O)CC4""",21,"""E4C3D0DB94FDC547"""
+"""5FB819FF9819DE2A_88386F761CF5930B_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](C)(=O)=O)C(=O)CN""",21,"""E4C3D0DB94FDC547"""
+"""986FA7E1CF50B946_6ABB2140CC80ACC5_6036_UN""","""CN1CCN(CC1)C2CCCC2N3CCCCC[S]3(=O)=O""",21,"""E4C3D0DB94FDC547"""
+"""EB9C1C7980CB448A_7810BDA6CEC86299_6036_UN""","""CN1CCN(CC1)C2CCCC2N([S](C)(=O)=O)CCCBr""",21,"""E4C3D0DB94FDC547"""
+"""F43BA9282B1219B5_2813BCFB77AC664B_6003_UN""","""CN1CCN(CC1)C2CCCC2OC3=CC=C(C=C3)C#N""",21,"""E4C3D0DB94FDC547"""
+"""FE655CE1BF68453B_173346F33634DB6A_6003_UN""","""CN1CCN(CC1)C2CCCC2OC3=CC=CC=C3[N+]#[C-]""",21,"""E4C3D0DB94FDC547"""
+"""97368A292B5122E1_1064B3815779E6C8_6003_UN""","""CN1CCN(CC1)C2CCCC2OC3=CC=CC=C3C#N""",21,"""E4C3D0DB94FDC547"""
+"""0F2F33EF08A2767A_F8E411E5C987CFB4_6003_UN""","""CN1CCN(CC1)C2CCCC2OC3=CC=C(C=C3)[N+]#[C-]""",21,"""E4C3D0DB94FDC547"""
+"""C2C2B776605A56C2_76DF940776AA18CA_6003_UN""","""CN1CCN(CC1)C2CCCC2OC3=CC=CC(=C3)[N+]#[C-]""",21,"""E4C3D0DB94FDC547"""
+"""40057E73F99B203F_80B622A56F751899_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC(=C(C(=C3)F)F)F""",21,"""E502D66E5A9FC80D"""
+"""F3FAFEA2156EA653_ADB7853348832DA5_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=C(C(C)C)C=C3""",21,"""E502D66E5A9FC80D"""
+"""A030D8449683710C_0F344202989A0660_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC4=C(C=C3)CCC4""",21,"""E502D66E5A9FC80D"""
+"""15788874741AC610_AFE602CE87F27CC2_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=CC(=C3)C#CC""",21,"""E502D66E5A9FC80D"""
+"""BC8732C9BE516DF7_AFE286BC969A575D_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=CC(=C3)CSC""",21,"""E502D66E5A9FC80D"""
+"""94DEAD278D5B3CB0_2F0C3692348D7B58_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CN=C(C=C3)[N](=O)=O""",21,"""E502D66E5A9FC80D"""
+"""AF3CD53E8F981E82_775734BE92158972_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CSC=C3C(F)(F)F""",21,"""E502D66E5A9FC80D"""
+"""A91264FABE3BF4E8_5E5CD1D4229A8CF3_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC(=CC=C3)C(=O)O""",21,"""E502D66E5A9FC80D"""
+"""04C547BF27D08ACB_BC5024D517ABC370_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C4=C3[NH]C=CC3=CC=C4""",21,"""E502D66E5A9FC80D"""
+"""77D9EEDDC96BFA13_7FB09185B6F2B267_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=C(C=C(C)C=C3F)F""",21,"""E502D66E5A9FC80D"""
+"""6DCF6AC50F853E60_CB0BEF8D01A9933C_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=CC4=NON=C34""",21,"""E502D66E5A9FC80D"""
+"""2BF1128947F27417_8C71B1D56CA3C044_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=C(C(=C(C)C=C3)F)F""",21,"""E502D66E5A9FC80D"""
+"""02EE59DC0B173FA3_CDBAFA14663EEDC0_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C4=C[N]3C=NN=C3C=C4""",21,"""E502D66E5A9FC80D"""
+"""CE724D1E2309847C_238C19DCE4003E6C_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC(=C(C=C3)F)OC""",21,"""E502D66E5A9FC80D"""
+"""E62A3254B0BE1744_35515A6D2395A110_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=C(C=C(C)C=C3C)C""",21,"""E502D66E5A9FC80D"""
+"""FC5F995A479B5784_409A05226441C79C_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=C(OC)C=CC=C3F""",21,"""E502D66E5A9FC80D"""
+"""DF194DC250FFB91D_90C9A5216A9FF0B0_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=C(C(N)=O)C=C3""",21,"""E502D66E5A9FC80D"""
+"""7C5F5421F1277997_4AB68C1DD0881505_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC(=C(OC)C=C3)F""",21,"""E502D66E5A9FC80D"""
+"""7860F8B7404C5DD3_121E8FD880E5F9D9_6006_DP""","""NC1=NC(=NS1)C2=C(C=CC=N2)C4=C3[N](CCNC3)N=C4""",21,"""E502D66E5A9FC80D"""
+"""A91264FABE3BF4E8_1E4FED807B43ACC2_6006_DP""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=CC(=C3)C(O)=O""",21,"""E502D66E5A9FC80D"""
+"""F23410D026FF5821_37E487B68931BCB9_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=CC(=C3F)OC""",21,"""E502D66E5A9FC80D"""
+"""145EA739D9A66208_807BF0C841C07ED1_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=C(C=CC(=C3)OC)C""",21,"""E502D66E5A9FC80D"""
+"""45A422471D6508AF_91235C2F20840FDC_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C4=C3OC=CC3=CC=C4""",21,"""E502D66E5A9FC80D"""
+"""9A0A0EFE5948064E_28D2588A21FA3BEA_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=C(OC)C=C(C=C3)F""",21,"""E502D66E5A9FC80D"""
+"""7170010CA1E12D04_288F44C27F41AD23_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC(=C(OC)C=C3)C""",21,"""E502D66E5A9FC80D"""
+"""74686463A6D62520_38C82B8AC84DC2BC_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=C(C(C)O)C=C3""",21,"""E502D66E5A9FC80D"""
+"""0FFD56982DED355F_30EC9735F769859D_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=COC(=C3)C(F)(F)F""",21,"""E502D66E5A9FC80D"""
+"""D98F2F8DD35A2D22_2E19D1B048FBD26E_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC(=CS3)C(F)(F)F""",21,"""E502D66E5A9FC80D"""
+"""B35686E7822326C2_AD88D374C91AE475_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CN=C(N(C)C)N=C3""",21,"""E502D66E5A9FC80D"""
+"""9340C5887C97D0F6_78093AE0FF013CB6_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C4=CC3=C(C=CC=N3)S4""",21,"""E502D66E5A9FC80D"""
+"""5F0BADA03D8E50AD_CF7CBA5FF7723ACE_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=C(C(=CC=C3O)F)F""",21,"""E502D66E5A9FC80D"""
+"""D88B8A4E1231F19C_283F80D5A63439D4_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CSC4=C3C=CC=C4""",21,"""E502D66E5A9FC80D"""
+"""B9C2FAB54DE3F8AE_57393C6061034B43_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=C[N]4N=CC=C34""",21,"""E502D66E5A9FC80D"""
+"""D769E211DE1797E0_EE9315E1E045A0F4_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CN=C(C=C3)C(F)F""",21,"""E502D66E5A9FC80D"""
+"""E0420BE46A79CD66_8588C9EAC2225078_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC4=C(C=C3)CCO4""",21,"""E502D66E5A9FC80D"""
+"""EC63AA0F0946EEF5_D34BB31EF65803FB_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=C(C=C3)[N](=O)=O""",21,"""E502D66E5A9FC80D"""
+"""237AAD69575FC76C_2885B7BB397BB660_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""E502D66E5A9FC80D"""
+"""2B785271456A863F_8C31D43B48A2E422_6006_UN""","""NC1=NC(=NS1)C2=C(C=CC=N2)C3=CC=C(S3)C(F)(F)F""",21,"""E502D66E5A9FC80D"""
+"""7F75C8D0EFF4650A_80F5817258777D31_6006_UN""","""C1(=NC3=C(C=C1)N2CCC(C2)N3)C4=CC(=C(C(=C4)F)F)F""",21,"""E54175B96D9DADA5"""
+"""D564775F593D2B95_ADF426E47F81480D_6006_UN""","""C1(=NC3=C(C=C1)N2CCC(C2)N3)C4=CC=C(C(C)C)C=C4""",21,"""E54175B96D9DADA5"""
+"""A3141B13B16E9336_0F77E1D5AF9863C8_6006_UN""","""C1(=NC3=C(C=C1)N2CCC(C2)N3)C4=CC5=C(C=C4)CCC5""",21,"""E54175B96D9DADA5"""
+"""CCD1B026DD2F3C23_AFA5A119B0F0196A_6006_UN""","""C1(=NC3=C(C=C1)N2CCC(C2)N3)C4=CC=CC(=C4)C#CC""",21,"""E54175B96D9DADA5"""
+"""09DB362B9551B15A_AFA1256BA19832F5_6006_UN""","""C1(=NC3=C(C=C1)N2CCC(C2)N3)C4=CC=CC(=C4)CSC""",21,"""E54175B96D9DADA5"""
+"""329183DA9669119A_2F4F9545038F1EF0_6006_UN""","""C1(=NC3=C(C=C1)N2CCC(C2)N3)C4=CN=C(C=C4)[N](=O)=O""",21,"""E54175B96D9DADA5"""
+"""848C5646067B4AB8_77149769A517ECDA_6006_UN""","""C1(=NC3=C(C=C1)N2CCC(C2)N3)C4=CSC=C4C(F)(F)F""",21,"""E54175B96D9DADA5"""
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+"""D798A9F2D689B1E1_2E43E571A8C88239_6006_UN""","""C1(=C(C(=CC=C1)[S](=O)(=O)Cl)C#N)C2=CC(=CS2)C(F)(F)F""",21,"""E558E2AFBAAC985A"""
+"""281C43E64E85ECAB_ADD2E7B52929B422_6006_UN""","""C1(=C(C(=CC=C1)[S](=O)(=O)Cl)C#N)C2=CN=C(N(C)C)N=C2""",21,"""E558E2AFBAAC985A"""
+"""31969AA4FE15FE5C_78530E211F326CE1_6006_UN""","""C1(=C(C(=CC=C1)[S](=O)(=O)Cl)C#N)C3=CC2=C(C=CC=N2)S3""",21,"""E558E2AFBAAC985A"""
+"""5EB090ECC7BDBA81_CF268E9E17416A99_6006_UN""","""C1(=C(C(=CC=C1)[S](=O)(=O)Cl)C#N)C2=C(C(=CC=C2O)F)F""",21,"""E558E2AFBAAC985A"""
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+"""83BC5D9F8663A0A0_576308A181301B14_6006_UN""","""C1(=C(C(=CC=C1)[S](=O)(=O)Cl)C#N)C2=CC=C[N]3N=CC=C23""",21,"""E558E2AFBAAC985A"""
+"""F0F4F5CD32398AE8_EEC921200076F0A3_6006_UN""","""C1(=C(C(=CC=C1)[S](=O)(=O)Cl)C#N)C2=CN=C(C=C2)C(F)F""",21,"""E558E2AFBAAC985A"""
+"""19F692FE86AC067C_85D2FD2B2211002F_6006_UN""","""C1(=C(C(=CC=C1)[S](=O)(=O)Cl)C#N)C2=CC3=C(C=C2)CCO3""",21,"""E558E2AFBAAC985A"""
+"""D9948D4742A905B1_D31187DF166B53AC_6006_UN""","""C1(=C(C(=CC=C1)[S](=O)(=O)Cl)C#N)C2=CC=C(C=C2)[N](=O)=O""",21,"""E558E2AFBAAC985A"""
+"""A8A09523D7847989_28DF837AD948E637_6006_UN""","""C1(=C(C(=CC=C1)[S](=O)(=O)Cl)C#N)C2=CC3=C(C=C2)C=N[NH]3""",21,"""E558E2AFBAAC985A"""
+"""34937254E2110CA8_8C6BE0FAA891B475_6006_UN""","""C1(=C(C(=CC=C1)[S](=O)(=O)Cl)C#N)C2=CC=C(S2)C(F)(F)F""",21,"""E558E2AFBAAC985A"""
+"""B856525A34ADAF33_9BE0FCEC44EB4468_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN([S](C)(=O)=O)CCCN""",21,"""E57FC0A089B8E349"""
+"""9BC884AAE1CB2470_3115C84A44170BC6_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN([S](CC)(=O)=O)CCBr""",21,"""E57FC0A089B8E349"""
+"""E5E0E38BC20CBA0B_3F993E65515C9527_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN(CCNC)[S](=O)(=O)C""",21,"""E57FC0A089B8E349"""
+"""E6931E7EF45BE565_C3E302215A2D582D_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN([S](CCCC)(=O)=O)C""",21,"""E57FC0A089B8E349"""
+"""3DCF4A66CD2691C0_F7F0E07C888D2372_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN2C(C(C)(C)[S]2(=O)=O)=O""",21,"""E57FC0A089B8E349"""
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+"""333F6CDFEB0AC672_EE54FF7BD780571B_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN(C)[S](=O)(=O)CCCCl""",21,"""E57FC0A089B8E349"""
+"""26768D21DBBE8173_AFA8B57FD190CED0_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN([S](CC)(=O)=O)CC#C""",21,"""E57FC0A089B8E349"""
+"""B970A3E613C3837F_F67B5929B25337B0_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN2[S](CCCC2=O)(=O)=O""",21,"""E57FC0A089B8E349"""
+"""4EFF82A4EBD35FA8_2485C5B14DAA09E6_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN2C(C(N)C[S]2(=O)=O)=O""",21,"""E57FC0A089B8E349"""
+"""083FFE7460AB5DCF_014CA23213459432_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN([S](C)(=O)=O)C2CNC2""",21,"""E57FC0A089B8E349"""
+"""91D62F85FE50AA42_DB9B4DC171A33B1D_6036_DP""","""COC1=C(C=C(C=C1)C(=O)C)CN[S](=O)(=O)C2(CC2)C#N""",21,"""E57FC0A089B8E349"""
+"""AE21149395759B91_CC9714EDAE32AD15_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN(C)[S](=O)(=O)CCCN""",21,"""E57FC0A089B8E349"""
+"""215547DA9A17C026_658E37091376592A_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN(C)[S](=O)(=O)C2COC2""",21,"""E57FC0A089B8E349"""
+"""CC4CC769972C59F3_05ABE6EBCFDBE9B5_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN(C)[S](=O)(=O)CCOC""",21,"""E57FC0A089B8E349"""
+"""FE5A18CF5C444C00_AB757B091BEB3BA0_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN(C)[S](=O)(=O)CC(=O)C""",21,"""E57FC0A089B8E349"""
+"""22516DC536F79F1B_235D1DBDDD6508ED_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN2CCCC(C)[S]2(=O)=O""",21,"""E57FC0A089B8E349"""
+"""C56D397698564495_2EB23B5A645C3348_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN2CCC(C)(C)[S]2(=O)=O""",21,"""E57FC0A089B8E349"""
+"""E37F32692A6E8F60_151A9A9B656BC117_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN([S](CC)(=O)=O)CCN""",21,"""E57FC0A089B8E349"""
+"""503491AD7C104646_54B706215B2DC7A3_6036_UN""","""COC1=C(C=C(C=C1)C(=O)C)CN(CC)[S](=O)(=O)CCN""",21,"""E57FC0A089B8E349"""
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+"""C585B224B635E689_4014E894E08A66DA_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=C(OC)C=CC=C3F)F""",21,"""E58C3BD8DE54694B"""
+"""69150407B8EEEEDB_90474897EE5451F6_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=CC=C(C(N)=O)C=C3)F""",21,"""E58C3BD8DE54694B"""
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+"""1A3CE1F488D2F320_3846C63C4C8663FA_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=CC=C(C(C)O)C=C3)F""",21,"""E58C3BD8DE54694B"""
+"""E705A63A4A359563_30627A8373A224DB_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=COC(=C3)C(F)(F)F)F""",21,"""E58C3BD8DE54694B"""
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+"""69993C74DAB62D94_7887D7567BCA9DF0_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C4=CC3=C(C=CC=N3)S4)F""",21,"""E58C3BD8DE54694B"""
+"""3A07D6F47F10E200_CFF257E973B99B88_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=C(C(=CC=C3O)F)F)F""",21,"""E58C3BD8DE54694B"""
+"""1713F3757E0C666E_28B16D6322FF9892_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=CSC4=C3C=CC=C4)F""",21,"""E58C3BD8DE54694B"""
+"""7D00C42E559FFE6A_57B7D1D6E5C8EA05_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=CC=C[N]4N=CC=C34)F""",21,"""E58C3BD8DE54694B"""
+"""F02D294B0B23C745_EE1DF857648E01B2_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=CN=C(C=C3)C(F)F)F""",21,"""E58C3BD8DE54694B"""
+"""81131E7079882320_8506245C46E9F13E_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=CC4=C(C=C3)CCO4)F""",21,"""E58C3BD8DE54694B"""
+"""E9634A1834F65BCC_D3C55EA87293A2BD_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=CC=C(C=C3)[N](=O)=O)F""",21,"""E58C3BD8DE54694B"""
+"""BBD28FD3904B967D_280B5A0DBDB01726_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=CC4=C(C=C3)C=N[NH]4)F""",21,"""E58C3BD8DE54694B"""
+"""ECFF2445DAEBB5C5_8CBF398DCC694564_6006_UN""","""FC2=C(C=C1C(=NC=NC1=C2)C3=CC=C(S3)C(F)(F)F)F""",21,"""E58C3BD8DE54694B"""
+"""8BD5617F5182D914_8392A3647E5CC20C_6006_UN""","""COC2=C1C=CC(=NC1=CC=C2)C3=CC(=C(C(=C3)F)F)F""",21,"""E62657AF4BB61298"""
+"""2B6ACDA7EB4860F4_AE9304F259AAF730_6006_UN""","""COC2=C1C=CC(=NC1=CC=C2)C3=CC=C(C(C)C)C=C3""",21,"""E62657AF4BB61298"""
+"""09E1E30B1F003A7C_0C10C3C389B3DCF5_6006_UN""","""COC2=C1C=CC(=NC1=CC=C2)C3=CC4=C(C=C3)CCC4""",21,"""E62657AF4BB61298"""
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+"""7C9EFBCF14D6CAE6_37572948D0B3169F_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=C(C=C(C)C=C3C)C""",21,"""E704A54BA9B97F82"""
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+"""BCD0B5D613B80AC8_93252F0AD3A2B853_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C4=C3OC=CC3=CC=C4""",21,"""E704A54BA9B97F82"""
+"""1BCCE7310A57D44D_2AD42BAFD2DC8C65_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=C(OC)C=C(C=C3)F""",21,"""E704A54BA9B97F82"""
+"""D2CA645B8C8F849D_2A8937E78C671AAC_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CC(=C(OC)C=C3)C""",21,"""E704A54BA9B97F82"""
+"""D6F8B82EF1835A06_3ACE58AF3B6B7533_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CC=C(C(C)O)C=C3""",21,"""E704A54BA9B97F82"""
+"""F89D0ACDCF8E5334_32EAE410044F3212_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=COC(=C3)C(F)(F)F""",21,"""E704A54BA9B97F82"""
+"""FCED1122CAF06636_2C1FA295BBDD65E1_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CC(=CS3)C(F)(F)F""",21,"""E704A54BA9B97F82"""
+"""129B8AD3679B6811_AF8EA0513A3C53FA_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CN=C(N(C)C)N=C3""",21,"""E704A54BA9B97F82"""
+"""D4C20C2F1BFA8E51_7A0F49C50C278B39_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C4=CC3=C(C=CC=N3)S4""",21,"""E704A54BA9B97F82"""
+"""91A7A40558D7DC45_CD7AC97A04548D41_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=C(C(=CC=C3O)F)F""",21,"""E704A54BA9B97F82"""
+"""6A5D2F1D3EDAC6F2_2A39F3F055128E5B_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CSC4=C3C=CC=C4""",21,"""E704A54BA9B97F82"""
+"""B2F601759376236A_553F4F459225FCCC_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CC=C[N]4N=CC=C34""",21,"""E704A54BA9B97F82"""
+"""7A576BDA62770A23_EC9566C41363177B_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CN=C(C=C3)C(F)F""",21,"""E704A54BA9B97F82"""
+"""A361A1B6755A6FEF_878EBACF3104E7F7_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CC4=C(C=C3)CCO4""",21,"""E704A54BA9B97F82"""
+"""A1AEE24E59F4469B_D14DC03B057EB474_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CC=C(C=C3)[N](=O)=O""",21,"""E704A54BA9B97F82"""
+"""B1AF8771FAD903C1_2A83C49ECA5D01EF_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CC4=C(C=C3)C=N[NH]4""",21,"""E704A54BA9B97F82"""
+"""1A1867E395FD47D4_8E37A71EBB8453AD_6006_UN""","""COC1=CC2=C(C=C1)C=NN=C2C3=CC=C(S3)C(F)(F)F""",21,"""E704A54BA9B97F82"""
+"""8D580A92C8E6120C_99DF345940E65B3F_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N([S](C)(=O)=O)CCCN""",21,"""E74008158DB5FC1E"""
+"""40C1C12AA0F60360_332A00FF401A1491_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N([S](CC)(=O)=O)CCBr""",21,"""E74008158DB5FC1E"""
+"""D6E49DAD922DFDF8_3DA6F6D055518A70_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N(CCNC)[S](=O)(=O)C""",21,"""E74008158DB5FC1E"""
+"""42E217EA21914F26_C1DCCA945E20477A_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N([S](CCCC)(=O)=O)C""",21,"""E74008158DB5FC1E"""
+"""0FA6651C165577AA_F5CF28C98C803C25_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""E74008158DB5FC1E"""
+"""1ECE7CF1C3705E7A_E529397B3DB265E8_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N([S](C)(=O)=O)CCC#C""",21,"""E74008158DB5FC1E"""
+"""CFE8E366C5F076DC_EC6B37CED38D484C_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N(C)[S](=O)(=O)CCCCl""",21,"""E74008158DB5FC1E"""
+"""D31E80352A099486_AD977DCAD59DD187_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N([S](CC)(=O)=O)CC#C""",21,"""E74008158DB5FC1E"""
+"""FAAE2628AC8FFF8A_F444919CB65E28E7_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N3[S](CCCC3=O)(=O)=O""",21,"""E74008158DB5FC1E"""
+"""10B50458A643BD10_26BA0D0449A716B1_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""E74008158DB5FC1E"""
+"""2D6D59969C1AF640_03736A8717488B65_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N([S](C)(=O)=O)C3CNC3""",21,"""E74008158DB5FC1E"""
+"""D6A80F9A6901CC21_D9A4857475AE244A_6036_DP""","""C(C1=NC(=NO1)C2=CC=CC=C2)N[S](=O)(=O)C3(CC3)C#N""",21,"""E74008158DB5FC1E"""
+"""E4CF0E55F4D0A09E_CEA8DC58AA3FB242_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N(C)[S](=O)(=O)CCCN""",21,"""E74008158DB5FC1E"""
+"""D9E1AA485A59AC45_67B1FFBC177B467D_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N(C)[S](=O)(=O)C3COC3""",21,"""E74008158DB5FC1E"""
+"""93D0BFB44443139F_07942E5ECBD6F6E2_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N(C)[S](=O)(=O)CCOC""",21,"""E74008158DB5FC1E"""
+"""969ED3C941F70476_A94AB3BC1FE624F7_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N(C)[S](=O)(=O)CC(=O)C""",21,"""E74008158DB5FC1E"""
+"""6E8296D3202C68D0_2162D508D96817BA_6036_UN""","""C(C1=NC(=NO1)C2=CC=CC=C2)N3CCCC(C)[S]3(=O)=O""",21,"""E74008158DB5FC1E"""
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+"""A458B90E57C4D464_2E811E3B6A2B4F6C_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC(=C(C=C2)F)OC)OC""",21,"""E80FD189D4B4B90D"""
+"""F054345C3813148C_385C5D8AADBED010_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=C(C=C(C)C=C2C)C)OC""",21,"""E80FD189D4B4B90D"""
+"""BF1D1E9C2169DC35_4D9702C5EA6AB69C_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=C(OC)C=CC=C2F)OC""",21,"""E80FD189D4B4B90D"""
+"""CC49606C02650014_9DC4A2C6E4B481B0_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC=C(C(N)=O)C=C2)OC""",21,"""E80FD189D4B4B90D"""
+"""A51912C15F108D08_47BB8BFA5EA36405_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC(=C(OC)C=C2)F)OC""",21,"""E80FD189D4B4B90D"""
+"""D01C6B5B11132559_1F13883F0ECE88D9_6006_DP""","""COC(=O)C1=C(C=CC(=C1)C3=C2[N](CCNC2)N=C3)OC""",21,"""E80FD189D4B4B90D"""
+"""75D1CEF6866A03BA_1342EA67F568DDC2_6006_DP""","""COC(=O)C1=C(C=CC(=C1)C2=CC=CC(=C2)C(O)=O)OC""",21,"""E80FD189D4B4B90D"""
+"""CF057571C8A8A6F7_3AE98051071ACDB9_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC=CC(=C2F)OC)OC""",21,"""E80FD189D4B4B90D"""
+"""25F434AAD58ED1B3_8D76F72FCFEB0FD1_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=C(C=CC(=C2)OC)C)OC""",21,"""E80FD189D4B4B90D"""
+"""C337B0106A4EF5D6_9C2E5BC8AEAF7EDC_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C3=C2OC=CC2=CC=C3)OC""",21,"""E80FD189D4B4B90D"""
+"""C4F7198F3D0568A6_25DF5F6DAFD14AEA_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=C(OC)C=C(C=C2)F)OC""",21,"""E80FD189D4B4B90D"""
+"""A383764B4CF2E12C_25824325F16ADC23_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC(=C(OC)C=C2)C)OC""",21,"""E80FD189D4B4B90D"""
+"""7F90D6D2EEDFA50C_35C52C6D4666B3BC_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC=C(C(C)O)C=C2)OC""",21,"""E80FD189D4B4B90D"""
+"""243F978E709D46D4_3DE190D27942F49D_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=COC(=C2)C(F)(F)F)OC""",21,"""E80FD189D4B4B90D"""
+"""5AC239DCEE782158_2314D657C6D0A36E_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC(=CS2)C(F)(F)F)OC""",21,"""E80FD189D4B4B90D"""
+"""C616B20D629FD584_A085D49347319575_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CN=C(N(C)C)N=C2)OC""",21,"""E80FD189D4B4B90D"""
+"""EAC35259DEE9F13B_75043D07712A4DB6_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C3=CC2=C(C=CC=N2)S3)OC""",21,"""E80FD189D4B4B90D"""
+"""2E4FA80721A07C19_C271BDB879594BCE_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=C(C(=CC=C2O)F)F)OC""",21,"""E80FD189D4B4B90D"""
+"""1EBD09B79B592F25_25328732281F48D4_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CSC3=C2C=CC=C3)OC""",21,"""E80FD189D4B4B90D"""
+"""3AD3EAD3ADD202F6_5A343B87EF283A43_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC=C[N]3N=CC=C23)OC""",21,"""E80FD189D4B4B90D"""
+"""82F2362C0F47F756_E39E12066E6ED1F4_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CN=C(C=C2)C(F)F)OC""",21,"""E80FD189D4B4B90D"""
+"""0DCE625FBBA27917_8885CE0D4C092178_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC3=C(C=C2)CCO3)OC""",21,"""E80FD189D4B4B90D"""
+"""4532B2F5547D9D43_DE46B4F9787372FB_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC=C(C=C2)[N](=O)=O)OC""",21,"""E80FD189D4B4B90D"""
+"""9C0C0229A15A8373_2588B05CB750C760_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC3=C(C=C2)C=N[NH]3)OC""",21,"""E80FD189D4B4B90D"""
+"""44C26A64EB44B1A1_813CD3DCC6899522_6006_UN""","""COC(=O)C1=C(C=CC(=C1)C2=CC=C(S2)C(F)(F)F)OC""",21,"""E80FD189D4B4B90D"""
+"""C66104C36C6815CA_96BA3163158648FD_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](C)(=O)=O)CCCN""",21,"""E8250D2FD8D5EFDC"""
+"""3C58719319B8EDEC_3C4F05C5157A0753_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](CC)(=O)=O)CCBr""",21,"""E8250D2FD8D5EFDC"""
+"""2F24C5D2957F125A_32C3F3EA003199B2_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N(CCNC)[S](=O)(=O)C""",21,"""E8250D2FD8D5EFDC"""
+"""4C9EC4CDA277CF1C_CEB9CFAE0B4054B8_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](CCCC)(=O)=O)C""",21,"""E8250D2FD8D5EFDC"""
+"""7A9764DC3D099E92_FAAA2DF3D9E02FE7_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""E8250D2FD8D5EFDC"""
+"""DF679B402F1E8869_EA4C3C4168D2762A_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](C)(=O)=O)CCC#C""",21,"""E8250D2FD8D5EFDC"""
+"""6D411D166CE97697_E30E32F486ED5B8E_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N(C)[S](=O)(=O)CCCCl""",21,"""E8250D2FD8D5EFDC"""
+"""4F8B3561332C208B_A2F278F080FDC245_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](CC)(=O)=O)CC#C""",21,"""E8250D2FD8D5EFDC"""
+"""5AFC1271450988D7_FB2194A6E33E3B25_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3[S](CCCC3=O)(=O)=O""",21,"""E8250D2FD8D5EFDC"""
+"""9430BBA2239C9451_29DF083E1CC70573_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""E8250D2FD8D5EFDC"""
+"""93782A8B47F56621_0C166FBD422898A7_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](C)(=O)=O)C3CNC3""",21,"""E8250D2FD8D5EFDC"""
+"""02E89975A519B08F_D6C1804E20CE3788_6036_DP""","""CC(C1=C[N](N=C1)C2CCCC2)N[S](=O)(=O)C3(CC3)C#N""",21,"""E8250D2FD8D5EFDC"""
+"""298BE2C71DEA1ADA_C1CDD962FF5FA180_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N(C)[S](=O)(=O)CCCN""",21,"""E8250D2FD8D5EFDC"""
+"""82A1152CFFE6E850_68D4FA86421B55BF_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N(C)[S](=O)(=O)C3COC3""",21,"""E8250D2FD8D5EFDC"""
+"""FDE12348EDF7B7EA_08F12B649EB6E520_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N(C)[S](=O)(=O)CCOC""",21,"""E8250D2FD8D5EFDC"""
+"""BD2A5F2B258B3BB6_A62FB6864A863735_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N(C)[S](=O)(=O)CC(=O)C""",21,"""E8250D2FD8D5EFDC"""
+"""DA595ECAEC13E443_2E07D0328C080478_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3CCCC(C)[S]3(=O)=O""",21,"""E8250D2FD8D5EFDC"""
+"""E886CA3D2905D86F_23E8F6D535313FDD_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3CCC(C)(C)[S]3(=O)=O""",21,"""E8250D2FD8D5EFDC"""
+"""281066460BEB2B66_184057143406CD82_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](CC)(=O)=O)CCN""",21,"""E8250D2FD8D5EFDC"""
+"""F25C414B5402CAB8_59EDCBAE0A40CB36_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N(CC)[S](=O)(=O)CCN""",21,"""E8250D2FD8D5EFDC"""
+"""6F18B49C64C78D5A_E37E605B0B563E7B_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""E8250D2FD8D5EFDC"""
+"""8250989E5F7B5290_6B465331C9FB2B47_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""E8250D2FD8D5EFDC"""
+"""17C34415DB45C38A_0460C50C5C7D6319_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](CCNC)(=O)=O)C""",21,"""E8250D2FD8D5EFDC"""
+"""17C34415DB45C38A_D8903F9AA5E2683F_6036_DP""","""CC(C1=C[N](N=C1)C2CCCC2)N(C)[S](=O)(=O)CCNC""",21,"""E8250D2FD8D5EFDC"""
+"""BEAF5623C8347196_C92DBB76DED8AFE4_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3[S](CCC3CI)(=O)=O""",21,"""E8250D2FD8D5EFDC"""
+"""652B8257D21AA784_552B10BEA4D6A129_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3C(CN)CC[S]3(=O)=O""",21,"""E8250D2FD8D5EFDC"""
+"""C38207C90C84D3D0_C67CCF44DC1C0C51_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N(CC(C)C)[S](=O)(=O)C""",21,"""E8250D2FD8D5EFDC"""
+"""3959C8A9AC688287_5A755AEEA5166186_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3[S](=O)(CCNCC3)=O""",21,"""E8250D2FD8D5EFDC"""
+"""B544322BAE5C2CB2_E89241B08E87A12D_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](C=C)(=O)=O)C3CC3""",21,"""E8250D2FD8D5EFDC"""
+"""110930DB9F50B96D_4895C1B35882A8D2_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3CC4(C[S]3(=O)=O)CC4""",21,"""E8250D2FD8D5EFDC"""
+"""760C746DD4A63736_84DEB28250DDB990_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](C)(=O)=O)C(=O)CN""",21,"""E8250D2FD8D5EFDC"""
+"""F2D45C579B569B3C_665DFCB480A8865E_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N3CCCCC[S]3(=O)=O""",21,"""E8250D2FD8D5EFDC"""
+"""0ED9E482B542DDC3_74F6605282E04802_6036_UN""","""CC(C1=C[N](N=C1)C2CCCC2)N([S](C)(=O)=O)CCCBr""",21,"""E8250D2FD8D5EFDC"""
+"""647F0C4B093B3AB8_24F5610F3B844CD0_6003_UN""","""CC(OC1=CC=C(C=C1)C#N)C2=C[N](N=C2)C3CCCC3""",21,"""E8250D2FD8D5EFDC"""
+"""143EFBC23A2E0150_1BD59B077A1CF1F1_6003_UN""","""CC(OC1=CC=CC=C1[N+]#[C-])C2=C[N](N=C2)C3CCCC3""",21,"""E8250D2FD8D5EFDC"""
+"""72BDE6A67BD0E5C6_1C826E751B51CC53_6003_UN""","""CC(OC1=CC=CC=C1C#N)C2=C[N](N=C2)C3CCCC3""",21,"""E8250D2FD8D5EFDC"""
+"""CB4EBB9FDC88C093_F402CC1185AFE52F_6003_UN""","""CC(OC1=CC=C(C=C1)[N+]#[C-])C2=C[N](N=C2)C3CCCC3""",21,"""E8250D2FD8D5EFDC"""
+"""3ED457A4C3224D35_7A3949F33A823251_6003_UN""","""CC(OC1=CC=CC(=C1)[N+]#[C-])C2=C[N](N=C2)C3CCCC3""",21,"""E8250D2FD8D5EFDC"""
+"""46DC985842B3FC67_8DEC326D0CF14BD1_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC(=C(C(=C2)F)F)F)F""",21,"""E858C6A6391B9B45"""
+"""78051EAA558B3CD7_A0ED95FB2B077EED_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC=C(C(C)C)C=C2)F""",21,"""E858C6A6391B9B45"""
+"""0E9736B543D275D0_026E52CAFB1E5528_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC3=C(C=C2)CCC3)F""",21,"""E858C6A6391B9B45"""
+"""2DF0FEFCBDCDA103_A2BC1206E4762F8A_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC=CC(=C2)C#CC)F""",21,"""E858C6A6391B9B45"""
+"""81A22EE83093CF77_A2B89674F51E0415_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC=CC(=C2)CSC)F""",21,"""E858C6A6391B9B45"""
+"""456B7C9DD64E30A8_2256265A57092810_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CN=C(C=C2)[N](=O)=O)F""",21,"""E858C6A6391B9B45"""
+"""0413CED0960CF572_7A0D2476F191DA3A_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CSC=C2C(F)(F)F)F""",21,"""E858C6A6391B9B45"""
+"""4686F4E5D9A9EC28_5306C11C411EDFBB_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC(=CC=C2)C(=O)O)F""",21,"""E858C6A6391B9B45"""
+"""666CFFFE9A6BE5CE_B10A341D742F9038_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C3=C2[NH]C=CC2=CC=C3)F""",21,"""E858C6A6391B9B45"""
+"""34001529CE8C1AAE_72EA814DD576E12F_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=C(C=C(C)C=C2F)F)F""",21,"""E858C6A6391B9B45"""
+"""43896F37F61A8434_C651FF45622DC074_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC=CC3=NON=C23)F""",21,"""E858C6A6391B9B45"""
+"""A11ED53B732A0B1D_812BA11D0F27930C_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=C(C(=C(C)C=C2)F)F)F""",21,"""E858C6A6391B9B45"""
+"""7839E5E43D6A4AB2_C0E0EADC05BABE88_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C3=C[N]2C=NN=C2C=C3)F""",21,"""E858C6A6391B9B45"""
+"""20721056A7EED5D0_2ED6091487846D24_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC(=C(C=C2)F)OC)F""",21,"""E858C6A6391B9B45"""
+"""8E7669D1812D3459_380B4AA54011F258_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=C(C=C(C)C=C2C)C)F""",21,"""E858C6A6391B9B45"""
+"""79E7AE20B0AF3DC0_4DC015EA07C594D4_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=C(OC)C=CC=C2F)F""",21,"""E858C6A6391B9B45"""
+"""6B8918596988D91D_9D93B5E9091BA3F8_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC=C(C(N)=O)C=C2)F""",21,"""E858C6A6391B9B45"""
+"""4085D34157BE6395_47EC9CD5B30C464D_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC(=C(OC)C=C2)F)F""",21,"""E858C6A6391B9B45"""
+"""151F685DCD624BDD_1F449F10E361AA91_6006_DP""","""CC(C)C(=O)C1=C(C=C(C=C1)C3=C2[N](CCNC2)N=C3)F""",21,"""E858C6A6391B9B45"""
+"""4686F4E5D9A9EC28_1315FD4818C7FF8A_6006_DP""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC=CC(=C2)C(O)=O)F""",21,"""E858C6A6391B9B45"""
+"""A98F0C1491B0E622_3ABE977EEAB5EFF1_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC=CC(=C2F)OC)F""",21,"""E858C6A6391B9B45"""
+"""F564A501A52C0AF6_8D21E00022442D99_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=C(C=CC(=C2)OC)C)F""",21,"""E858C6A6391B9B45"""
+"""8F2CB4FC33534A13_9C794CE743005C94_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C3=C2OC=CC2=CC=C3)F""",21,"""E858C6A6391B9B45"""
+"""E224F5E740122937_25884842427E68A2_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=C(OC)C=C(C=C2)F)F""",21,"""E858C6A6391B9B45"""
+"""ED41B423EC274ACA_25D5540A1CC5FE6B_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC(=C(OC)C=C2)C)F""",21,"""E858C6A6391B9B45"""
+"""4D40D725E02A7149_35923B42ABC991F4_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC=C(C(C)O)C=C2)F""",21,"""E858C6A6391B9B45"""
+"""CAC1764BB150E7EE_3DB687FD94EDD6D5_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=COC(=C2)C(F)(F)F)F""",21,"""E858C6A6391B9B45"""
+"""D3DE3F3192DF0665_2343C1782B7F8126_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CC(=CS2)C(F)(F)F)F""",21,"""E858C6A6391B9B45"""
+"""59F63572DCDFE9EC_A0D2C3BCAA9EB73D_6006_UN""","""CC(C)C(=O)C1=C(C=C(C=C1)C2=CN=C(N(C)C)N=C2)F""",21,"""E858C6A6391B9B45"""
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+"""49CB0C608B93696D_75D48613FC3CE3E0_6036_UN""","""C(C1=CC=C(C=C1)OCC2CC2)N([S](C)(=O)=O)CCCBr""",21,"""E907EB6EA609443E"""
+"""E961CB23BDE7812C_25D7874E4558E732_6003_UN""","""O(CC1=CC=C(C=C1)OCC2CC2)C3=CC=C(C=C3)C#N""",21,"""E907EB6EA609443E"""
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+"""D5C6F0A724E07D03_F5202A50FB734ECD_6003_UN""","""O(CC1=CC=C(C=C1)OCC2CC2)C3=CC=C(C=C3)[N+]#[C-]""",21,"""E907EB6EA609443E"""
+"""22B2B12B768548D6_7B1BAFB2445E99B3_6003_UN""","""O(CC1=CC=C(C=C1)OCC2CC2)C3=CC=CC(=C3)[N+]#[C-]""",21,"""E907EB6EA609443E"""
+"""78155F525BF111B4_971569C363ED74E5_6036_UN""","""C[C@@H](C1=CC(=C(C=C1)C)[N](=O)=O)N([S](C)(=O)=O)CCCN""",21,"""E98A558FAEBED3C4"""
+"""8B746A10C472D391_3DE05D6563113B4B_6036_UN""","""C[C@@H](C1=CC(=C(C=C1)C)[N](=O)=O)N([S](CC)(=O)=O)CCBr""",21,"""E98A558FAEBED3C4"""
+"""DABAEC5C831789E6_336CAB4A765AA5AA_6036_UN""","""C[C@@H](C1=CC(=C(C=C1)C)[N](=O)=O)N(CCNC)[S](=O)(=O)C""",21,"""E98A558FAEBED3C4"""
+"""D517A20C56D9ADB9_CF16970E7D2B68A0_6036_UN""","""C[C@@H](C1=CC(=C(C=C1)C)[N](=O)=O)N([S](CCCC)(=O)=O)C""",21,"""E98A558FAEBED3C4"""
+"""ABB71DEA3BDB62EE_FB057553AF8B13FF_6036_UN""","""C[C@@H](C1=CC(=C(C=C1)C)[N](=O)=O)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""E98A558FAEBED3C4"""
+"""6149B5383F699184_EBE364E11EB94A32_6036_UN""","""C[C@@H](C1=CC(=C(C=C1)C)[N](=O)=O)N([S](C)(=O)=O)CCC#C""",21,"""E98A558FAEBED3C4"""
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+"""A646149523274C6C_275E4A7A1A13EA5E_6006_UN""","""NC1=NN=C(C=C1)C2=CC=C(S2)C3=CC(=CS3)C(F)(F)F""",21,"""EC454DA40877F03D"""
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+"""768B1E8E9BBAB83B_C63B2195A59A02FE_6006_UN""","""NC1=NN=C(C=C1)C2=CC=C(S2)C3=C(C(=CC=C3O)F)F""",21,"""EC454DA40877F03D"""
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+"""1954B4FE3B26F961_239274333F192E3A_6006_UN""","""NCCNC(=O)C1=NC=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""EE1515E65CFD5057"""
+"""515538BC0F701B28_872617B34EC07C78_6006_UN""","""NCCNC(=O)C1=NC=C(C=C1)C2=CC=C(S2)C(F)(F)F""",21,"""EE1515E65CFD5057"""
+"""D036090B9C73EEF6_8BA1DCE4EDC48064_6006_UN""","""COC(=O)C1=C(C(=CC(=C1)C2=CC(=C(C(=C2)F)F)F)C)N""",21,"""EE15282FD82E50F0"""
+"""3793F840E7EB4E64_A6A07B72CA32B558_6006_UN""","""COC(=O)C1=C(C(=CC(=C1)C2=CC=C(C(C)C)C=C2)C)N""",21,"""EE15282FD82E50F0"""
+"""5D04B16A75EC62A2_0423BC431A2B9E9D_6006_UN""","""COC(=O)C1=C(C(=CC(=C1)C2=CC3=C(C=C2)CCC3)C)N""",21,"""EE15282FD82E50F0"""
+"""52A9E5F12D97A085_A4F1FC8F0543E43F_6006_UN""","""COC(=O)C1=C(C(=CC(=C1)C2=CC=CC(=C2)C#CC)C)N""",21,"""EE15282FD82E50F0"""
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+"""D7D59C4891686A7C_A0698C82ACD347DA_6036_UN""","""CC1=CC=C(C=C1)C2CCCC2N(C)[S](=O)(=O)CC(=O)C""",21,"""EE63372B3E809F33"""
+"""63B2A52E30AD18B7_2841EA366A5D7497_6036_UN""","""CC1=CC=C(C=C1)C2CCCC2N3CCCC(C)[S]3(=O)=O""",21,"""EE63372B3E809F33"""
+"""A71372BFE015D9E3_25AECCD1D3644F32_6036_UN""","""CC1=CC=C(C=C1)C2CCCC2N3CCC(C)(C)[S]3(=O)=O""",21,"""EE63372B3E809F33"""
+"""D82D905397F92C1B_1E066D10D253BD6D_6036_UN""","""CC1=CC=C(C=C1)C2CCCC2N([S](CC)(=O)=O)CCN""",21,"""EE63372B3E809F33"""
+"""98456FC4101F9F1B_5FABF1AAEC15BBD9_6036_UN""","""CC1=CC=C(C=C1)C2CCCC2N(CC)[S](=O)(=O)CCN""",21,"""EE63372B3E809F33"""
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+"""14852256AA93B25E_2207BB8140AA08F5_6006_DP""","""N1CCN(CC1)C2=NC(=NC=N2)C3=CSC4=C3C=CC=C4""",21,"""EF3AED3ABC01F92C"""
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+"""F478F8619F218000_8FB0F2BE24BC6159_6006_DP""","""N1CCN(CC1)C2=NC(=NC=N2)C3=CC4=C(C=C3)CCO4""",21,"""EF3AED3ABC01F92C"""
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+"""A1FE1F01370C8246_8609EF6FAE3CD503_6006_DP""","""N1CCN(CC1)C2=NC(=NC=N2)C3=CC=C(S3)C(F)(F)F""",21,"""EF3AED3ABC01F92C"""
+"""B7C034F73082625A_8A77AFC92396E648_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""EFC35B02167C36DC"""
+"""B4CAA8ED8BAD10B5_A776085F0460D374_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC=C(C(C)C)C=C2""",21,"""EFC35B02167C36DC"""
+"""C8806E303BD260C3_05F5CF6ED479F8B1_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)CCC3""",21,"""EFC35B02167C36DC"""
+"""985804BFBE7AF3D4_A5278FA2CB118213_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)C#CC""",21,"""EFC35B02167C36DC"""
+"""FBDA275F89F62EFB_A5230BD0DA79A98C_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)CSC""",21,"""EFC35B02167C36DC"""
+"""5027EC9AB328149C_25CDBBFE786E8589_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""EFC35B02167C36DC"""
+"""324A8C84DA80AF51_7D96B9D2DEF677A3_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CSC=C2C(F)(F)F""",21,"""EFC35B02167C36DC"""
+"""4FA56AE2EE41C63B_549D5CB86E797222_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)O""",21,"""EFC35B02167C36DC"""
+"""D921B5CB78C077FA_B691A9B95B483DA1_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""EFC35B02167C36DC"""
+"""FB30574C6C2D995D_75711CE9FA114CB6_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=C(C=C(C)C=C2F)F""",21,"""EFC35B02167C36DC"""
+"""1C9C03E05CAD2987_C1CA62E14D4A6DED_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC=CC3=NON=C23""",21,"""EFC35B02167C36DC"""
+"""6989059C3801E90D_86B03CB920403E95_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=C(C(=C(C)C=C2)F)F""",21,"""EFC35B02167C36DC"""
+"""2234FEB2689F11B4_C77B77782ADD1311_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C3=C[N]2C=NN=C2C=C3""",21,"""EFC35B02167C36DC"""
+"""E27585E693A75F9C_294D94B0A8E3C0BD_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)F)OC""",21,"""EFC35B02167C36DC"""
+"""BC193A1E3903501F_3F90D7016F765FC1_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=C(C=C(C)C=C2C)C""",21,"""EFC35B02167C36DC"""
+"""F40CF3ED7DDA74F3_4A5B884E28A2394D_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=C(OC)C=CC=C2F""",21,"""EFC35B02167C36DC"""
+"""FE41E5613698B55C_9A08284D267C0E61_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC=C(C(N)=O)C=C2""",21,"""EFC35B02167C36DC"""
+"""CCB00C03CA186B48_407701719C6BEBD4_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)F""",21,"""EFC35B02167C36DC"""
+"""6575321EE4558456_18DF02B4CC060708_6006_DP""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C3=C2[N](CCNC2)N=C3""",21,"""EFC35B02167C36DC"""
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+"""8E7EE6612DC51A71_3D250ADAC5D24268_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC=CC(=C2F)OC""",21,"""EFC35B02167C36DC"""
+"""3FC93D564705FEE6_8ABA7DA40D238000_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=C(C=CC(=C2)OC)C""",21,"""EFC35B02167C36DC"""
+"""A6953859B7BF40BA_9BE2D1436C67F10D_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C3=C2OC=CC2=CC=C3""",21,"""EFC35B02167C36DC"""
+"""257138425547E777_2213D5E66D19C53B_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=C(OC)C=C(C=C2)F""",21,"""EFC35B02167C36DC"""
+"""16F92E4A3BE29638_224EC9AE33A253F2_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)C""",21,"""EFC35B02167C36DC"""
+"""FB7D8D9FE6974E93_3209A6E684AE3C6D_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC=C(C(C)O)C=C2""",21,"""EFC35B02167C36DC"""
+"""B4F2888D7EED67DB_3A2D1A59BB8A7B4C_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=COC(=C2)C(F)(F)F""",21,"""EFC35B02167C36DC"""
+"""CA7EF7862195512B_24D85CDC04182CBF_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC(=CS2)C(F)(F)F""",21,"""EFC35B02167C36DC"""
+"""575122343DCF0FF4_A7495E1885F91AA4_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CN=C(N(C)C)N=C2""",21,"""EFC35B02167C36DC"""
+"""F2371B5F08F282DA_72C8B78CB3E2C267_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C3=CC2=C(C=CC=N2)S3""",21,"""EFC35B02167C36DC"""
+"""3B869D913E6527F5_C5BD3733BB91C41F_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=C(C(=CC=C2O)F)F""",21,"""EFC35B02167C36DC"""
+"""464C15F1ED4AE16D_22FE0DB9EAD7C705_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CSC3=C2C=CC=C3""",21,"""EFC35B02167C36DC"""
+"""C7021A163BCBCDB0_5DF8B10C2DE0B592_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC=C[N]3N=CC=C23""",21,"""EFC35B02167C36DC"""
+"""DC3F20B60962111F_E452988DACA65E25_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CN=C(C=C2)C(F)F""",21,"""EFC35B02167C36DC"""
+"""400E2A1A27B9E8AE_8F4944868EC1AEA9_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)CCO3""",21,"""EFC35B02167C36DC"""
+"""3CBC1761172FA425_D98A3E72BABBFD2A_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""EFC35B02167C36DC"""
+"""19C852F62A53DFB0_22443AD7759848B1_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""EFC35B02167C36DC"""
+"""23CDD9630FE19C62_86F0595704411AF3_6006_UN""","""CC(C)(C)C(=O)C1=CC=C(C=C1)C2=CC=C(S2)C(F)(F)F""",21,"""EFC35B02167C36DC"""
+"""FDC3BFAE5D934877_95AD1A2071CEA2F3_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=CC(=C(C(=C3)F)F)F""",21,"""F019EEEB44247267"""
+"""D8C8A2B1FCEF01F5_B8ACBDB6563897CF_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=CC=C(C(C)C)C=C3""",21,"""F019EEEB44247267"""
+"""3754AC0282EE95FF_1A2F7A878621BC0A_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=CC4=C(C=C3)CCC4""",21,"""F019EEEB44247267"""
+"""CDAC1DFAA1C1BC4C_BAFD3A4B9949C6A8_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=CC=CC(=C3)C#CC""",21,"""F019EEEB44247267"""
+"""251DB05E9DBF9FE9_BAF9BE398821ED37_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=CC=CC(=C3)CSC""",21,"""F019EEEB44247267"""
+"""53E15E71934FFA7F_3A170E172A36C132_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=CN=C(C=C3)[N](=O)=O""",21,"""F019EEEB44247267"""
+"""A2969EDDC954F220_624C0C3B8CAE3318_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=CSC=C3C(F)(F)F""",21,"""F019EEEB44247267"""
+"""D03AED09555C162D_4B47E9513C213699_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=CC(=CC=C3)C(=O)O""",21,"""F019EEEB44247267"""
+"""02D5090546B34BC4_A94B1C500910791A_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C4=C3[NH]C=CC3=CC=C4""",21,"""F019EEEB44247267"""
+"""3746319500E43CDD_6AABA900A849080D_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=C(C=C(C)C=C3F)F""",21,"""F019EEEB44247267"""
+"""31E927AFAC9803F0_DE10D7081F122956_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=CC=CC4=NON=C34""",21,"""F019EEEB44247267"""
+"""5B75D8B3F0AAAFCD_996A895072187A2E_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=C(C(=C(C)C=C3)F)F""",21,"""F019EEEB44247267"""
+"""400E20168FFD68C9_D8A1C291788557AA_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C4=C[N]3C=NN=C3C=C4""",21,"""F019EEEB44247267"""
+"""F4E85591EDFCBC54_36972159FABB8406_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=CC(=C(C=C3)F)OC""",21,"""F019EEEB44247267"""
+"""03DAC54D2BE7CDD6_204A62E83D2E1B7A_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=C(C=C(C)C=C3C)C""",21,"""F019EEEB44247267"""
+"""5F65D5A81F1F1552_55813DA77AFA7DF6_6006_UN""","""CSC1=CC2=C(C=C1)N=CN=C2C3=C(OC)C=CC=C3F""",21,"""F019EEEB44247267"""
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+"""BF5C483B253F75A1_1821A2B8C4D3984F_6006_UN""","""COC2=NC(=C1CC(NC1=N2)=O)C3=CC4=C(C=C3)CCC4""",21,"""F21736D406D65622"""
+"""6C0E88B62E5A2107_B8F3E274DBBBE2ED_6006_UN""","""COC2=NC(=C1CC(NC1=N2)=O)C3=CC=CC(=C3)C#CC""",21,"""F21736D406D65622"""
+"""BB3CEDC9F5E5A202_B8F76606CAD3C972_6006_UN""","""COC2=NC(=C1CC(NC1=N2)=O)C3=CC=CC(=C3)CSC""",21,"""F21736D406D65622"""
+"""B341E55CB339D496_3819D62868C4E577_6006_UN""","""COC2=NC(=C1CC(NC1=N2)=O)C3=CN=C(C=C3)[N](=O)=O""",21,"""F21736D406D65622"""
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+"""878DD1B1365790A1_392FA3AEE946904A_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C2=CC(=CS2)C(F)(F)F""",21,"""F234A470FB228A29"""
+"""C7496D5A56A6FCD9_BABEA16A68A7A651_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C2=CN=C(N(C)C)N=C2""",21,"""F234A470FB228A29"""
+"""1E878EF8F63AA49D_6F3F48FE5EBC7E92_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C3=CC2=C(C=CC=N2)S3""",21,"""F234A470FB228A29"""
+"""7D11B978F0EA8CC1_D84AC84156CF78EA_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C2=C(C(=CC=C2O)F)F""",21,"""F234A470FB228A29"""
+"""FC572FAABB40CF62_3F09F2CB07897BF0_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C2=CSC3=C2C=CC=C3""",21,"""F234A470FB228A29"""
+"""71E8B87A96DE3119_400F4E7EC0BE0967_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C2=CC=C[N]3N=CC=C23""",21,"""F234A470FB228A29"""
+"""0EF523E285F49DA3_F9A567FF41F8E2D0_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C2=CN=C(C=C2)C(F)F""",21,"""F234A470FB228A29"""
+"""DE0294B02A3DC2A2_92BEBBF4639F125C_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C2=CC3=C(C=C2)CCO3""",21,"""F234A470FB228A29"""
+"""B374EE02C6383226_C47DC10057E541DF_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C2=CC=C(C=C2)[N](=O)=O""",21,"""F234A470FB228A29"""
+"""72FB6C2964992D18_3FB3C5A598C6F444_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C2=CC3=C(C=C2)C=N[NH]3""",21,"""F234A470FB228A29"""
+"""F3E0883317BD5A28_9B07A625E91FA606_6006_UN""","""NCC1=NC(=CC(=C1)C(F)(F)F)C2=CC=C(S2)C(F)(F)F""",21,"""F234A470FB228A29"""
+"""3C5260BF8DF5DB16_96830432B84D3D20_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC(=C(C(=C2)F)F)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""5E24A206E48B6071_BB82A3A49FBB081C_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC=C(C(C)C)C=C2)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""B22F00344FB34760_190164954FA223D9_6006_UN""","""OCCC4=CC1=C(N=CC(=C1)C2=CC3=C(C=C2)CCC3)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""78B3B732466775B9_B9D3245950CA597B_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC=CC(=C2)C#CC)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""B92BF00763DFDBEF_B9D7A02B41A272E4_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC=CC(=C2)CSC)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""74C92512A0484CBB_39391005E3B55EE1_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CN=C(C=C2)[N](=O)=O)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""EFBBEB7A11ACCE3F_61621229452DACCB_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CSC=C2C(F)(F)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""3D8B476A6CAD4437_4869F743F5A2A94A_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC(=CC=C2)C(=O)O)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""D2B5C3CAB19B22B1_AA650242C093E6C9_6006_UN""","""OCCC4=CC1=C(N=CC(=C1)C3=C2[NH]C=CC2=CC=C3)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""E0269EECD5346965_6985B71261CA97DE_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=C(C=C(C)C=C2F)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""4AFD7693CAEF26A4_DD3EC91AD691B685_6006_UN""","""OCCC4=CC1=C(N=CC(=C1)C2=CC=CC3=NON=C23)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""DDF6AB34173B513F_9A449742BB9BE5FD_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=C(C(=C(C)C=C2)F)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""1BAB66EBB9EB6C02_DB8FDC83B106C879_6006_UN""","""OCCC4=CC1=C(N=CC(=C1)C3=C[N]2C=NN=C2C=C3)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""AF07BC3CBE72EAB8_35B93F4B33381BD5_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC(=C(C=C2)F)OC)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""8BD7537F8BCB284E_23647CFAF4AD84A9_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=C(C=C(C)C=C2C)C)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""ACB92933AB067233_56AF23B5B379E225_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=C(OC)C=CC=C2F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""00189B36B1CD1C5C_86FC83B6BDA7D509_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC=C(C(N)=O)C=C2)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""09A1E5CC5BEDFE8B_5C83AA8A07B030BC_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC(=C(OC)C=C2)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""9652FEB44F6330F7_042BA94F57DDDC60_6006_DP""","""OCCC4=CC1=C(N=CC(=C1)C3=C2[N](CCNC2)N=C3)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""3D8B476A6CAD4437_087ACB17AC7B897B_6006_DP""","""OCCC3=CC1=C(N=CC(=C1)C2=CC=CC(=C2)C(O)=O)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""85CE261A6011E372_21D1A1215E099900_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC=CC(=C2F)OC)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""7F90E9CABFD154D3_964ED65F96F85B68_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=C(C=CC(=C2)OC)C)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""62D023767A29BDEB_87167AB8F7BC2A65_6006_UN""","""OCCC4=CC1=C(N=CC(=C1)C3=C2OC=CC2=CC=C3)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""59C4288D902A0AAD_3EE77E1DF6C21E53_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=C(OC)C=C(C=C2)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""D978E329E024CD76_3EBA6255A879889A_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC(=C(OC)C=C2)C)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""452A29E69C2ADF92_2EFD0D1D1F75E705_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC=C(C(C)O)C=C2)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""B24F8F42B0C69198_26D9B1A22051A024_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=COC(=C2)C(F)(F)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""0F12EF33643D9327_382CF7279FC3F7D7_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC(=CS2)C(F)(F)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""194A68F0DA9F5B73_BBBDF5E31E22C1CC_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CN=C(N(C)C)N=C2)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""26E7B897AE253D7C_6E3C1C772839190F_6006_UN""","""OCCC4=CC1=C(N=CC(=C1)C3=CC2=C(C=CC=N2)S3)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""BB871EAB4B21C267_D9499CC8204A1F77_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=C(C(=CC=C2O)F)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""C56BA219970E4C3D_3E0AA642710C1C6D_6006_UN""","""OCCC4=CC1=C(N=CC(=C1)C2=CSC3=C2C=CC=C3)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""6D9FFC8E7DE7E374_410C1AF7B63B6EFA_6006_UN""","""OCCC4=CC1=C(N=CC(=C1)C2=CC=C[N]3N=CC=C23)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""5CDA1C45B947A20C_F8A63376377D854D_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CN=C(C=C2)C(F)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""ECB06F5E414D5300_93BDEF7D151A75C1_6006_UN""","""OCCC4=CC1=C(N=CC(=C1)C2=CC3=C(C=C2)CCO3)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""C1E2462254916E94_C57E958921602642_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC=C(C=C2)[N](=O)=O)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""21DD54AFFA9A3A8C_3EB0912CEE4393D9_6006_UN""","""OCCC4=CC1=C(N=CC(=C1)C2=CC3=C(C=C2)C=N[NH]3)[NH]4""",21,"""F337F0F98DA7EDB4"""
+"""B3942CC72EC2F0EE_9A04F2AC9F9AC19B_6006_UN""","""OCCC3=CC1=C(N=CC(=C1)C2=CC=C(S2)C(F)(F)F)[NH]3""",21,"""F337F0F98DA7EDB4"""
+"""527BC9C925860B32_8DA10C795052022A_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](C)(=O)=O)CCCN""",21,"""F33E30359D01A50B"""
+"""B34C30E42A82CD0F_275438DF50AE4D84_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](CC)(=O)=O)CCBr""",21,"""F33E30359D01A50B"""
+"""F6AB8EE200CEE4E4_29D8CEF045E5D365_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N(CCNC)[S](=O)(=O)C""",21,"""F33E30359D01A50B"""
+"""3411479DF1EB5C01_D5A2F2B44E941E6F_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](CCCC)(=O)=O)C""",21,"""F33E30359D01A50B"""
+"""55EBC9199CF16EE9_E1B110E99C346530_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2C(C(C)(C)[S]2(=O)=O)=O""",21,"""F33E30359D01A50B"""
+"""EDD6300AB0C535CF_F157015B2D063CFD_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](C)(=O)=O)CCC#C""",21,"""F33E30359D01A50B"""
+"""E1AD2A9FB8EEE3A1_F8150FEEC3391159_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N(C)[S](=O)(=O)CCCCl""",21,"""F33E30359D01A50B"""
+"""3EAB978D35D27493_B9E945EAC5298892_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](CC)(=O)=O)CC#C""",21,"""F33E30359D01A50B"""
+"""AF0008DC2D88EEDF_E03AA9BCA6EA71F2_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2[S](CCCC2=O)(=O)=O""",21,"""F33E30359D01A50B"""
+"""96F7B2D9A245CED9_32C4352459134FA4_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2C(C(N)C[S]2(=O)=O)=O""",21,"""F33E30359D01A50B"""
+"""9BA4BDC04B1088B9_170D52A707FCD270_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](C)(=O)=O)C2CNC2""",21,"""F33E30359D01A50B"""
+"""A4F3F383646D495D_CDDABD54651A7D5F_6036_DP""","""CC(C)C(CC1=CC=C(C=C1)F)N[S](=O)(=O)C2(CC2)C#N""",21,"""F33E30359D01A50B"""
+"""E5F2448CF8DBF876_DAD6E478BA8BEB57_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N(C)[S](=O)(=O)CCCN""",21,"""F33E30359D01A50B"""
+"""EB1CD4402C7C4049_73CFC79C07CF1F68_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N(C)[S](=O)(=O)C2COC2""",21,"""F33E30359D01A50B"""
+"""A0230300172832DA_13EA167EDB62AFF7_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N(C)[S](=O)(=O)CCOC""",21,"""F33E30359D01A50B"""
+"""AAED0E519D28406F_BD348B9C0F527DE2_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N(C)[S](=O)(=O)CC(=O)C""",21,"""F33E30359D01A50B"""
+"""B52A1A3152292AF2_351CED28C9DC4EAF_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2CCCC(C)[S]2(=O)=O""",21,"""F33E30359D01A50B"""
+"""1A6203F5A0866273_38F3CBCF70E5750A_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2CCC(C)(C)[S]2(=O)=O""",21,"""F33E30359D01A50B"""
+"""9F8B76BCEA926097_035B6A0E71D28755_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](CC)(=O)=O)CCN""",21,"""F33E30359D01A50B"""
+"""E2DAF3DDB60C9C28_42F6F6B44F9481E1_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N(CC)[S](=O)(=O)CCN""",21,"""F33E30359D01A50B"""
+"""428494DEBBA1E88B_F8655D414E8274AC_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N(C)[S](=O)(=O)C(C)(C)C""",21,"""F33E30359D01A50B"""
+"""6B0B0F73DF6D6DA3_705D6E2B8C2F6190_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2[S](=O)(=O)C3(CC2)CC3""",21,"""F33E30359D01A50B"""
+"""6566DDD92DE4F67C_1F7BF81619A929CE_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](CCNC)(=O)=O)C""",21,"""F33E30359D01A50B"""
+"""6566DDD92DE4F67C_C38B0280E03622E8_6036_DP""","""CC(C)C(CC1=CC=C(C=C1)F)N(C)[S](=O)(=O)CCNC""",21,"""F33E30359D01A50B"""
+"""3453AF2EB474D1EC_D236866C9B0CE533_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2[S](CCC2CI)(=O)=O""",21,"""F33E30359D01A50B"""
+"""3D634426DCCD24EE_4E302DA4E102EBFE_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2C(CN)CC[S]2(=O)=O""",21,"""F33E30359D01A50B"""
+"""FD422A8A5E1E99EC_DD67F25E99C84686_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N(CC(C)C)[S](=O)(=O)C""",21,"""F33E30359D01A50B"""
+"""689DED33BE7A7065_416E67F4E0C22B51_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2[S](=O)(CCNCC2)=O""",21,"""F33E30359D01A50B"""
+"""2310EBAB2CCC1B83_F3897CAACB53EBFA_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](C=C)(=O)=O)C2CC2""",21,"""F33E30359D01A50B"""
+"""93487750B0F20B96_538EFCA91D56E205_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2CC3(C[S]2(=O)=O)CC3""",21,"""F33E30359D01A50B"""
+"""A20C80C708860083_9FC58F981509F347_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](C)(=O)=O)C(=O)CN""",21,"""F33E30359D01A50B"""
+"""4E10000E27D95C98_7D46C1AEC57CCC89_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N2CCCCC[S]2(=O)=O""",21,"""F33E30359D01A50B"""
+"""21C89E0C89068ED8_6FED5D48C73402D5_6036_UN""","""CC(C)C(CC1=CC=C(C=C1)F)N([S](C)(=O)=O)CCCBr""",21,"""F33E30359D01A50B"""
+"""55202E2867DE4121_3FEE5C157E500607_6003_UN""","""CC(C)C(OC1=CC=C(C=C1)C#N)CC2=CC=C(C=C2)F""",21,"""F33E30359D01A50B"""
+"""DE1EA8F4439087D4_00CEA61D3FC8BB26_6003_UN""","""CC(C)C(OC1=CC=CC=C1[N+]#[C-])CC2=CC=C(C=C2)F""",21,"""F33E30359D01A50B"""
+"""950AE7A43B3A746A_0799536F5E858684_6003_UN""","""CC(C)C(OC1=CC=CC=C1C#N)CC2=CC=C(C=C2)F""",21,"""F33E30359D01A50B"""
+"""B74B4CEFEAA8F98D_EF19F10BC07BAFF8_6003_UN""","""CC(C)C(OC1=CC=C(C=C1)[N+]#[C-])CC2=CC=C(C=C2)F""",21,"""F33E30359D01A50B"""
+"""A0567F6285155F9F_612274E97F567886_6003_UN""","""CC(C)C(OC1=CC=CC(=C1)[N+]#[C-])CC2=CC=C(C=C2)F""",21,"""F33E30359D01A50B"""
+"""9B9B445F73BFE58B_8DCF696896D64E5A_6036_UN""","""CC(C)OC1=CC(=CC=C1)[C@H](C)N([S](C)(=O)=O)CCCN""",21,"""F35055245B85E97B"""
+"""03A017DC5BF4FE4B_273A5DCE962A01F4_6036_UN""","""CC(C)OC1=CC(=CC=C1)[C@H](C)N([S](CC)(=O)=O)CCBr""",21,"""F35055245B85E97B"""
+"""B9C1E787991FCB7D_29B6ABE183619F15_6036_UN""","""CC(C)OC1=CC(=CC=C1)[C@H](C)N(CCNC)[S](=O)(=O)C""",21,"""F35055245B85E97B"""
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+"""D140387CB3E3FC24_691BE78AB8AEB8DD_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C=C1)CN)C3=CC2=C(C=CC=N2)S3""",21,"""F4100B041D304C66"""
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+"""019BD3D0F8E1E7E6_462BE10A26ACCF28_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C=C1)CN)C2=CC=C[N]3N=CC=C23""",21,"""F4100B041D304C66"""
+"""2B17BE4B13C2E30E_FF81C88BA7EA249F_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C=C1)CN)C2=CN=C(C=C2)C(F)F""",21,"""F4100B041D304C66"""
+"""7726F9ECB28CA146_949A1480858DD413_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C=C1)CN)C2=CC3=C(C=C2)CCO3""",21,"""F4100B041D304C66"""
+"""DE16906535D76486_C2596E74B1F78790_6006_UN""","""C[S](=O)(=O)C1=C(C=C(C=C1)CN)C2=CC=C(C=C2)[N](=O)=O""",21,"""F4100B041D304C66"""
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+"""209D4BC9D84FD966_BE3971969D2FE86B_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CC=CC(=C3)C#CC)F""",21,"""F4DDA53640425CA4"""
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+"""06F915B7AA6CC52F_32536A84FEDDAAC5_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CC(=C(C=C3)F)OC)F""",21,"""F4DDA53640425CA4"""
+"""C2F0295F753F4D5C_248E2935394835B9_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=C(C=C(C)C=C3C)C)F""",21,"""F4DDA53640425CA4"""
+"""8F90887E36180341_5145767A7E9C5335_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=C(OC)C=CC=C3F)F""",21,"""F4DDA53640425CA4"""
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+"""E6F3038934D7F24D_5B69FF45CA5581AC_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CC(=C(OC)C=C3)F)F""",21,"""F4DDA53640425CA4"""
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+"""51C9513DC96B1E0C_91A483905B1DEA78_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=C(C=CC(=C3)OC)C)F""",21,"""F4DDA53640425CA4"""
+"""C1D38544AAB813DD_80FC2F773A599B75_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C4=C3OC=CC3=CC=C4)F""",21,"""F4DDA53640425CA4"""
+"""5F994C6B327D02C0_390D2BD23B27AF43_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=C(OC)C=C(C=C3)F)F""",21,"""F4DDA53640425CA4"""
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+"""691ADDC30B1106A6_2133E46DEDB41134_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=COC(=C3)C(F)(F)F)F""",21,"""F4DDA53640425CA4"""
+"""CA7A3F393BBBB95E_3FC6A2E8522646C7_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CC(=CS3)C(F)(F)F)F""",21,"""F4DDA53640425CA4"""
+"""FD3CF3C894CFD6FB_BC57A02CD3C770DC_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CN=C(N(C)C)N=C3)F""",21,"""F4DDA53640425CA4"""
+"""251EB10785E94A11_69D649B8E5DCA81F_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C4=CC3=C(C=CC=N3)S4)F""",21,"""F4DDA53640425CA4"""
+"""3573E9D7C5299C74_DEA3C907EDAFAE67_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=C(C(=CC=C3O)F)F)F""",21,"""F4DDA53640425CA4"""
+"""3DB1C2C246771365_39E0F38DBCE9AD7D_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CSC4=C3C=CC=C4)F""",21,"""F4DDA53640425CA4"""
+"""E05DF83A64FFADA4_46E64F387BDEDFEA_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CC=C[N]4N=CC=C34)F""",21,"""F4DDA53640425CA4"""
+"""CBDEED28E0DF579A_FF4C66B9FA98345D_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CN=C(C=C3)C(F)F)F""",21,"""F4DDA53640425CA4"""
+"""BF6687E3C2C53648_9457BAB2D8FFC4D1_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CC4=C(C=C3)CCO4)F""",21,"""F4DDA53640425CA4"""
+"""CF5ED1DE33A7E26B_C294C046EC859752_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CC=C(C=C3)[N](=O)=O)F""",21,"""F4DDA53640425CA4"""
+"""B966B16747DC50EB_395AC4E323A622C9_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CC4=C(C=C3)C=N[NH]4)F""",21,"""F4DDA53640425CA4"""
+"""57601130BA088A21_9DEEA763527F708B_6006_UN""","""NC1=CC2=C(C=C1)C(=CN=C2C3=CC=C(S3)C(F)(F)F)F""",21,"""F4DDA53640425CA4"""
+"""651450720EA2D478_9094575A42260A94_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC(=C(C(=C2)F)F)F""",21,"""F520A39177CCDA00"""
+"""A462E237CA8F7CC4_BD95F0CC65D03FA8_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=C(C(C)C)C=C2""",21,"""F520A39177CCDA00"""
+"""C6C6DEF46AAE2DC2_1F1637FDB5C9146D_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC3=C(C=C2)CCC3""",21,"""F520A39177CCDA00"""
+"""6ABE2C5D608B075E_BFC47731AAA16ECF_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=CC(=C2)C#CC""",21,"""F520A39177CCDA00"""
+"""AA4D9410DBF858E0_BFC0F343BBC94550_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=CC(=C2)CSC""",21,"""F520A39177CCDA00"""
+"""692719A88B7D8B54_3F2E436D19DE6955_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CN=C(C=C2)[N](=O)=O""",21,"""F520A39177CCDA00"""
+"""6F1E0ABD9DEDB598_67754141BF469B7F_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CSC=C2C(F)(F)F""",21,"""F520A39177CCDA00"""
+"""72F695CA668B72AD_4E7EA42B0FC99EFE_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC(=CC=C2)C(=O)O""",21,"""F520A39177CCDA00"""
+"""E7F23F567E5C95B6_AC72512A3AF8D17D_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C3=C2[NH]C=CC2=CC=C3""",21,"""F520A39177CCDA00"""
+"""F6203C27CC4354AE_6F92E47A9BA1A06A_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=C(C=C(C)C=C2F)F""",21,"""F520A39177CCDA00"""
+"""F4445100EF5014BE_DB299A722CFA8131_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=CC3=NON=C23""",21,"""F520A39177CCDA00"""
+"""154AB1FBE8F85EA2_9C53C42A41F0D249_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=C(C(=C(C)C=C2)F)F""",21,"""F520A39177CCDA00"""
+"""EF7DD187A2636ED5_DD988FEB4B6DFFCD_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C3=C[N]2C=NN=C2C=C3""",21,"""F520A39177CCDA00"""
+"""D0751E49123BE2B1_33AE6C23C9532C61_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC(=C(C=C2)F)OC""",21,"""F520A39177CCDA00"""
+"""46A3DBE62F04B60D_25732F920EC6B31D_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=C(C=C(C)C=C2C)C""",21,"""F520A39177CCDA00"""
+"""D2801B93738B7C3C_50B870DD4912D591_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=C(OC)C=CC=C2F""",21,"""F520A39177CCDA00"""
+"""FA9080FA98E30688_80EBD0DE47CCE2BD_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=C(C(N)=O)C=C2""",21,"""F520A39177CCDA00"""
+"""BF74E74007313DA8_5A94F9E2FDDB0708_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC(=C(OC)C=C2)F""",21,"""F520A39177CCDA00"""
+"""876C2D2792B2373C_023CFA27ADB6EBD4_6006_DP""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C3=C2[N](CCNC2)N=C3""",21,"""F520A39177CCDA00"""
+"""72F695CA668B72AD_0E6D987F5610BECF_6006_DP""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=CC(=C2)C(O)=O""",21,"""F520A39177CCDA00"""
+"""0F7D246AEA5CCD5C_27C6F249A462AEB4_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=CC(=C2F)OC""",21,"""F520A39177CCDA00"""
+"""963A0A307EF65FEA_905985376C936CDC_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=C(C=CC(=C2)OC)C""",21,"""F520A39177CCDA00"""
+"""BAA0BFE2212BCD99_810129D00DD71DD1_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C3=C2OC=CC2=CC=C3""",21,"""F520A39177CCDA00"""
+"""58E1C824B6812957_38F02D750CA929E7_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=C(OC)C=C(C=C2)F""",21,"""F520A39177CCDA00"""
+"""1CB42A6CA5A26B7D_38AD313D5212BF2E_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC(=C(OC)C=C2)C""",21,"""F520A39177CCDA00"""
+"""44C1241960883A5C_28EA5E75E51ED0B1_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=C(C(C)O)C=C2""",21,"""F520A39177CCDA00"""
+"""14BC45BAB5EF167C_20CEE2CADA3A9790_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=COC(=C2)C(F)(F)F""",21,"""F520A39177CCDA00"""
+"""BEC042F67F8A7180_3E3BA44F65A8C063_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC(=CS2)C(F)(F)F""",21,"""F520A39177CCDA00"""
+"""122BD0495C39CF42_BDAAA68BE449F678_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CN=C(N(C)C)N=C2""",21,"""F520A39177CCDA00"""
+"""A87A4E66F3C18FC7_682B4F1FD2522EBB_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C3=CC2=C(C=CC=N2)S3""",21,"""F520A39177CCDA00"""
+"""019D5F13F6CADFDF_DF5ECFA0DA2128C3_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=C(C(=CC=C2O)F)F""",21,"""F520A39177CCDA00"""
+"""6587C7D35E22EB21_381DF52A8B672BD9_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CSC3=C2C=CC=C3""",21,"""F520A39177CCDA00"""
+"""19CB665CB6EE979F_471B499F4C50594E_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=C[N]3N=CC=C23""",21,"""F520A39177CCDA00"""
+"""B5919E1BBC1EC9D2_FEB1601ECD16B2F9_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CN=C(C=C2)C(F)F""",21,"""F520A39177CCDA00"""
+"""EB0A55A9E34463BA_95AABC15EF714275_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC3=C(C=C2)CCO3""",21,"""F520A39177CCDA00"""
+"""9164B5CAA6025489_C369C6E1DB0B11F6_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=C(C=C2)[N](=O)=O""",21,"""F520A39177CCDA00"""
+"""D95746B2DC38EAF3_38A7C2441428A46D_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC3=C(C=C2)C=N[NH]3""",21,"""F520A39177CCDA00"""
+"""52045CCEEC84ECAA_9C13A1C465F1F62F_6006_UN""","""C1(=C(C=CC(=C1)C#N)[S](=O)(=O)Cl)C2=CC=C(S2)C(F)(F)F""",21,"""F520A39177CCDA00"""
+"""D89343CF28715E8A_90E1CD63C45E1C50_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=CC(=C(C(=C3)F)F)F""",21,"""F55539A8F1B4CCC4"""
+"""943E3BC8EAC8FA4A_BDE06AF5E3A8296C_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=CC=C(C(C)C)C=C3""",21,"""F55539A8F1B4CCC4"""
+"""D818364A205BDB6E_1F63ADC433B102A9_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=CC4=C(C=C3)CCC4""",21,"""F55539A8F1B4CCC4"""
+"""E32758F9C2C4289B_BFB1ED082CD9780B_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=CC=CC(=C3)C#CC""",21,"""F55539A8F1B4CCC4"""
+"""F8BF820269462F7F_BFB5697A3DB15394_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=CC=CC(=C3)CSC""",21,"""F55539A8F1B4CCC4"""
+"""BAD2E1317888D8DA_3F5BD9549FA67F91_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=CN=C(C=C3)[N](=O)=O""",21,"""F55539A8F1B4CCC4"""
+"""A3935045962EE2DB_6700DB78393E8DBB_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=CSC=C3C(F)(F)F""",21,"""F55539A8F1B4CCC4"""
+"""A9880B7CF22FE940_4E0B3E1289B1883A_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=CC(=CC=C3)C(=O)O""",21,"""F55539A8F1B4CCC4"""
+"""99DEBBE7E916489E_AC07CB13BC80C7B9_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C4=C3[NH]C=CC3=CC=C4""",21,"""F55539A8F1B4CCC4"""
+"""5C2EDC7922F3A88F_6FE77E431DD9B6AE_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=C(C=C(C)C=C3F)F""",21,"""F55539A8F1B4CCC4"""
+"""AE4F5367BF9BAA72_DB5C004BAA8297F5_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=CC=CC4=NON=C34""",21,"""F55539A8F1B4CCC4"""
+"""B8AD2E1865B705E0_9C265E13C788C48D_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C3=C(C(=C(C)C=C3)F)F""",21,"""F55539A8F1B4CCC4"""
+"""7A69CF349F071317_DDED15D2CD15E909_6006_UN""","""C1(=C(ON=C1C2CC2)[S](=O)(=O)Cl)C4=C[N]3C=NN=C3C=C4""",21,"""F55539A8F1B4CCC4"""
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+"""36961B6A6A8EC1E8_28570B59C8DFCFC5_6006_DP""","""N1CCN(CC1)C2=NC(=CN=C2)C3=CC=C(C(C)O)C=C3""",21,"""F59DF6BD5A0DC574"""
+"""BE526250FC0F86E3_2073B7E6F7FB88E4_6006_DP""","""N1CCN(CC1)C2=NC(=CN=C2)C3=COC(=C3)C(F)(F)F""",21,"""F59DF6BD5A0DC574"""
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+"""C378980F46481353_C3D493CDF6CA0E82_6006_DP""","""N1CCN(CC1)C2=NC(=CN=C2)C3=CC=C(C=C3)[N](=O)=O""",21,"""F59DF6BD5A0DC574"""
+"""7406C5462D3EFFAC_381A976839E9BB19_6006_DP""","""N1CCN(CC1)C2=NC(=CN=C2)C3=CC4=C(C=C3)C=N[NH]4""",21,"""F59DF6BD5A0DC574"""
+"""78CEEEFF2D06007D_9CAEF4E84830E95B_6006_DP""","""N1CCN(CC1)C2=NC(=CN=C2)C3=CC=C(S3)C(F)(F)F""",21,"""F59DF6BD5A0DC574"""
+"""F5A8C725A8016C5F_936CAEAFEE4C3B49_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC(=C(C(=C3)F)F)F""",21,"""F6D85A64DBA6EBDD"""
+"""85D521ABF59231AD_BE6D0939C9BA0E75_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC=C(C(C)C)C=C3""",21,"""F6D85A64DBA6EBDD"""
+"""B0FEB11C5ACF6858_1CEECE0819A325B0_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC4=C(C=C3)CCC4""",21,"""F6D85A64DBA6EBDD"""
+"""0EB9FC5FA5249268_BC3C8EC406CB5F12_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC=CC(=C3)C#CC""",21,"""F6D85A64DBA6EBDD"""
+"""8B77B40CD5C760E3_BC380AB617A3748D_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC=CC(=C3)CSC""",21,"""F6D85A64DBA6EBDD"""
+"""9029FDE6788C9034_3CD6BA98B5B45888_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CN=C(C=C3)[N](=O)=O""",21,"""F6D85A64DBA6EBDD"""
+"""C8BDF1DB287D45C9_648DB8B4132CAAA2_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CSC=C3C(F)(F)F""",21,"""F6D85A64DBA6EBDD"""
+"""32F53015320469EA_4D865DDEA3A3AF23_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC(=CC=C3)C(=O)O""",21,"""F6D85A64DBA6EBDD"""
+"""9EF46C7E75ABD273_AF8AA8DF9692E0A0_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C4=C3[NH]C=CC3=CC=C4""",21,"""F6D85A64DBA6EBDD"""
+"""0CCD3DC150C18005_6C6A1D8F37CB91B7_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=C(C=C(C)C=C3F)F""",21,"""F6D85A64DBA6EBDD"""
+"""C329F7C683CAABD9_D8D163878090B0EC_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC=CC4=NON=C34""",21,"""F6D85A64DBA6EBDD"""
+"""048C4FC49CE3E689_9FAB3DDFED9AE394_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=C(C(=C(C)C=C3)F)F""",21,"""F6D85A64DBA6EBDD"""
+"""D22A593C11465514_DE60761EE707CE10_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C4=C[N]3C=NN=C3C=C4""",21,"""F6D85A64DBA6EBDD"""
+"""6E136F31021640CB_305695D665391DBC_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC(=C(C=C3)F)OC""",21,"""F6D85A64DBA6EBDD"""
+"""3CC337100CD33AD6_268BD667A2AC82C0_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=C(C=C(C)C=C3C)C""",21,"""F6D85A64DBA6EBDD"""
+"""DA33D814811261BB_53408928E578E44C_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=C(OC)C=CC=C3F""",21,"""F6D85A64DBA6EBDD"""
+"""36D83CE6BDA33E5F_8313292BEBA6D360_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC=C(C(N)=O)C=C3""",21,"""F6D85A64DBA6EBDD"""
+"""5A3D26A988D21B07_596C001751B136D5_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC(=C(OC)C=C3)F""",21,"""F6D85A64DBA6EBDD"""
+"""552D03522B09B720_01C403D201DCDA09_6006_DP""","""COC1=CC2=C(C=C1)C=CC(=N2)C4=C3[N](CCNC3)N=C4""",21,"""F6D85A64DBA6EBDD"""
+"""32F53015320469EA_0D95618AFA7A8F12_6006_DP""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC=CC(=C3)C(O)=O""",21,"""F6D85A64DBA6EBDD"""
+"""2A6D680FDD0138E4_243E0BBC08089F69_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC=CC(=C3F)OC""",21,"""F6D85A64DBA6EBDD"""
+"""DBC983A1E3033D2B_93A17CC2C0F95D01_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=C(C=CC(=C3)OC)C""",21,"""F6D85A64DBA6EBDD"""
+"""F0BF16A585364C29_82F9D025A1BD2C0C_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C4=C3OC=CC3=CC=C4""",21,"""F6D85A64DBA6EBDD"""
+"""BE4B33913021556D_3B08D480A0C3183A_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=C(OC)C=C(C=C3)F""",21,"""F6D85A64DBA6EBDD"""
+"""6FE32AD6089BF5F5_3B55C8C8FE788EF3_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC(=C(OC)C=C3)C""",21,"""F6D85A64DBA6EBDD"""
+"""B5C6405496777043_2B12A7804974E16C_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=CC=C(C(C)O)C=C3""",21,"""F6D85A64DBA6EBDD"""
+"""4BEDF74CFF878DC1_23361B3F7650A64D_6006_UN""","""COC1=CC2=C(C=C1)C=CC(=N2)C3=COC(=C3)C(F)(F)F""",21,"""F6D85A64DBA6EBDD"""
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+"""04452F7AED1E308C_62300490CB958838_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=C(C=C(C)C=C2F)F""",21,"""F882437B27F8F252"""
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+"""B19C1034DC9E08BA_D03A6F011B59D79F_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C3=C[N]2C=NN=C2C=C3""",21,"""F882437B27F8F252"""
+"""47AD731913E8E1F0_3E0C8CC999670433_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=CC(=C(C=C2)F)OC""",21,"""F882437B27F8F252"""
+"""B1B399A8E78FD77A_28D1CF785EF29B4F_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=C(C=C(C)C=C2C)C""",21,"""F882437B27F8F252"""
+"""E95196CEF2A3D477_5D1A90371926FDC3_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=C(OC)C=CC=C2F""",21,"""F882437B27F8F252"""
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+"""10695F749BFFE2A0_0F9E1ACDFD82C386_6006_DP""","""FC(F)(F)COC1=NC(=CN=C1)C3=C2[N](CCNC2)N=C3""",21,"""F882437B27F8F252"""
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+"""9EBA057686AE497C_9DFB65DD3CA7448E_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=C(C=CC(=C2)OC)C""",21,"""F882437B27F8F252"""
+"""914E82F6CDD9CD43_8CA3C93A5DE33583_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C3=C2OC=CC2=CC=C3""",21,"""F882437B27F8F252"""
+"""44A6532695B7237D_3552CD9F5C9D01B5_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=C(OC)C=C(C=C2)F""",21,"""F882437B27F8F252"""
+"""4972E980A9971782_350FD1D70226977C_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=CC(=C(OC)C=C2)C""",21,"""F882437B27F8F252"""
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+"""27F1AFD9EC292AFF_2D6C02208A0EBFC2_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=COC(=C2)C(F)(F)F""",21,"""F882437B27F8F252"""
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+"""693ED516CB1564E9_6589AFF5826606E9_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C3=CC2=C(C=CC=N2)S3""",21,"""F882437B27F8F252"""
+"""A307DC625728479D_D2FC2F4A8A150091_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=C(C(=CC=C2O)F)F""",21,"""F882437B27F8F252"""
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+"""D301E145314B6381_4AB9A9751C64711C_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=CC=C[N]3N=CC=C23""",21,"""F882437B27F8F252"""
+"""A23417991E616887_F31380F49D229AAB_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=CN=C(C=C2)C(F)F""",21,"""F882437B27F8F252"""
+"""1C3ADA92217F7D60_98085CFFBF456A27_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=CC3=C(C=C2)CCO3""",21,"""F882437B27F8F252"""
+"""E4E5D8EDB00EEB56_CECB260B8B3F39A4_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""F882437B27F8F252"""
+"""48806CB3FEAABF9D_350522AE441C8C3F_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""F882437B27F8F252"""
+"""44F201DD0C2C7981_91B1412E35C5DE7D_6006_UN""","""FC(F)(F)COC1=NC(=CN=C1)C2=CC=C(S2)C(F)(F)F""",21,"""F882437B27F8F252"""
+"""9EE01079228806E1_8628BEDDD4C34AE8_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N([S](C)(=O)=O)CCCN""",21,"""F8B782911990EDC9"""
+"""98008587B0754405_2CDD8A7BD43F0546_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N([S](CC)(=O)=O)CCBr""",21,"""F8B782911990EDC9"""
+"""BD5C3E662E9908F7_22517C54C1749BA7_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N(CCNC)[S](=O)(=O)C""",21,"""F8B782911990EDC9"""
+"""5A6139955CC8030C_DE2B4010CA0556AD_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N([S](CCCC)(=O)=O)C""",21,"""F8B782911990EDC9"""
+"""EF8BD7A2706CDDD1_EA38A24D18A52DF2_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N3C(C(C)(C)[S]3(=O)=O)=O""",21,"""F8B782911990EDC9"""
+"""24F6BCB38A763802_FADEB3FFA997743F_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N([S](C)(=O)=O)CCC#C""",21,"""F8B782911990EDC9"""
+"""53434D6D3220FE0E_F39CBD4A47A8599B_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)CCCCl""",21,"""F8B782911990EDC9"""
+"""7084D966384D3028_B260F74E41B8C050_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N([S](CC)(=O)=O)CC#C""",21,"""F8B782911990EDC9"""
+"""8FB76FC6DE8BF2A4_EBB31B18227B3930_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N3[S](CCCC3=O)(=O)=O""",21,"""F8B782911990EDC9"""
+"""871F789295078817_394D8780DD820766_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N3C(C(N)C[S]3(=O)=O)=O""",21,"""F8B782911990EDC9"""
+"""D444E8F89B8584CD_1C84E003836D9AB2_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N([S](C)(=O)=O)C3CNC3""",21,"""F8B782911990EDC9"""
+"""2A8C58D301DA4D58_C6530FF0E18B359D_6036_DP""","""C(C1=NN=N[N]1C2=CC=CC=C2)N[S](=O)(=O)C3(CC3)C#N""",21,"""F8B782911990EDC9"""
+"""6879622F9CBE80DC_D15F56DC3E1AA395_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)CCCN""",21,"""F8B782911990EDC9"""
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+"""4F8ED912F377B8B7_1863A4DA5FF3E735_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)CCOC""",21,"""F8B782911990EDC9"""
+"""02E2FC6ACE0F8538_B6BD39388BC33520_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)CC(=O)C""",21,"""F8B782911990EDC9"""
+"""722964E11112D6F2_3E955F8C4D4D066D_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N3CCCC(C)[S]3(=O)=O""",21,"""F8B782911990EDC9"""
+"""218635F0F6B61AD7_337A796BF4743DC8_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N3CCC(C)(C)[S]3(=O)=O""",21,"""F8B782911990EDC9"""
+"""5F6F5EF16599E50D_08D2D8AAF543CF97_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N([S](CC)(=O)=O)CCN""",21,"""F8B782911990EDC9"""
+"""2767464313BF0016_497F4410CB05C923_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N(CC)[S](=O)(=O)CCN""",21,"""F8B782911990EDC9"""
+"""6884CE600CA88C8A_F3ECEFE5CA133C6E_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)C(C)(C)C""",21,"""F8B782911990EDC9"""
+"""AB2544011ED3E511_7BD4DC8F08BE2952_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N3[S](=O)(=O)C4(CC3)CC4""",21,"""F8B782911990EDC9"""
+"""C8312028722885A9_14F24AB29D38610C_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N([S](CCNC)(=O)=O)C""",21,"""F8B782911990EDC9"""
+"""C8312028722885A9_C802B02464A76A2A_6036_DP""","""C(C1=NN=N[N]1C2=CC=CC=C2)N(C)[S](=O)(=O)CCNC""",21,"""F8B782911990EDC9"""
+"""4AD58D3260C52254_D9BF34C81F9DADF1_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N3[S](CCC3CI)(=O)=O""",21,"""F8B782911990EDC9"""
+"""298759E6F6497D05_45B99F006593A33C_6036_UN""","""C(C1=NN=N[N]1C2=CC=CC=C2)N3C(CN)CC[S]3(=O)=O""",21,"""F8B782911990EDC9"""
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+"""E984E51E20B3FD27_34A84E81EC341A7F_6006_UN""","""CN(C)C(=O)C1=C(C=C(C=C1)C2=CC3=C(C=C2)C=N[NH]3)N""",21,"""F92F2F548FD06412"""
+"""FC189355C8E5426F_901C2D019DED483D_6006_UN""","""CN(C)C(=O)C1=C(C=C(C=C1)C2=CC=C(S2)C(F)(F)F)N""",21,"""F92F2F548FD06412"""
+"""C447F7CFF5B4AB5A_9C9B225DB114F01F_6006_UN""","""OC(=O)C1=C(C(=CC=C1)C2=CC(=C(C(=C2)F)F)F)[N](=O)=O""",21,"""F92FD69684FE208B"""
+"""DFDCE31F62384F94_B19A85CB96E2C523_6006_UN""","""OC(=O)C1=C(C(=CC=C1)C2=CC=C(C(C)C)C=C2)[N](=O)=O""",21,"""F92FD69684FE208B"""
+"""1EBF17ED5186127C_131942FA46FBEEE6_6006_UN""","""OC(=O)C1=C(C(=CC=C1)C2=CC3=C(C=C2)CCC3)[N](=O)=O""",21,"""F92FD69684FE208B"""
+"""1196A51A54F69E03_B3CB023659939444_6006_UN""","""OC(=O)C1=C(C(=CC=C1)C2=CC=CC(=C2)C#CC)[N](=O)=O""",21,"""F92FD69684FE208B"""
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+"""E5D15085230F41CD_3373CA44CBBDE800_6006_UN""","""CN1C(=O)NC(=O)C2=C1[NH]C(=N2)C3=CC(=C(OC)C=C3)C""",21,"""FEFE58E8EE638D2E"""
+"""ADA5401F0C2AE726_2334A50C7CB1879F_6006_UN""","""CN1C(=O)NC(=O)C2=C1[NH]C(=N2)C3=CC=C(C(C)O)C=C3""",21,"""FEFE58E8EE638D2E"""
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+"""70978E1AA56703B4_35E55F36FC07974D_6006_UN""","""CN1C(=O)NC(=O)C2=C1[NH]C(=N2)C3=CC(=CS3)C(F)(F)F""",21,"""FEFE58E8EE638D2E"""
+"""B792BC1AF8A36CD4_B6745DF27DE6A156_6006_UN""","""CN1C(=O)NC(=O)C2=C1[NH]C(=N2)C3=CN=C(N(C)C)N=C3""",21,"""FEFE58E8EE638D2E"""
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+"""4C2253E86B373B5D_33C30E5312C87CF7_6006_UN""","""CN1C(=O)NC(=O)C2=C1[NH]C(=N2)C3=CSC4=C3C=CC=C4""",21,"""FEFE58E8EE638D2E"""
+"""DCE516643E4094EC_4CC5B2E6D5FF0E60_6006_UN""","""CN1C(=O)NC(=O)C2=C1[NH]C(=N2)C3=CC=C[N]4N=CC=C34""",21,"""FEFE58E8EE638D2E"""
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+"""C30A91C488A12357_C8B73D9842A446D8_6006_UN""","""CN1C(=O)NC(=O)C2=C1[NH]C(=N2)C3=CC=C(C=C3)[N](=O)=O""",21,"""FEFE58E8EE638D2E"""
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+"""CBCBE037C1F170EB_39615E47E882544F_6036_UN""","""C(CCCC1=CC(=C(C=C1)Cl)Cl)N2CCCC(C)[S]2(=O)=O""",21,"""FF43835ABC5FBFEB"""
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+"""BFC95CB8ABEC1F0C_DE4B3503BA52FFD3_6036_UN""","""C(CCCC1=CC(=C(C=C1)Cl)Cl)N2[S](CCC2CI)(=O)=O""",21,"""FF43835ABC5FBFEB"""
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+"""15230BB66E01D421_D11A4131B8965C66_6036_UN""","""C(CCCC1=CC(=C(C=C1)Cl)Cl)N(CC(C)C)[S](=O)(=O)C""",21,"""FF43835ABC5FBFEB"""
+"""E8E6749F37471DFE_4D13D49BC19C31B1_6036_UN""","""C(CCCC1=CC(=C(C=C1)Cl)Cl)N2[S](=O)(CCNCC2)=O""",21,"""FF43835ABC5FBFEB"""
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+"""57E33DAA4499DE15_5FF34FC63C08F8E5_6036_UN""","""C(CCCC1=CC(=C(C=C1)Cl)Cl)N2CC3(C[S]2(=O)=O)CC3""",21,"""FF43835ABC5FBFEB"""
+"""14B07A6E20148CD3_93B83CF73457E9A7_6036_UN""","""C(CCCC1=CC(=C(C=C1)Cl)Cl)N([S](C)(=O)=O)C(=O)CN""",21,"""FF43835ABC5FBFEB"""
+"""1C338EDFA62E605A_713B72C1E422D669_6036_UN""","""C(CCCC1=CC(=C(C=C1)Cl)Cl)N2CCCCC[S]2(=O)=O""",21,"""FF43835ABC5FBFEB"""
+"""71B7311CE9801784_6390EE27E66A1835_6036_UN""","""C(CCCC1=CC(=C(C=C1)Cl)Cl)N([S](C)(=O)=O)CCCBr""",21,"""FF43835ABC5FBFEB"""
+"""E31F32E8F4D979FA_3393EF7A5F0E1CE7_6003_UN""","""O(CCCCC1=CC(=C(C=C1)Cl)Cl)C2=CC=C(C=C2)C#N""",21,"""FF43835ABC5FBFEB"""
+"""5B6FA10129C3FA98_0CB315721E96A1C6_6003_UN""","""O(CCCCC1=CC(=C(C=C1)Cl)Cl)C2=CC=CC=C2[N+]#[C-]""",21,"""FF43835ABC5FBFEB"""
+"""921F47C9622AF909_0BE4E0007FDB9C64_6003_UN""","""O(CCCCC1=CC(=C(C=C1)Cl)Cl)C2=CC=CC=C2C#N""",21,"""FF43835ABC5FBFEB"""
+"""C8A64CFC99838281_E3644264E125B518_6003_UN""","""O(CCCCC1=CC(=C(C=C1)Cl)Cl)C2=CC=C(C=C2)[N+]#[C-]""",21,"""FF43835ABC5FBFEB"""
+"""C3E031F359AFDBBF_6D5FC7865E086266_6003_UN""","""O(CCCCC1=CC(=C(C=C1)Cl)Cl)C2=CC=CC(=C2)[N+]#[C-]""",21,"""FF43835ABC5FBFEB"""
+"""E88D9CC034B612B4_81D4AE4201804B90_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN([S](C)(=O)=O)CCCN""",21,"""FF4B920ECCD3ECB1"""
+"""A14694E7AA235072_2B219AE4017C043E_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN([S](CC)(=O)=O)CCBr""",21,"""FF4B920ECCD3ECB1"""
+"""831C1606077BC86F_25AD6CCB14379ADF_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN(CCNC)[S](=O)(=O)C""",21,"""FF4B920ECCD3ECB1"""
+"""985ABD8DB97D6C61_D9D7508F1F4657D5_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN([S](CCCC)(=O)=O)C""",21,"""FF4B920ECCD3ECB1"""
+"""2A26B2F4006D9063_EDC4B2D2CDE62C8A_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN2C(C(C)(C)[S]2(=O)=O)=O""",21,"""FF4B920ECCD3ECB1"""
+"""3424C2EE1EEE8DF4_FD22A3607CD47547_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN([S](C)(=O)=O)CCC#C""",21,"""FF4B920ECCD3ECB1"""
+"""5555452E1A0DF61C_F460ADD592EB58E3_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN(C)[S](=O)(=O)CCCCl""",21,"""FF4B920ECCD3ECB1"""
+"""2A371DD10155028F_B59CE7D194FBC128_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN([S](CC)(=O)=O)CC#C""",21,"""FF4B920ECCD3ECB1"""
+"""7D181CF18B4016CD_EC4F0B87F7383848_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN2[S](CCCC2=O)(=O)=O""",21,"""FF4B920ECCD3ECB1"""
+"""52968469E0ABED23_3EB1971F08C1061E_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN2C(C(N)C[S]2(=O)=O)=O""",21,"""FF4B920ECCD3ECB1"""
+"""85820EBD0934365F_1B78F09C562E9BCA_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN([S](C)(=O)=O)C2CNC2""",21,"""FF4B920ECCD3ECB1"""
+"""8CE4E2C91D6C6289_C1AF1F6F34C834E5_6036_DP""","""CN(C)CCC1=C(C=CC=C1)CN[S](=O)(=O)C2(CC2)C#N""",21,"""FF4B920ECCD3ECB1"""
+"""DB03F8B19215AE94_D6A34643EB59A2ED_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN(C)[S](=O)(=O)CCCN""",21,"""FF4B920ECCD3ECB1"""
+"""8A675E4D5FB9709A_7FBA65A7561D56D2_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN(C)[S](=O)(=O)C2COC2""",21,"""FF4B920ECCD3ECB1"""
+"""993F3F58DE1714AE_1F9FB4458AB0E64D_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN(C)[S](=O)(=O)CCOC""",21,"""FF4B920ECCD3ECB1"""
+"""514BA2AAEA373EE8_B14129A75E803458_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN(C)[S](=O)(=O)CC(=O)C""",21,"""FF4B920ECCD3ECB1"""
+"""F69E57E362184D56_39694F13980E0715_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN2CCCC(C)[S]2(=O)=O""",21,"""FF4B920ECCD3ECB1"""
+"""FC463D5455E552DB_348669F421373CB0_6036_UN""","""CN(C)CCC1=C(C=CC=C1)CN2CCC(C)(C)[S]2(=O)=O""",21,"""FF4B920ECCD3ECB1"""
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+"""B315B6571B8F8F50_39220FCDF8A89A6B_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CC(=C(C=C2)F)OC""",21,"""FFACC07F46376C0A"""
+"""40BF5078B9493FEA_2FFF4C7C3F3D0517_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=C(C=C(C)C=C2C)C""",21,"""FFACC07F46376C0A"""
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+"""2C18354CDBF1495F_04E1FB9167EB08C5_6006_DP""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CC=CC(=C2)C(O)=O""",21,"""FFACC07F46376C0A"""
+"""76896A82FB5750DC_2D4A91A7959918BE_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CC=CC(=C2F)OC""",21,"""FFACC07F46376C0A"""
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+"""5D04B0FCE6364236_8B8D4A3E3C2CABDB_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C3=C2OC=CC2=CC=C3""",21,"""FFACC07F46376C0A"""
+"""91124E758DC512B9_327C4E9B3D529FED_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=C(OC)C=C(C=C2)F""",21,"""FFACC07F46376C0A"""
+"""300B264FB7DB515D_322152D363E90924_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CC(=C(OC)C=C2)C""",21,"""FFACC07F46376C0A"""
+"""B4169714100DF613_22663D9BD4E566BB_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CC=C(C(C)O)C=C2""",21,"""FFACC07F46376C0A"""
+"""3099CEB7B0CDE966_2A428124EBC1219A_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=COC(=C2)C(F)(F)F""",21,"""FFACC07F46376C0A"""
+"""9341F77E1F45800B_34B7C7A154537669_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CC(=CS2)C(F)(F)F""",21,"""FFACC07F46376C0A"""
+"""8EB699EF0CA1EA64_B726C565D5B24072_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CN=C(N(C)C)N=C2""",21,"""FFACC07F46376C0A"""
+"""275D492F3159605F_62A72CF1E3A998B1_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C3=CC2=C(C=CC=N2)S3""",21,"""FFACC07F46376C0A"""
+"""228D3AE2947CD407_D5D2AC4EEBDA9EC9_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=C(C(=CC=C2O)F)F""",21,"""FFACC07F46376C0A"""
+"""E204D800F10FA74D_329196C4BA9C9DD3_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CSC3=C2C=CC=C3""",21,"""FFACC07F46376C0A"""
+"""2A246C167E6E9367_4D972A717DABEF44_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CC=C[N]3N=CC=C23""",21,"""FFACC07F46376C0A"""
+"""4F18C5DD1E4ACF51_F43D03F0FCED04F3_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CN=C(C=C2)C(F)F""",21,"""FFACC07F46376C0A"""
+"""12209B0DDC1378EC_9F26DFFBDE8AF47F_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CC3=C(C=C2)CCO3""",21,"""FFACC07F46376C0A"""
+"""77DF0C4AFF5D15E0_C9E5A50FEAF0A7FC_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CC=C(C=C2)[N](=O)=O""",21,"""FFACC07F46376C0A"""
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+"""280F60CBBA1ABDD5_969FC22A540A4025_6006_UN""","""CNC1=C(C=C(C=C1)C(F)(F)F)C2=CC=C(S2)C(F)(F)F""",21,"""FFACC07F46376C0A"""
+"""1D8557554E2B1C2C_5603D5B335E3914A_2875_UN""","""C[C@H]([N]1N=NC(=C1)CCC#N)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""15EDE6BD87F64827_24B11A1ABE111092_2875_UN""","""C[C@H]([N]1N=NC(=C1)CC(C)O)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""5C6C600F27EC62AC_8F2D21D2B35C9B0A_2875_UN""","""C[C@H]([N]1N=NC(=C1)CN=C=S)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""6B750F64708324CC_A65471DF5C391280_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(CC)N)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""630AC4B2B24817C6_87E2B3F2B46B6E54_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(NC)=O)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""5226D9F1C886DFD3_33E132BD6547C96F_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(C)(C)C)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""554788602BA22330_7E793543EABCE321_2875_UN""","""C[C@H]([N]1N=NC(=C1)CCCN)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""E54DD4CC868B44D6_FC1F4C86227A825C_2875_UN""","""C[C@H]([N]1N=NC(=C1)COCC)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""83AD73EA04FD2D6F_8E3DD6D365123C24_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(C)(C)Cl)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""E7A6C5B8A0D54879_ECD849AC78B32BBF_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(C)(C)Br)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""DF72FFB3FD4E5DE4_8F6E0D3B75F29541_2875_UN""","""C[C@H]([N]1N=NC(=C1)CCCI)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""48B69600C6B7B8CF_BD82153329372EBF_2875_UN""","""C[C@H]([N]1N=NC(=C1)CN=C=O)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""08499888C27D3743_2CC0B9B163026194_2875_UN""","""C[C@H]([N]1N=NC(=C1)COCCl)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""6C55AC1CBEA10EEE_D4FC4BBAA2A3D39C_2875_UN""","""C[C@H]([N]1N=NC(=C1)CC(O)=O)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""B42BF52B11844CD2_0CA9A6C4AAAA2D19_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(N)CO)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""E2B7A161F7DC5D95_45F669C6AFFC2C24_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(OC)=O)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""53E04B268D7A0D29_DB9AD0D24D4AAD2A_2875_UN""","""C[C@H]([N]1N=NC(=C1)CNCC)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""511D793ED1D4BCC7_586450DC84FCEFD3_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(CC)=O)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""0895EE0E17B16FBD_516E49222A503ADD_2875_UN""","""C[C@H]([N]1N=NC(=C1)C2CNC2)C3=CC=C(C=C3)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""AF98796E4C1090A1_0767B4C995CEF4CF_2875_DP""","""C[C@H]([N]1N=NC(=C1)C(N)(C)C)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""E44723296F98A683_DD516C772CFA4B37_2875_UN""","""C[C@H]([N]1N=NC(=C1)C2(C)CC2)C3=CC=C(C=C3)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""1BE61DE348FAA845_24B965A2CDB957D3_2875_UN""","""C[C@H]([N]1N=NC(=C1)C2(N)CC2)C3=CC=C(C=C3)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""393D359A0EFE2151_2BE7A7702C1FDBE2_2875_UN""","""C[C@H]([N]1N=NC(=C1)CCCO)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""AF98796E4C1090A1_529E602C9FDC2566_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(C)(C)N)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""DCD277F25E16C765_D1C75B8DDAE2DA60_2875_UN""","""C[C@H]([N]1N=NC(=C1)CN(C)C)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""F01A5AA45DA2AFED_288B0373B7A7B669_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(CC)O)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""C219C878C2A35C07_846F4EE478A802B4_2875_DP""","""C[C@H]([N]1N=NC(=C1)C2CCN2)C3=CC=C(C=C3)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""C219C878C2A35C07_DA6659FB65C3E510_2875_UN""","""C[C@H]([N]1N=NC(=C1)C2NCC2)C3=CC=C(C=C3)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""AFE2982BB0303C86_3F149CAA62C719A1_2875_UN""","""C[C@H]([N]1N=NC(=C1)[S](C)(=O)=O)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""0B253AB2138ECB43_9D4F4DA3C9605B52_2875_UN""","""C[C@H]([N]1N=NC(=C1)CCNC)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""092967FE33DD25C6_97CB75F34A81755D_2875_UN""","""C[C@H]([N]1N=NC(=C1)CCCC)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""64291DC22E6B8136_C8C3A4EFA6C899EC_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(C)(C)O)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""09A9569BF6000AA1_5EAF7F3A7F7C871B_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(NC)C)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""EE31FBA548B7A970_052CE8A18036EFAB_2875_UN""","""C[C@H]([N]1N=NC(=C1)CCOC)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""27FAD72CA4E8680E_E5B5D994B5FD5CE0_2875_UN""","""C[C@H]([N]1N=NC(=C1)C(OC)C)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""C57947F5F088B2FC_7CD7B4BF58C4FF74_2875_UN""","""C[C@H]([N]1N=NC(=C1)C2(O)CC2)C3=CC=C(C=C3)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""0C53F816DB408895_408E097C17CB8C77_2875_UN""","""C[C@H]([N]1N=NC(=C1)CC(C)N)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""11F4E490691CBC6C_E2B7E5FDB6A2710C_2875_UN""","""C[C@H]([N]1N=NC(=C1)[Si](C)(C)C)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""E10130A587E043B0_C3DC71480F8A5DE4_2875_UN""","""C[C@H]([N]1N=NC(=C1)CCCBr)C2=CC=C(C=C2)C(F)(F)F""",21,"""076C6CD08ADB856E"""
+"""F74AF7A34F6DB05B_41CC6B5895C74640_2875_UN""","""O=[N](=O)C1=C(C=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)CCC#N""",21,"""10A3D23B2AFF5264"""
+"""E23FFB607A438900_337EA4F11E35C798_2875_UN""","""O=[N](=O)C1=C(C=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)CC(C)O""",21,"""10A3D23B2AFF5264"""
+"""C4B4B56EF41DBD98_98E29F3913784C00_2875_UN""","""O=[N](=O)C1=C(C=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)CN=C=S""",21,"""10A3D23B2AFF5264"""
+"""0B8BF5B9967495B3_B19BCF34FC1DC58A_2875_UN""","""O=[N](=O)C1=C(C=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)C(CC)N""",21,"""10A3D23B2AFF5264"""
+"""08538F537FFBA827_902D0D19144FB95E_2875_UN""","""O=[N](=O)C1=C(C=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)C(NC)=O""",21,"""10A3D23B2AFF5264"""
+"""725EFACA4F6A0C07_242E8C56C5631E65_2875_UN""","""O=[N](=O)C1=C(C=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)C(C)(C)C""",21,"""10A3D23B2AFF5264"""
+"""0A594DA9CC3B3764_69B68BA84A98342B_2875_UN""","""O=[N](=O)C1=C(C=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)CCCN""",21,"""10A3D23B2AFF5264"""
+"""99CBDDC42DC996F2_EBD0F26D825E5556_2875_UN""","""O=[N](=O)C1=C(C=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)COCC""",21,"""10A3D23B2AFF5264"""
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+"""2B09B11ABB2C6648_B6D473980739DFE2_2875_UN""","""N3=N[N](C1CC(C1)(C#N)C2=CC=CC=C2)C=C3CCNC""",21,"""2CF752EB448201DE"""
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+"""277F17DFA6576E53_75344101B12503AB_2875_UN""","""N3=N[N](C1CC(C1)(C#N)C2=CC=CC=C2)C=C3C(NC)C""",21,"""2CF752EB448201DE"""
+"""DB53AC9EECA574AC_2EB7D69A4E6F6B1B_2875_UN""","""N3=N[N](C1CC(C1)(C#N)C2=CC=CC=C2)C=C3CCOC""",21,"""2CF752EB448201DE"""
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+"""BEC9CB3C6BFBC946_E8474F73C1D3D954_2875_UN""","""N3=N[N](C1CC(C1)(C#N)C2=CC=CC=C2)C=C3CCCBr""",21,"""2CF752EB448201DE"""
+"""9BC48CA9F56F6AE4_7E87C2CC305CD595_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CCC#N)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""0124FAE664F1239A_0C350D65BBAE544D_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CC(C)O)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""F9776616B2B25384_A7A936ADB6E3DFD5_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CN=C=S)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""78FA99E9948FBE91_8ED066A05986565F_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(CC)N)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""77F1D6041A7DD2BA_AF66A48DB1D42A8B_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(NC)=O)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""695C4CAC28B0DBB9_1B6525C260F88DB0_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(C)(C)C)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""3F9ECFB2C1E05B57_56FD223CEF03A7FE_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CCCN)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""9A032725E45B8F2D_D49B5BF927C5C683_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)COCC)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""50C1C623A3D75B07_A6B9C1AC60AD78FB_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(C)(C)Cl)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""94AA02807BB2370E_C45C5ED37D0C6F60_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(C)(C)Br)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""997CD9B52484B9F9_A7EA1A44704DD19E_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CCCI)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""ADB17E220AB599F2_9506024C2C886A60_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CN=C=O)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""4EA930946A55E289_0444AECE66BD254B_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)COCCl)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""35EC53689FEC4C74_FC785CC5A71C9743_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CC(O)=O)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""CA4ADE3966E84086_242DB1BBAF1569C6_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(N)CO)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""97E8A55FC0F0DAB8_6D727EB9AA4368FB_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(OC)=O)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""3F3990BC6153FD1B_F31EC7AD48F5E9F5_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CNCC)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""F10966AAD3CA6028_70E047A38143AB0C_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(CC)=O)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""063E293853B8D151_79EA5E5D2FEF7E02_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C3CNC3)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""5E116A164D52364F_2FE3A3B69071B010_2875_DP""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(N)(C)C)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""E9736728272DD133_F5D57B0829450FE8_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C3(C)CC3)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""BC230B7C9F772E44_0C3D72DDC806130C_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C3(N)CC3)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""C3E9817484DE57CF_0363B00F29A09F3D_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CCCO)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""5E116A164D52364F_7A1A77539A6361B9_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(C)(C)N)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""01C255BAFE80855C_F9434CF2DF5D9EBF_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CN(C)C)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""40E7784CB65209B0_000F140CB218F2B6_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(CC)O)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""C62FC0C9C8361BF5_ACEB599B7D17466B_2875_DP""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C3CCN3)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""C62FC0C9C8361BF5_F2E24E84607CA1CF_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C3NCC3)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""2618FF60E028B69E_17908BD567785D7E_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)[S](C)(=O)=O)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""7C9A5FE0468F4C11_B5CB5ADCCCDF1F8D_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CCNC)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""99FF195B28FF3BCC_BF4F628C4F3E3182_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CCCC)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""DCF54601FE1044B2_E047B390A377DD33_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(C)(C)O)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""63FB087E88A5A714_762B68457AC3C3C4_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(NC)C)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""26CF627E6316AE8A_2DA8FFDE8589AB74_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CCOC)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""4F0CB3B2199F4D82_CD31CEEBB042183F_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C(OC)C)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""8249D58A3242B060_5453A3C05D7BBBAB_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)C3(O)CC3)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""6C741433DD3A6BC9_680A1E031274C8A8_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CC(C)N)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""4CB3AE2699E0776F_CA33F282B31D35D3_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)[Si](C)(C)C)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""A8B4FD552D46F5FB_EB5866370A35193B_2875_UN""","""FC(F)(F)C1=C(C=CC(=C1)[N]2N=NC(=C2)CCCBr)C#N""",21,"""2FE87BAF8F64C1B1"""
+"""A22DA207BB33A18B_60DA7690FAB831AA_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3CCC#N""",21,"""31B5CFF34580258E"""
+"""778B33B2230616DE_1268B939714AB072_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3CC(C)O""",21,"""31B5CFF34580258E"""
+"""C99D623C8CC3FE2E_B9F482F17C073BEA_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3CN=C=S""",21,"""31B5CFF34580258E"""
+"""EE3DA928DD3E4047_908DD2FC9362B260_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3C(CC)N""",21,"""31B5CFF34580258E"""
+"""DB7D79B633DA01AE_B13B10D17B30CEB4_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3C(NC)=O""",21,"""31B5CFF34580258E"""
+"""ADF2AEEB398B7D33_0538919EAA1C698F_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3C(C)(C)C""",21,"""31B5CFF34580258E"""
+"""92F2F9DB0CE4F524_48A0966025E743C1_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3CCCN""",21,"""31B5CFF34580258E"""
+"""A6B3842A2E0BD3E3_CAC6EFA5ED2122BC_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3COCC""",21,"""31B5CFF34580258E"""
+"""0649DE9A69995255_B8E475F0AA499CC4_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3C(C)(C)Cl""",21,"""31B5CFF34580258E"""
+"""3F8EE2E8D7090D77_DA01EA8FB7E88B5F_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3C(C)(C)Br""",21,"""31B5CFF34580258E"""
+"""FE579EEC2CFBB418_B9B7AE18BAA935A1_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3CCCI""",21,"""31B5CFF34580258E"""
+"""77CFAEF91ADABFAE_8B5BB610E66C8E5F_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3CN=C=O""",21,"""31B5CFF34580258E"""
+"""E92D5B7CFCF27641_1A191A92AC59C174_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3COCCl""",21,"""31B5CFF34580258E"""
+"""D41394780D1C0651_E225E8996DF8737C_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3CC(O)=O""",21,"""31B5CFF34580258E"""
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+"""C1E9AFA8FDF01414_1D3E0453E3447B02_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3CCCO""",21,"""31B5CFF34580258E"""
+"""55AC399806A2AF26_6447C30F50878586_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3C(C)(C)N""",21,"""31B5CFF34580258E"""
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+"""85522626FCD9C942_1E52A05078FC1689_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3C(CC)O""",21,"""31B5CFF34580258E"""
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+"""2FC86A66C522B71F_6876DC19B02727FB_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3C(NC)C""",21,"""31B5CFF34580258E"""
+"""1A058823DA6D93E4_33F54B824F6D4F4B_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3CCOC""",21,"""31B5CFF34580258E"""
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+"""A24EAD3B6281224C_D46E46DE79F9D1EC_2875_UN""","""N3=N[N]([S](=O)(=O)C1=CC2=C(C=C1)OCC2)C=C3[Si](C)(C)C""",21,"""31B5CFF34580258E"""
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+"""29AEFA0AA50A222E_679B4B962AAA1A48_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CCC#N)C3=O""",21,"""36F4F2F595920E6C"""
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+"""5D9B958D9428A5D5_BEB5BFF7AC151008_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CN=C=S)C3=O""",21,"""36F4F2F595920E6C"""
+"""FC75A77D57E3891B_97CCEFFA43709982_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(CC)N)C3=O""",21,"""36F4F2F595920E6C"""
+"""19B292E4C615C438_B67A2DD7AB22E556_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(NC)=O)C3=O""",21,"""36F4F2F595920E6C"""
+"""D19AACE4283E3CE0_0279AC987A0E426D_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(C)(C)C)C3=O""",21,"""36F4F2F595920E6C"""
+"""6DC22577DBA4DA31_4FE1AB66F5F56823_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CCCN)C3=O""",21,"""36F4F2F595920E6C"""
+"""E813D30A8AA25EC2_CD87D2A33D33095E_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)COCC)C3=O""",21,"""36F4F2F595920E6C"""
+"""02527764467AFDEA_BFA548F67A5BB726_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(C)(C)Cl)C3=O""",21,"""36F4F2F595920E6C"""
+"""4D5C816159E0CF4B_DD40D78967FAA0BD_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(C)(C)Br)C3=O""",21,"""36F4F2F595920E6C"""
+"""214C401F9C2D9226_BEF6931E6ABB1E43_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CCCI)C3=O""",21,"""36F4F2F595920E6C"""
+"""560193B9982349F0_8C1A8B16367EA5BD_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CN=C=O)C3=O""",21,"""36F4F2F595920E6C"""
+"""E85E3EC606DE0A8B_1D5827947C4BEA96_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)COCCl)C3=O""",21,"""36F4F2F595920E6C"""
+"""C2B52C81378D37B3_E564D59FBDEA589E_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CC(O)=O)C3=O""",21,"""36F4F2F595920E6C"""
+"""0A2D462B263F76E8_3D3138E1B5E3A61B_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(N)CO)C3=O""",21,"""36F4F2F595920E6C"""
+"""A1AB7E758296EFB7_746EF7E3B0B5A726_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(OC)=O)C3=O""",21,"""36F4F2F595920E6C"""
+"""D2C230EEA4CEA1BE_EA024EF752032628_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CNCC)C3=O""",21,"""36F4F2F595920E6C"""
+"""5DA6B50A3BE9E09B_69FCCEF99BB564D1_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(CC)=O)C3=O""",21,"""36F4F2F595920E6C"""
+"""06183E7B97298B42_60F6D7073519B1DF_2875_DP""","""N1CCC(CC1)N4CCC([N]2N=NC(=C2)C3CNC3)C4=O""",21,"""36F4F2F595920E6C"""
+"""5A57FC5D0BDEB6C7_36FF2AEC8A877FCD_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(N)(C)C)C3=O""",21,"""36F4F2F595920E6C"""
+"""C8E70980ECC8B603_ECC9F25233B3C035_2875_DP""","""N1CCC(CC1)N4CCC([N]2N=NC(=C2)C3(C)CC3)C4=O""",21,"""36F4F2F595920E6C"""
+"""38A08352F041BE4C_1521FB87D2F0DCD1_2875_DP""","""N1CCC(CC1)N4CCC([N]2N=NC(=C2)C3(N)CC3)C4=O""",21,"""36F4F2F595920E6C"""
+"""147A38BA83B1629D_1A7F3955335650E0_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CCCO)C3=O""",21,"""36F4F2F595920E6C"""
+"""5A57FC5D0BDEB6C7_6306FE098095AE64_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(C)(C)N)C3=O""",21,"""36F4F2F595920E6C"""
+"""CA754C2D03EFA9CF_E05FC5A8C5AB5162_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CN(C)C)C3=O""",21,"""36F4F2F595920E6C"""
+"""BF4D1A9E451E6BE2_19139D56A8EE3D6B_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(CC)O)C3=O""",21,"""36F4F2F595920E6C"""
+"""2A84B36AD2FE7A9B_B5F7D0C167E189B6_2875_DP""","""N1CCC(CC1)N4CCC([N]2N=NC(=C2)C3CCN3)C4=O""",21,"""36F4F2F595920E6C"""
+"""2A84B36AD2FE7A9B_EBFEC7DE7A8A6E12_2875_DP""","""N1CCC(CC1)N4CCC([N]2N=NC(=C2)C3NCC3)C4=O""",21,"""36F4F2F595920E6C"""
+"""6E45EFD4DDCC016F_0E8C028F7D8E92A3_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)[S](C)(=O)=O)C3=O""",21,"""36F4F2F595920E6C"""
+"""177724695F7C6A42_ACD7D386D629D050_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CCNC)C3=O""",21,"""36F4F2F595920E6C"""
+"""FB6B42E9C3DBC648_A653EBD655C8FE5F_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CCCC)C3=O""",21,"""36F4F2F595920E6C"""
+"""7CFFB853FD509AAA_F95B3ACAB98112EE_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(C)(C)O)C3=O""",21,"""36F4F2F595920E6C"""
+"""6A265728D54A71E5_6F37E11F60350C19_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(NC)C)C3=O""",21,"""36F4F2F595920E6C"""
+"""FFFFBF9EFF9BD949_34B476849F7F64A9_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CCOC)C3=O""",21,"""36F4F2F595920E6C"""
+"""59846FFFE48D7D3C_D42D47B1AAB4D7E2_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)C(OC)C)C3=O""",21,"""36F4F2F595920E6C"""
+"""B15356226CD5B420_4D4F2A9A478D7476_2875_DP""","""N1CCC(CC1)N4CCC([N]2N=NC(=C2)C3(O)CC3)C4=O""",21,"""36F4F2F595920E6C"""
+"""55C7A0B3892F0E37_7116975908820775_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CC(C)N)C3=O""",21,"""36F4F2F595920E6C"""
+"""760525F6D7AC253D_D32F7BD8A9EBFA0E_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)[Si](C)(C)C)C3=O""",21,"""36F4F2F595920E6C"""
+"""AFADF8FD71D68077_F244EF6D10C3D6E6_2875_DP""","""N1CCC(CC1)N3CCC([N]2N=NC(=C2)CCCBr)C3=O""",21,"""36F4F2F595920E6C"""
+"""8F6DF7EF71EB65C6_6FE9D5CD371B2364_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3CCC#N""",21,"""3E866CAE88233740"""
+"""BD6081BD59EA38D9_1D5B1A64BCE9A2BC_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3CC(C)O""",21,"""3E866CAE88233740"""
+"""0618AA12802ECA03_B6C721ACB1A42924_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3CN=C=S""",21,"""3E866CAE88233740"""
+"""171B65204A3A84C3_9FBE71A15EC1A0AE_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(CC)N""",21,"""3E866CAE88233740"""
+"""9D58260561BDE08F_BE08B38CB693DC7A_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(NC)=O""",21,"""3E866CAE88233740"""
+"""42133294C358AFE0_0A0B32C367BF7B41_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(C)(C)C""",21,"""3E866CAE88233740"""
+"""3C06891939AB17DF_4793353DE844510F_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3CCCN""",21,"""3E866CAE88233740"""
+"""7357145E9E084AC1_C5F54CF820823072_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3COCC""",21,"""3E866CAE88233740"""
+"""A398BBCEACC474E3_B7D7D6AD67EA8E0A_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(C)(C)Cl""",21,"""3E866CAE88233740"""
+"""2AB5D80866302B7F_D53249D27A4B9991_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(C)(C)Br""",21,"""3E866CAE88233740"""
+"""FA7C8A8D12035E09_B6840D45770A276F_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3CCCI""",21,"""3E866CAE88233740"""
+"""8E3277491DBB44C9_8468154D2BCF9C91_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3CN=C=O""",21,"""3E866CAE88233740"""
+"""88EEBF300E5B913C_152AB9CF61FAD3BA_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3COCCl""",21,"""3E866CAE88233740"""
+"""7525925EB6AAF7BE_ED164BC4A05B61B2_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3CC(O)=O""",21,"""3E866CAE88233740"""
+"""BA3E1C08EEC71865_3543A6BAA8529F37_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(N)CO""",21,"""3E866CAE88233740"""
+"""489C6E2419FFAE85_7C1C69B8AD049E0A_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(OC)=O""",21,"""3E866CAE88233740"""
+"""734432C5D17570BE_E270D0AC4FB21F04_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3CNCC""",21,"""3E866CAE88233740"""
+"""3D892E307A68EA89_618E50A286045DFD_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(CC)=O""",21,"""3E866CAE88233740"""
+"""F4C1708712919055_6884495C28A888F3_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C4CNC4""",21,"""3E866CAE88233740"""
+"""2AC01C61E17512B1_3E8DB4B7973646E1_2875_DP""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(N)(C)C""",21,"""3E866CAE88233740"""
+"""BC9C1D26AF2689B0_E4BB6C092E02F919_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C4(C)CC4""",21,"""3E866CAE88233740"""
+"""BD3FB961A012AF93_1D5365DCCF41E5FD_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C4(N)CC4""",21,"""3E866CAE88233740"""
+"""6448C50A0D78103A_120DA70E2EE769CC_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3CCCO""",21,"""3E866CAE88233740"""
+"""2AC01C61E17512B1_6B7460529D249748_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(C)(C)N""",21,"""3E866CAE88233740"""
+"""48D3EAF9B7718B9C_E82D5BF3D81A684E_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3CN(C)C""",21,"""3E866CAE88233740"""
+"""1D273EA9C3A7EA7B_1161030DB55F0447_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C(CC)O""",21,"""3E866CAE88233740"""
+"""310CE0DEEF7EFA31_BD854E9A7A50B09A_2875_DP""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C4CCN4""",21,"""3E866CAE88233740"""
+"""310CE0DEEF7EFA31_E38C5985673B573E_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3C4NCC4""",21,"""3E866CAE88233740"""
+"""3172754E2EF8129E_06FE9CD4603FAB8F_2875_UN""","""N3=N[N](CC1=CC(=NO1)C2CCNCC2)C=C3[S](C)(=O)=O""",21,"""3E866CAE88233740"""
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+"""451E0123404A7375_12BA1198C570ED5C_2875_UN""","""OC(=O)C1=CC(=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)C(OC)=O""",21,"""5020148EE0574416"""
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+"""627FF2E3BF04CE1F_0622317C40DCFBA5_2875_UN""","""OC(=O)C1=CC(=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)C3CNC3""",21,"""5020148EE0574416"""
+"""6D1EDEE8C2DB753C_502BCC97FF4235B7_2875_DP""","""OC(=O)C1=CC(=CC=C1)[S](=O)(=O)[N]2N=NC(=C2)C(N)(C)C""",21,"""5020148EE0574416"""
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+"""676223DCEBD6DF07_40A4CADF9C607CC5_2875_UN""","""N3=N[N](CC1=C[N](N=C1)C2=CC=CC=C2)C=C3C(C)(C)C""",21,"""742994B273FC30C4"""
+"""A33C982DE71E65C8_0D3CCD21139B568B_2875_UN""","""N3=N[N](CC1=C[N](N=C1)C2=CC=CC=C2)C=C3CCCN""",21,"""742994B273FC30C4"""
+"""A8E8CBC509E37324_8F5AB4E4DB5D37F6_2875_UN""","""N3=N[N](CC1=C[N](N=C1)C2=CC=CC=C2)C=C3COCC""",21,"""742994B273FC30C4"""
+"""A2A656014A3C5112_FD782EB19C35898E_2875_UN""","""N3=N[N](CC1=C[N](N=C1)C2=CC=CC=C2)C=C3C(C)(C)Cl""",21,"""742994B273FC30C4"""
+"""407031614224EE79_9F9DB1CE81949E15_2875_UN""","""N3=N[N](CC1=C[N](N=C1)C2=CC=CC=C2)C=C3C(C)(C)Br""",21,"""742994B273FC30C4"""
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+"""554B337FA16935B6_EE81A2BF5D084679_2875_DP""","""N1CCC(CC1)C2=NOC(=C2)C[N]3N=NC(=C3)CC(C)N""",21,"""A963C713C0184F60"""
+"""F95D0F4C01C68CA4_4CB84E3EFC61BB02_2875_DP""","""N1CCC(CC1)C2=NOC(=C2)C[N]3N=NC(=C3)[Si](C)(C)C""",21,"""A963C713C0184F60"""
+"""D7F4A3161F4EC803_6DD3DA8B454997EA_2875_DP""","""N1CCC(CC1)C2=NOC(=C2)C[N]3N=NC(=C3)CCCBr""",21,"""A963C713C0184F60"""
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+"""4CCCB7E7B2C8716A_0A573B9F79CD5C89_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3C(CC)N""",21,"""AB6F2690AF2FCB67"""
+"""DDCEEBEE334462C5_2BE1F9B2919F205D_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3C(NC)=O""",21,"""AB6F2690AF2FCB67"""
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+"""AF415FE5458A0016_D27A7F03CF48AD28_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3CCCN""",21,"""AB6F2690AF2FCB67"""
+"""AE429DEB1AFA8F67_501C06C6078ECC55_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3COCC""",21,"""AB6F2690AF2FCB67"""
+"""7035F7FAAB7189DE_223E9C9340E6722D_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3C(C)(C)Cl""",21,"""AB6F2690AF2FCB67"""
+"""928AF95CD6ED1831_40DB03EC5D4765B6_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3C(C)(C)Br""",21,"""AB6F2690AF2FCB67"""
+"""0A9168A9A423FD4E_236D477B5006DB48_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3CCCI""",21,"""AB6F2690AF2FCB67"""
+"""722BD606143E90A6_11815F730CC360B6_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3CN=C=O""",21,"""AB6F2690AF2FCB67"""
+"""5F3D2D793C195E1C_80C3F3F146F62F9D_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3COCCl""",21,"""AB6F2690AF2FCB67"""
+"""95B6525F15C2A90A_78FF01FA87579D95_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3CC(O)=O""",21,"""AB6F2690AF2FCB67"""
+"""63FB7031AC9EC5CB_A0AAEC848F5E6310_2875_UN""","""N3=N[N](CN2C(=O)C1=C(C=CC=C1)C2=O)C=C3C(N)CO""",21,"""AB6F2690AF2FCB67"""
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+"""C16F04B12D68FFD8_BA291480015EE81A_2875_UN""","""N3=N[N](CC1=CC=C(C=C1)[N]2C=CC=N2)C=C3C(NC)C""",21,"""E3EA076AF4F9EA6F"""
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+"""5B765BB1143E310C_0133B22ECBDF33E1_2875_UN""","""N3=N[N](CC1=CC=C(C=C1)[N]2C=CC=N2)C=C3C(OC)C""",21,"""E3EA076AF4F9EA6F"""
+"""DB2C906CCE3EC9CD_9851DF0526E69075_2875_UN""","""N3=N[N](CC1=CC=C(C=C1)[N]2C=CC=N2)C=C3C4(O)CC4""",21,"""E3EA076AF4F9EA6F"""
+"""CD0C5D794A7697FA_A40862C669E9E376_2875_UN""","""N3=N[N](CC1=CC=C(C=C1)[N]2C=CC=N2)C=C3CC(C)N""",21,"""E3EA076AF4F9EA6F"""
+"""8BCC6916D4951A3A_06318E47C8801E0D_2875_UN""","""N3=N[N](CC1=CC=C(C=C1)[N]2C=CC=N2)C=C3[Si](C)(C)C""",21,"""E3EA076AF4F9EA6F"""
+"""5BDB3C7FE4941410_275A1AF271A832E5_2875_UN""","""N3=N[N](CC1=CC=C(C=C1)[N]2C=CC=N2)C=C3CCCBr""",21,"""E3EA076AF4F9EA6F"""
+"""AF18F32845FBB845_BD9FB2A73030FD07_2875_UN""","""FC1=CC2=C(C(=C1)F)CCC[C@H]2[N]3N=NC(=C3)CCC#N""",21,"""ECF00BC48F08E923"""
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+"""F7F281F9008F5B3C_4DC816CB59EA7ECD_2875_UN""","""FC1=CC2=C(C(=C1)F)CCC[C@H]2[N]3N=NC(=C3)C(CC)N""",21,"""ECF00BC48F08E923"""
+"""A0B1F828432C55D8_6C7ED4E6B1B80219_2875_UN""","""FC1=CC2=C(C(=C1)F)CCC[C@H]2[N]3N=NC(=C3)C(NC)=O""",21,"""ECF00BC48F08E923"""
+"""72057293341D2BFA_D87D55A96094A522_2875_UN""","""FC1=CC2=C(C(=C1)F)CCC[C@H]2[N]3N=NC(=C3)C(C)(C)C""",21,"""ECF00BC48F08E923"""
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+"""BA3E5C84521E3B0A_EEB08FB585E583E6_2875_UN""","""FC1=CC2=C(C(=C1)F)CCC[C@H]2[N]3N=NC(=C3)CCOC""",21,"""ECF00BC48F08E923"""
+"""E5539B0D52E8F656_0E29BE80B02E30AD_2875_UN""","""FC1=CC2=C(C(=C1)F)CCC[C@H]2[N]3N=NC(=C3)C(OC)C""",21,"""ECF00BC48F08E923"""
+"""22D34DA93A643C52_974BD3AB5D179339_2875_UN""","""FC1=CC2=C(C(=C1)F)CCC[C@H]2[N]3N=NC(=C3)C4(O)CC4""",21,"""ECF00BC48F08E923"""
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+"""0674DF6563561E6E_092B82E9B3711D41_2875_UN""","""FC1=CC2=C(C(=C1)F)CCC[C@H]2[N]3N=NC(=C3)[Si](C)(C)C""",21,"""ECF00BC48F08E923"""
+"""803FDB0C56218461_2840165C0A5931A9_2875_UN""","""FC1=CC2=C(C(=C1)F)CCC[C@H]2[N]3N=NC(=C3)CCCBr""",21,"""ECF00BC48F08E923"""
+"""F9303B8C764C0098_A01FD852B4474FA8_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CCC#N""",21,"""F17061310B7F5B8C"""
+"""E35C744B920FA83E_D2AD17FB3FB5CE70_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CC(C)O""",21,"""F17061310B7F5B8C"""
+"""3D2735035E05F155_79312C3332F845E8_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CN=C=S""",21,"""F17061310B7F5B8C"""
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+"""D4CB0D0CDA34872F_C5FD3F5CE4E3178D_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(C)(C)C""",21,"""F17061310B7F5B8C"""
+"""74096C8FFA77CDD9_886538A26B183DC3_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CCCN""",21,"""F17061310B7F5B8C"""
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+"""D3FA5C4BF8F1A6A6_7821DB32E4B6E2C6_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(C)(C)Cl""",21,"""F17061310B7F5B8C"""
+"""3C856E119A9B0ABD_1AC4444DF917F55D_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(C)(C)Br""",21,"""F17061310B7F5B8C"""
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+"""A82BC1B1551D8EF6_DADCB450E2A6BF76_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)COCCl""",21,"""F17061310B7F5B8C"""
+"""6A207E322CE1196B_22E0465B23070D7E_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CC(O)=O""",21,"""F17061310B7F5B8C"""
+"""C5064E48609A25AA_FAB5AB252B0EF3FB_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(N)CO""",21,"""F17061310B7F5B8C"""
+"""8B8C636299828B15_B3EA64272E58F2C6_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(OC)=O""",21,"""F17061310B7F5B8C"""
+"""3FCFC60286894A4C_2D86DD33CCEE73C8_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CNCC""",21,"""F17061310B7F5B8C"""
+"""FD2FAE7724784667_AE785D3D05583131_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(CC)=O""",21,"""F17061310B7F5B8C"""
+"""6B9E6E06FA1F3D4B_A77244C3ABF4E43F_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C2CNC2""",21,"""F17061310B7F5B8C"""
+"""6DCF6904A238AF2D_F17BB928146A2A2D_2875_DP""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(N)(C)C""",21,"""F17061310B7F5B8C"""
+"""4B573D1CF20BAB4B_2B4D6196AD5E95D5_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C2(C)CC2""",21,"""F17061310B7F5B8C"""
+"""46A9704D4DF68EF7_D2A568434C1D8931_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C2(N)CC2""",21,"""F17061310B7F5B8C"""
+"""0303257AB30F6C98_DDFBAA91ADBB0500_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CCCO""",21,"""F17061310B7F5B8C"""
+"""6DCF6904A238AF2D_A4826DCD1E78FB84_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(C)(C)N""",21,"""F17061310B7F5B8C"""
+"""716F8BA16514AED2_27DB566C5B460482_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CN(C)C""",21,"""F17061310B7F5B8C"""
+"""96F69B648FC3A9C1_DE970E923603688B_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(CC)O""",21,"""F17061310B7F5B8C"""
+"""C743DA7C100BCD2A_72734305F90CDC56_2875_DP""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C2CCN2""",21,"""F17061310B7F5B8C"""
+"""C743DA7C100BCD2A_2C7A541AE4673BF2_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C2NCC2""",21,"""F17061310B7F5B8C"""
+"""282F6275B2A199BF_C908914BE363C743_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)[S](C)(=O)=O""",21,"""F17061310B7F5B8C"""
+"""375F45C17290C29D_6B53404248C485B0_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CCNC""",21,"""F17061310B7F5B8C"""
+"""E0E51DB81402899D_61D77812CB25ABBF_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CCCC""",21,"""F17061310B7F5B8C"""
+"""E890F11CF60E1241_3EDFA90E276C470E_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(C)(C)O""",21,"""F17061310B7F5B8C"""
+"""E3850845FF15F488_A8B372DBFED859F9_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(NC)C""",21,"""F17061310B7F5B8C"""
+"""47D299F30F226343_F330E54001923149_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CCOC""",21,"""F17061310B7F5B8C"""
+"""5534F22A1DD3ACA7_13A9D47534598202_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C(OC)C""",21,"""F17061310B7F5B8C"""
+"""A1FA7B5F355EE8EF_8ACBB95ED9602196_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)C2(O)CC2""",21,"""F17061310B7F5B8C"""
+"""F06EF0B56CBCFC8F_B692049D966F5295_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CC(C)N""",21,"""F17061310B7F5B8C"""
+"""AE9038EBC40DCE7F_14ABE81C3706AFEE_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)[Si](C)(C)C""",21,"""F17061310B7F5B8C"""
+"""FD14B3CC9AD80A41_35C07CA98E2E8306_2875_UN""","""OC(=O)CCCCCCCCC[N]1N=NC(=C1)CCCBr""",21,"""F17061310B7F5B8C"""
+"""3C38CC1D1E1E8B31_A01BA47E4027D711_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CCC#N""",21,"""F1741D1DFF1FC335"""
+"""381C0A516D24F7E1_D2A96BD7CBD556C9_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CC(C)O""",21,"""F1741D1DFF1FC335"""
+"""EDCCA2B79D1B5626_7935501FC698DD51_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CN=C=S""",21,"""F1741D1DFF1FC335"""
+"""FFDD7043ACDB402F_504C001229FD54DB_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(CC)N""",21,"""F1741D1DFF1FC335"""
+"""A6349DDC7E817A33_71FAC23FC1AF280F_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(NC)=O""",21,"""F1741D1DFF1FC335"""
+"""55F8506E4B509FA2_C5F9437010838F34_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(C)(C)C""",21,"""F1741D1DFF1FC335"""
+"""168AC104551E7BDD_8861448E9F78A57A_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CCCN""",21,"""F1741D1DFF1FC335"""
+"""F0ADFC9C1F197621_0A073D4B57BEC407_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)COCC""",21,"""F1741D1DFF1FC335"""
+"""1FDB36A388600DB3_7825A71E10D67A7F_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(C)(C)Cl""",21,"""F1741D1DFF1FC335"""
+"""9EF4CA5619BE942C_1AC038610D776DE4_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(C)(C)Br""",21,"""F1741D1DFF1FC335"""
+"""BD966171800DA017_79767CF60036D31A_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CCCI""",21,"""F1741D1DFF1FC335"""
+"""B8E86B48F8C8FDEE_4B9A64FE5CF368E4_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CN=C=O""",21,"""F1741D1DFF1FC335"""
+"""419A72BF3F25AEFA_DAD8C87C16C627CF_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)COCCl""",21,"""F1741D1DFF1FC335"""
+"""CCDB9E6E4E0A0B98_22E43A77D76795C7_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CC(O)=O""",21,"""F1741D1DFF1FC335"""
+"""A8929B9B443BDA41_FAB1D709DF6E6B42_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(N)CO""",21,"""F1741D1DFF1FC335"""
+"""4DE5C4FCF467180C_B3EE180BDA386A7F_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(OC)=O""",21,"""F1741D1DFF1FC335"""
+"""CF46C0EF17B79C39_2D82A11F388EEB71_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CNCC""",21,"""F1741D1DFF1FC335"""
+"""F159781F1A195FF4_AE7C2111F138A988_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(CC)=O""",21,"""F1741D1DFF1FC335"""
+"""FD4EFAD099A33667_A77638EF5F947C86_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C2CNC2""",21,"""F1741D1DFF1FC335"""
+"""A3C2899E3243D28F_F17FC504E00AB294_2875_DP""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(N)(C)C""",21,"""F1741D1DFF1FC335"""
+"""AD2E51D7E697C2D9_2B491DBA593E0D6C_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C2(C)CC2""",21,"""F1741D1DFF1FC335"""
+"""1FCE8F9BD9D540B0_D2A1146FB87D1188_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C2(N)CC2""",21,"""F1741D1DFF1FC335"""
+"""A40A4E8BD5CF3906_DDFFD6BD59DB9DB9_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CCCO""",21,"""F1741D1DFF1FC335"""
+"""A3C2899E3243D28F_A48611E1EA18633D_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(C)(C)N""",21,"""F1741D1DFF1FC335"""
+"""6D646AAFC8061FAF_27DF2A40AF269C3B_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CN(C)C""",21,"""F1741D1DFF1FC335"""
+"""639462B3523611AC_DE9372BEC263F032_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(CC)O""",21,"""F1741D1DFF1FC335"""
+"""212CF279A0C05F55_72773F290D6C44EF_2875_DP""","""CCCCCCCCCCCC[N]1N=NC(=C1)C2CCN2""",21,"""F1741D1DFF1FC335"""
+"""212CF279A0C05F55_2C7E28361007A34B_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C2NCC2""",21,"""F1741D1DFF1FC335"""
+"""366DC081F728F0BC_C90CED6717035FFA_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)[S](C)(=O)=O""",21,"""F1741D1DFF1FC335"""
+"""458FF89D85055B0B_6B573C6EBCA41D09_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CCNC""",21,"""F1741D1DFF1FC335"""
+"""C803876B4B21BEA6_61D3043E3F453306_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CCCC""",21,"""F1741D1DFF1FC335"""
+"""DDE803849737DE56_3EDBD522D30CDFB7_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(C)(C)O""",21,"""F1741D1DFF1FC335"""
+"""21AEDAC7CB05542E_A8B70EF70AB8C140_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(NC)C""",21,"""F1741D1DFF1FC335"""
+"""94798AFF501D1086_F334996CF5F2A9F0_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CCOC""",21,"""F1741D1DFF1FC335"""
+"""1326DE192C0914F7_13ADA859C0391ABB_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C(OC)C""",21,"""F1741D1DFF1FC335"""
+"""58E96019F1B6E357_8ACFC5722D00B92F_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)C2(O)CC2""",21,"""F1741D1DFF1FC335"""
+"""4E683E52852A049E_B69678B1620FCA2C_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CC(C)N""",21,"""F1741D1DFF1FC335"""
+"""7F44089A44E56731_14AF9430C3663757_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)[Si](C)(C)C""",21,"""F1741D1DFF1FC335"""
+"""507F2A9492963743_35C400857A4E1BBF_2875_UN""","""CCCCCCCCCCCC[N]1N=NC(=C1)CCCBr""",21,"""F1741D1DFF1FC335"""
+"""B519CB57D780C9A2_A21C2A301A15B4E2_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CCC#N)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""6EFADCFDA8C2C116_D0AEE59991E7353A_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CC(C)O)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""CD61F8CF14B38DFB_7B32DE519CAABEA2_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CN=C=S)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""42C4433D0FC05F52_524B8E5C73CF3728_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(CC)N)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""A1B1AE906294F3E2_73FD4C719B9D4BFC_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(NC)=O)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""9E6AFA4901D8F1F7_C7FECD3E4AB1ECC7_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(C)(C)C)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""B9512083746AE0EF_8A66CAC0C54AC689_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CCCN)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""9E868E26055C6262_0800B3050D8CA7F4_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)COCC)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""AD0DAA4A09C44309_7A2229504AE4198C_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(C)(C)Cl)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""8FA8A627ABAAD945_18C7B62F57450E17_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(C)(C)Br)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""74C534463927CA2D_7B71F2B85A04B0E9_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CCCI)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""F04EC4FA5F11FC4A_499DEAB006C10B17_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CN=C=O)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""D65267438B354485_D8DF46324CF4443C_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)COCCl)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""57C0344553363455_20E3B4398D55F634_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CC(O)=O)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""9D4A7E0E07605A0F_F8B65947855C08B1_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(N)CO)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""5852D9B61CA43918_B1E99645800A098C_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(OC)=O)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""542B4E4F9FDDDEEB_2F852F5162BC8882_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CNCC)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""EE06F3DDE69B0D2E_AC7BAF5FAB0ACA7B_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(CC)=O)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""BA987CC7F60D8A31_A571B6A105A61F75_2875_UN""","""CCOC(=O)C34CC(C[N]1N=NC(=C1)C2CNC2)(C3)OC4""",21,"""F3739353A52DA0C6"""
+"""63D7388622409FDD_F3784B4ABA38D167_2875_DP""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(N)(C)C)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""D8878E95FDACB8F0_294E93F4030C6E9F_2875_UN""","""CCOC(=O)C34CC(C[N]1N=NC(=C1)C2(C)CC2)(C3)OC4""",21,"""F3739353A52DA0C6"""
+"""CCB95AACF1FE3862_D0A69A21E24F727B_2875_UN""","""CCOC(=O)C34CC(C[N]1N=NC(=C1)C2(N)CC2)(C3)OC4""",21,"""F3739353A52DA0C6"""
+"""1C28C0B9FF5AC225_DFF858F303E9FE4A_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CCCO)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""63D7388622409FDD_A6819FAFB02A00CE_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(C)(C)N)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""A47E61B6E6419654_25D8A40EF514FFC8_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CN(C)C)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""F0C50961C3C5D98A_DC94FCF0985193C1_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(CC)O)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""3C87FECEF85E42E6_7070B167575E271C_2875_DP""","""CCOC(=O)C34CC(C[N]1N=NC(=C1)C2CCN2)(C3)OC4""",21,"""F3739353A52DA0C6"""
+"""3C87FECEF85E42E6_2E79A6784A35C0B8_2875_UN""","""CCOC(=O)C34CC(C[N]1N=NC(=C1)C2NCC2)(C3)OC4""",21,"""F3739353A52DA0C6"""
+"""9B59E1A84FA8C4DA_CB0B63294D313C09_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)[S](C)(=O)=O)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""8DF9C61FA0FE346D_6950B220E6967EFA_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CCNC)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""0E5D3EB246F5F7FE_63D48A70657750F5_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CCCC)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""7ACCD501B126A528_3CDC5B6C893EBC44_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(C)(C)O)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""7DF70A277D953ED5_AAB080B9508AA2B3_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(NC)C)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""D7748F3FA530AF62_F1331722AFC0CA03_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CCOC)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""D517C0B2EDC0BFE0_11AA26179A0B7948_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)C(OC)C)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""69AE2B5A2BDB9887_88C84B3C7732DADC_2875_UN""","""CCOC(=O)C34CC(C[N]1N=NC(=C1)C2(O)CC2)(C3)OC4""",21,"""F3739353A52DA0C6"""
+"""55B173A11FB2AC9A_B491F6FF383DA9DF_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CC(C)N)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""90C1FFE5EB0DADDD_16A81A7E995454A4_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)[Si](C)(C)C)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""8C19D77224D002C2_37C38ECB207C784C_2875_UN""","""CCOC(=O)C23CC(C[N]1N=NC(=C1)CCCBr)(C2)OC3""",21,"""F3739353A52DA0C6"""
+"""1E178C479C7ADB5B_AB49BFF2FFEDBAEC_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CCC#N""",21,"""FA26069140D5AEC8"""
+"""C8E04E1D52712E8B_D9FB705B741F3B34_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CC(C)O""",21,"""FA26069140D5AEC8"""
+"""280F88A61F164494_72674B937952B0AC_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CN=C=S""",21,"""FA26069140D5AEC8"""
+"""DDAE550A49167698_5B1E1B9E96373926_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(CC)N""",21,"""FA26069140D5AEC8"""
+"""31D76AA24817AFDA_7AA8D9B37E6545F2_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(NC)=O""",21,"""FA26069140D5AEC8"""
+"""50DDAAB334951069_CEAB58FCAF49E2C9_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(C)(C)C""",21,"""FA26069140D5AEC8"""
+"""A84F7F556F360281_83335F0220B2C887_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CCCN""",21,"""FA26069140D5AEC8"""
+"""2BCC6D40E2523759_015526C7E874A9FA_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)COCC""",21,"""FA26069140D5AEC8"""
+"""921A7EBD16099332_7377BC92AF1C1782_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(C)(C)Cl""",21,"""FA26069140D5AEC8"""
+"""EA4FC8F31852D686_119223EDB2BD0019_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(C)(C)Br""",21,"""FA26069140D5AEC8"""
+"""5D7946752B3EC6E5_7224677ABFFCBEE7_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CCCI""",21,"""FA26069140D5AEC8"""
+"""81E9844D513B8EA4_40C87F72E3390519_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CN=C=O""",21,"""FA26069140D5AEC8"""
+"""A6F9BD8500F92166_D18AD3F0A90C4A32_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)COCCl""",21,"""FA26069140D5AEC8"""
+"""4A6A4080F8FEE1DB_29B621FB68ADF83A_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CC(O)=O""",21,"""FA26069140D5AEC8"""
+"""C4474F016C8DE09C_F1E3CC8560A406BF_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(N)CO""",21,"""FA26069140D5AEC8"""
+"""D6712A72C93311CC_B8BC038765F20782_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(OC)=O""",21,"""FA26069140D5AEC8"""
+"""9354A0338B67EFCE_26D0BA938744868C_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CNCC""",21,"""FA26069140D5AEC8"""
+"""2782BB2F04E89AC1_A52E3A9D4EF2C475_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(CC)=O""",21,"""FA26069140D5AEC8"""
+"""8275EDFAA493882B_AC242363E05E117B_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C3CNC3""",21,"""FA26069140D5AEC8"""
+"""1EE09573B3C0F2EC_FA2DDE885FC0DF69_2875_DP""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(N)(C)C""",21,"""FA26069140D5AEC8"""
+"""5E98503FD8A5734B_201B0636E6F46091_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C3(C)CC3""",21,"""FA26069140D5AEC8"""
+"""E95EA421A8FABCA7_D9F30FE307B77C75_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C3(N)CC3""",21,"""FA26069140D5AEC8"""
+"""87DB483F4053C28B_D6ADCD31E611F044_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CCCO""",21,"""FA26069140D5AEC8"""
+"""1EE09573B3C0F2EC_AFD40A6D55D20EC0_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(C)(C)N""",21,"""FA26069140D5AEC8"""
+"""A7E0B93B1921DB12_2C8D31CC10ECF1C6_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CN(C)C""",21,"""FA26069140D5AEC8"""
+"""C9C2E4D3AF75F5C5_D5C169327DA99DCF_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(CC)O""",21,"""FA26069140D5AEC8"""
+"""ADED460AC214D428_792524A5B2A62912_2875_DP""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C3CCN3""",21,"""FA26069140D5AEC8"""
+"""ADED460AC214D428_272C33BAAFCDCEB6_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C3NCC3""",21,"""FA26069140D5AEC8"""
+"""78C25225A70F6720_C25EF6EBA8C93207_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)[S](C)(=O)=O""",21,"""FA26069140D5AEC8"""
+"""80BADAF33B40AA47_600527E2036E70F4_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CCNC""",21,"""FA26069140D5AEC8"""
+"""77401B2B0A904D2F_6A811FB2808F5EFB_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CCCC""",21,"""FA26069140D5AEC8"""
+"""A48F57DF98865649_3589CEAE6CC6B24A_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(C)(C)O""",21,"""FA26069140D5AEC8"""
+"""7AAC4E77509F2992_A3E5157BB572ACBD_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(NC)C""",21,"""FA26069140D5AEC8"""
+"""4C425B0DFB2D7353_F86682E04A38C40D_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CCOC""",21,"""FA26069140D5AEC8"""
+"""D1C5D643C77ED3C4_18FFB3D57FF37746_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C(OC)C""",21,"""FA26069140D5AEC8"""
+"""07451128B9A8570E_819DDEFE92CAD4D2_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)C3(O)CC3""",21,"""FA26069140D5AEC8"""
+"""CD4EA5AA564EB724_BDC4633DDDC5A7D1_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CC(C)N""",21,"""FA26069140D5AEC8"""
+"""D4DC9FD9315DC87C_1FFD8FBC7CAC5AAA_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)[Si](C)(C)C""",21,"""FA26069140D5AEC8"""
+"""15904E220B104807_3E961B09C5847642_2875_UN""","""FC(F)(F)C1=CC(=C(N=C1)C#N)[N]2N=NC(=C2)CCCBr""",21,"""FA26069140D5AEC8"""
+"""4D23326BFE1A3AF3_AA5DF0E988CDC6EA_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)CCC#N""",21,"""FB32498A37F5D2CE"""
+"""A58687993D499B4E_D8EF3F40033F4732_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)CC(C)O""",21,"""FB32498A37F5D2CE"""
+"""6F02A5E054E799B8_737304880E72CCAA_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)CN=C=S""",21,"""FB32498A37F5D2CE"""
+"""1520883C387E4779_5A0A5485E1174520_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)C(CC)N""",21,"""FB32498A37F5D2CE"""
+"""BAACD0E7580D298E_7BBC96A8094539F4_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)C(NC)=O""",21,"""FB32498A37F5D2CE"""
+"""65B25C568E669E5E_CFBF17E7D8699ECF_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)C(C)(C)C""",21,"""FB32498A37F5D2CE"""
+"""64C93E3CEC58EED0_822710195792B481_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)CCCN""",21,"""FB32498A37F5D2CE"""
+"""B5E5971F76A21BB0_004169DC9F54D5FC_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)COCC""",21,"""FB32498A37F5D2CE"""
+"""5F01F6443E17047B_7263F389D83C6B84_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)C(C)(C)Cl""",21,"""FB32498A37F5D2CE"""
+"""0A506B0FA44CB38D_10866CF6C59D7C1F_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)C(C)(C)Br""",21,"""FB32498A37F5D2CE"""
+"""18649B7813A97AAB_73302861C8DCC2E1_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)CCCI""",21,"""FB32498A37F5D2CE"""
+"""FCD4962BC3EFC9E1_41DC30699419791F_2875_UN""","""O=[N](=O)C2=C1CC[C@H](C1=CC=C2)[N]3N=NC(=C3)CN=C=O""",21,"""FB32498A37F5D2CE"""
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+"""3F3FDA11571D1997_DF62662C187C13E7_6005_UN""","""CC1=C(C(=NO1)C(=O)O)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""00464454EDB73DCA"""
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+"""C56B70B3E773AC02_D8FA0347D5394EC0_6005_UN""","""CC1=C(C(=NO1)C(=O)O)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""00464454EDB73DCA"""
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+"""388654C98C15BF5C_09C5A73E87FFF847_6005_UN""","""CC1=C(C(=NO1)C(=O)O)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""00464454EDB73DCA"""
+"""8F82AEB061F65F2C_78FE154B96F476B4_6005_UN""","""CC1=C(C(=NO1)C(=O)O)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""00464454EDB73DCA"""
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+"""820DD2B03122A20B_BFFB6BB66E11EFC4_6005_UN""","""CC1=C(C(=NO1)C(=O)O)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""00464454EDB73DCA"""
+"""D5CA0B3009DE07C1_EC0733EF50634ED5_6005_UN""","""CC1=C(C(=NO1)C(=O)O)C2=C(C=CC=C2)CN3CCCC3""",21,"""00464454EDB73DCA"""
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+"""64CABFE35A36FB92_0EC5F002F2516D5B_6004_UN""","""NC1=C(C(=NC=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)C#N""",21,"""0078D6EBF41DF955"""
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+"""7D21E4311FEF36CF_F60C7BB7AD486F00_6004_UN""","""NC1=C(C(=NC=C1)C2=CC(=C(OC)C=C2)CN(C)C)C#N""",21,"""0078D6EBF41DF955"""
+"""487CD6A9FEEBF51D_2E635FBBF98C7E88_6004_UN""","""NC1=C(C(=NC=C1)C2=CC=CC(=C2)COCCOC)C#N""",21,"""0078D6EBF41DF955"""
+"""1040DDD077CD5347_A70ED2BAF73075E4_6004_UN""","""NC1=C(C(=NC=C1)C2=CC=CC(=C2)CN(C)C3CC3)C#N""",21,"""0078D6EBF41DF955"""
+"""018BE7ABBFA9F817_B815C659C07A9281_6004_UN""","""NC1=C(C(=NC=C1)C2=CC=CC(=C2)OC(COC)C)C#N""",21,"""0078D6EBF41DF955"""
+"""60647CA843ABB966_EA543E6D4BCF32AD_6004_UN""","""NC1=C(C(=NC=C1)C2=CC(=C(C(NOC)=O)C=C2)F)C#N""",21,"""0078D6EBF41DF955"""
+"""577204D3A06BF6C3_FFADD859D0B293EF_6004_UN""","""NC1=C(C(=NC=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)C#N""",21,"""0078D6EBF41DF955"""
+"""FD9C915D9500C42C_8616B7752788AF92_6004_UN""","""NC1=C(C(=NC=C1)C2=CC(=CC=C2)CN3CCCC3)C#N""",21,"""0078D6EBF41DF955"""
+"""33A89757A289958B_9F3293774FE44012_6004_UN""","""NC1=C(C(=NC=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)C#N""",21,"""0078D6EBF41DF955"""
+"""5997BA355D7F1E92_E2C6CC95C8F2F17B_6004_UN""","""NC1=C(C(=NC=C1)C2=CC=CC(=C2)OCCN(C)C)C#N""",21,"""0078D6EBF41DF955"""
+"""0A4146B8C4185ED9_151B005759905240_6004_UN""","""NC1=C(C(=NC=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)C#N""",21,"""0078D6EBF41DF955"""
+"""CDD97160E1C1D300_223C38D3AEFA51F4_6004_UN""","""NC1=C(C(=NC=C1)C2=CC=C(C=C2)C3=CC=CC=C3)C#N""",21,"""0078D6EBF41DF955"""
+"""6BE80274A26A0505_F0F0C65784F57B47_6004_UN""","""NC1=C(C(=NC=C1)C2=C(C=CC=C2F)OC(F)(F)F)C#N""",21,"""0078D6EBF41DF955"""
+"""1509C8F6563957C7_202508DF71AF4F54_6004_UN""","""NC1=C(C(=NC=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)C#N""",21,"""0078D6EBF41DF955"""
+"""355827747CDB36D3_0FB03C9062882D91_6004_UN""","""NC1=C(C(=NC=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)C#N""",21,"""0078D6EBF41DF955"""
+"""40AABA838D63F7C5_0A8BC235BEB8FFB8_6004_UN""","""NC1=C(C(=NC=C1)C2=CC=CC(=C2F)C(N(C)C)=O)C#N""",21,"""0078D6EBF41DF955"""
+"""965F7C96E10EE7E6_CF7064C2DE38638C_6004_UN""","""NC1=C(C(=NC=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)C#N""",21,"""0078D6EBF41DF955"""
+"""B3A3C616EA1953DE_DF5CF49301D6D778_6004_UN""","""NC1=C(C(=NC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)C#N""",21,"""0078D6EBF41DF955"""
+"""808964CBCDEE52EC_024FADAAAF752302_6004_UN""","""NC1=C(C(=NC=C1)C2=CC(=CC=C2)C3=CC=CC=C3)C#N""",21,"""0078D6EBF41DF955"""
+"""9B2FFAFB8EB3D43B_923C49D03688A9D7_6004_UN""","""NC1=C(C(=NC=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)C#N""",21,"""0078D6EBF41DF955"""
+"""7FA231004F1AC9F9_B71DF963D687670C_6004_UN""","""NC1=C(C(=NC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)C#N""",21,"""0078D6EBF41DF955"""
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+"""9E8763660907DBF6_2C8D2A340144463C_6004_UN""","""NC1=C(C(=NC=C1)C2=CC=C(C=C2)OC3CCCC3)C#N""",21,"""0078D6EBF41DF955"""
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+"""38779473A2BD3E1E_09FB35819E553CD8_6004_UN""","""NC1=C(C(=NC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)C#N""",21,"""0078D6EBF41DF955"""
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+"""C45B64546D04CD56_BFC5F90977BB2B5B_6004_UN""","""NC1=C(C(=NC=C1)C2=CC(=CC=C2)C3=CC=NC=C3)C#N""",21,"""0078D6EBF41DF955"""
+"""DE072F9C70FDAC8E_EC39A15049C98A4A_6004_UN""","""NC1=C(C(=NC=C1)C2=C(C=CC=C2)CN3CCCC3)C#N""",21,"""0078D6EBF41DF955"""
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+"""DB15EE26FAB0B41F_009C5D49355B323D_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=CC=C2)OC3CCCC3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""C43B7FE12D20343E_AFEBA565CE4B9EC1_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=C(OCC)C=C2)OCC)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""AD5C32EEC89D9AB9_53EBD2A251A069EB_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2)OCCC(C)C)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""50A114168F81124F_0FD12AF4C28C5FEF_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""601EFE9601FAEF79_3CF9453545E2A947_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=C(C=C2)OC3CCOC3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""B4E91740CBF8DD48_F718A1419D955DB4_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=C(OC)C=C2)CN(C)C)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""C7C91DBBBF384A60_2F77854DC9514C3C_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2)COCCOC)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""1B7939EB63D42270_A61A084CC7ED4750_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2)CN(C)C3CC3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""509B222C94E6DDBC_B9011CAFF0A7A035_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2)OC(COC)C)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""A01A66EF02FE6E55_EB40E49B7B120019_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""E7A03762ED5FDF06_FEB902AFE06FA15B_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""1374F2E951BBAABA_87026D8317559D26_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=CC=C2)CN3CCCC3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""DC8DABB83A7A13DC_9E2649817F3972A6_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""FF355D40A8144013_E3D21663F82FC3CF_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2)OCCN(C)C)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""FBB00F625D78F620_140FDAA1694D60F4_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""7DACD6C9DBB95F09_2328E2259E276340_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""B195B4D833BFA4EC_F1E41CA1B42849F3_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(C=CC=C2F)OC(F)(F)F)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""31D16843486DD2A5_2131D22941727DE0_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""B3163BFB99685826_0EA4E66652551F25_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""F96F3537EEA4F07C_0B9F18C38E65CD0C_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""AA609E6A0EA5A4BB_CE64BE34EEE55138_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""6887DC8D7D43A2F6_DE482E65310BE5CC_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""43D9718BBE866B17_035B775C9FA811B6_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""869FC40730A3F4DE_9328932606559B63_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""6949635668B3A36E_B6092395E65A55B8_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""45E4593575790AFF_D0F493D4CFD3E4D8_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=C(OCCC(C)C)C=C2)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""D06540AC3052F98E_2D99F0C231997488_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=C(C=C2)OC3CCCC3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""60680A8135ACD2EF_ACAF293C86621C5C_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(C=C(OC)C=C2)CN(C)C)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""916B698825E32DBA_D9D04B0EFC4EB8EB_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""6BB45D4AB7C4A12A_26378C822B4F4606_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(C)C=C(C=C2)OCC3CC3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""0F317ABD60FAB700_D1B0657700366B18_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""F6705DB33E552B36_A7BB4B6BC85A6C73_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(OCC(C)(C)C)N=CC=C2)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""F85DD0E78ECBED8D_628BDA5151BE050C_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""98591ED24B88D35D_08EFEF77AE880E6C_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""04797AEC7188964F_79D45D02BF83809F_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""E74ED5FD04AF00D8_CB1FB1777DCA89DD_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""E1B3213F65265467_BED123FF476619EF_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""0F9F047C26917F8A_ED2D7BA67914B8FE_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(C=CC=C2)CN3CCCC3)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""DF812AF20E6DD640_75F92B27C5A65B44_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=CC(=N[N]2C3CCCCO3)C)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""DD74099F0D1D43D2_7FFE01249CDBBFB9_6005_UN""","""NC1=NC(=C(C(=N1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F)Cl""",21,"""016C0C1DC4C0CBE1"""
+"""3ACE77CCACB2C699_FF609180608C7511_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](CCN)(=O)=O)C2CC2""",21,"""01A8EF6FBE771809"""
+"""6F8944BF90E8DB42_6419410ACD2F7ABF_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C(C)C)[S](=O)(=O)CCN""",21,"""01A8EF6FBE771809"""
+"""6D7E70B5E69956BC_3396ADBF236F59E3_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](C)(=O)=O)CCN=C=S""",21,"""01A8EF6FBE771809"""
+"""D0778AC0DAF48C41_2E80AC076DC7202B_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](CC)(=O)=O)CCCN""",21,"""01A8EF6FBE771809"""
+"""A4D1BEE8A4B0C2D2_A45F09EA9B13150A_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](C)(=O)=O)C2CC(C2)N""",21,"""01A8EF6FBE771809"""
+"""6704FA564FF011C1_E28501EDAB26978B_6036_UN""","""NCC1=CC=C(C=C1)OCCN(CCCN)[S](=O)(=O)CCl""",21,"""01A8EF6FBE771809"""
+"""F3A081292A9204EB_17648DAB79B402CA_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2CNCC2""",21,"""01A8EF6FBE771809"""
+"""28AE8B581389C4D0_A93C86BCC65BA70E_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](CC)(=O)=O)CCCBr""",21,"""01A8EF6FBE771809"""
+"""8216B1C82F556824_1DE607BC63552480_6036_UN""","""NCC1=CC=C(C=C1)OCCN(CCCNC)[S](=O)(=O)C""",21,"""01A8EF6FBE771809"""
+"""7FB5640C11000735_F88B0FDAEA9C3ED8_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""01A8EF6FBE771809"""
+"""0E3CCFE5149269BD_AAC065C1B6A3ED10_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](=O)(=O)CC#N)C2CC2""",21,"""01A8EF6FBE771809"""
+"""D10C30E8C230F227_29140EB75E05AF07_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](C)(=O)=O)C(=O)CCN""",21,"""01A8EF6FBE771809"""
+"""EB09C30AF38E2B68_EF125947BA5B1BF4_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2=CC=CS2""",21,"""01A8EF6FBE771809"""
+"""A4D98649C129EC73_4DB404DEAA1409B5_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""01A8EF6FBE771809"""
+"""CC76A44511849B18_80D35F97755A29EA_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""01A8EF6FBE771809"""
+"""CB9FBA43FB64F345_74AEF020BA5A7943_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""01A8EF6FBE771809"""
+"""17FC077D63AB9B7C_7E5A172026214145_6036_UN""","""NCC1=CC=C(C=C1)OCCN(CC(CC)N)[S](=O)(=O)C""",21,"""01A8EF6FBE771809"""
+"""7DDDE1C1E40387FB_7C744201242AF16E_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""01A8EF6FBE771809"""
+"""B4322F1F747BF05F_EFB65D4DFED22A8A_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](C)(=O)=O)CCN=[N]#N""",21,"""01A8EF6FBE771809"""
+"""22A7081D27F78D75_3F076AEBF8AF2EAE_6036_UN""","""NCC1=CC=C(C=C1)OCCN(CC(C)(C)N)[S](=O)(=O)C""",21,"""01A8EF6FBE771809"""
+"""A349ECDED2F23C90_75080D5A6F61A923_6036_UN""","""NCC1=CC=C(C=C1)OCCN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""01A8EF6FBE771809"""
+"""4C9C89D06145A186_99359338654B0D2C_6036_UN""","""NCC1=CC=C(C=C1)OCCN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""01A8EF6FBE771809"""
+"""57E8C85ADABF23B1_90D8275CCE1E2096_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](=O)(=O)C2CC2)CC#C""",21,"""01A8EF6FBE771809"""
+"""245F1B382D631D3A_C4D83DD72910E550_6036_UN""","""NCC1=CC=C(C=C1)OCCN2[S](=O)(=O)C3(CCC2)CC3""",21,"""01A8EF6FBE771809"""
+"""B9FDEAA72396F86E_ECB3722A0C14A9B8_6036_UN""","""NCC1=CC=C(C=C1)OCCN2CCCC(C)(C)[S]2(=O)=O""",21,"""01A8EF6FBE771809"""
+"""9E04B00EB437F7DE_279A897E85D262AB_6036_UN""","""NCC1=CC=C(C=C1)OCCN2CCCC(CC)[S]2(=O)=O""",21,"""01A8EF6FBE771809"""
+"""40B9950B91CB6D70_16F3F9A4E06BD404_6036_UN""","""NCC1=CC=C(C=C1)OCCN2C(C(N)CC[S]2(=O)=O)=O""",21,"""01A8EF6FBE771809"""
+"""3913997F4206F5E0_C9ED9E0A9A63ED2A_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""01A8EF6FBE771809"""
+"""00FC2B5401C335CF_62D550934EF37006_6036_UN""","""NCC1=CC=C(C=C1)OCCN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""01A8EF6FBE771809"""
+"""F9FF87E4F0395FB2_22B9E0C34BC9A9B8_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""01A8EF6FBE771809"""
+"""D0FF6795CA1ED39E_8AF67A17B0D4B6D0_6036_UN""","""NCC1=CC=C(C=C1)OCCN2[S](CCN(C)CC2)(=O)=O""",21,"""01A8EF6FBE771809"""
+"""E0CEC05FD9CF4DD6_06615C9AD87D5D33_6036_UN""","""NCC1=CC=C(C=C1)OCCN2CC(=O)NCC[S]2(=O)=O""",21,"""01A8EF6FBE771809"""
+"""02D63BEA311F58C1_539A419375D89AA7_6036_UN""","""NCC1=CC=C(C=C1)OCCN2[S](CCCCC2C)(=O)=O""",21,"""01A8EF6FBE771809"""
+"""5EFD0BA3E5ABE5B1_2932045FDB387559_6036_UN""","""NCC1=CC=C(C=C1)OCCN(CCN)[S](=O)(=O)C2CC2""",21,"""01A8EF6FBE771809"""
+"""4C6DF5DD18DD8D9E_4FC8229E7F14E7AE_6036_UN""","""NCC1=CC=C(C=C1)OCCN(CCN)[S](=O)(=O)C(F)F""",21,"""01A8EF6FBE771809"""
+"""9CACC9B007EDE039_EFCDBEFB411F194C_6036_UN""","""NCC1=CC=C(C=C1)OCCN([S](CC)(=O)=O)C2CNC2""",21,"""01A8EF6FBE771809"""
+"""8B2B734CBEF3A3D0_DD546AC7D6F64D31_6036_DP""","""NCC1=CC=C(C=C1)OCCN3CC2(CNC2)C[S]3(=O)=O""",21,"""01A8EF6FBE771809"""
+"""FE0960C81D988C76_672113550F35095B_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""01A8EF6FBE771809"""
+"""E8EAC1AF8DDEFB33_9BCA8B05065719EB_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""01A8EF6FBE771809"""
+"""1F8AB61FF220CFF2_A5ABECB2CB69D170_6036_UN""","""NCC1=CC=C(C=C1)OCCN(C(C)(C)CN)[S](=O)(=O)C""",21,"""01A8EF6FBE771809"""
+"""3646CDA836148842_035A75B4C03B2994_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)OC3CCCC3)Cl""",21,"""02AA24E031A0D048"""
+"""9683643C563E8FF2_AC2D8D983B2B8568_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(OCC)C=C2)OCC)Cl""",21,"""02AA24E031A0D048"""
+"""C388CBB47FD1363D_502DFA5FA4C07242_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)OCCC(C)C)Cl""",21,"""02AA24E031A0D048"""
+"""F5152C8C01564BB4_0C17020937EC4446_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)C[N]3C=CN=C3)Cl""",21,"""02AA24E031A0D048"""
+"""D7A1BE5081403A03_3F3F6DC8B082B2EE_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)OC3CCOC3)Cl""",21,"""02AA24E031A0D048"""
+"""BE1DFD24F83CB908_F4DE89BC68F5461D_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(OC)C=C2)CN(C)C)Cl""",21,"""02AA24E031A0D048"""
+"""BCB78513D4757494_2CB1ADB03C315795_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)COCCOC)Cl""",21,"""02AA24E031A0D048"""
+"""B8725457A1BCD578_A5DC20B1328D5CF9_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)CN(C)C3CC3)Cl""",21,"""02AA24E031A0D048"""
+"""53123A583F27B0BF_BAC7345205C7BB9C_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)OC(COC)C)Cl""",21,"""02AA24E031A0D048"""
+"""4892FF02349B9676_E886CC668E721BB0_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(C(NOC)=O)C=C2)F)Cl""",21,"""02AA24E031A0D048"""
+"""2AC5347AC049EA28_FD7F2A52150FBAF2_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(OC)N=C(C=C2)C(F)(F)F)Cl""",21,"""02AA24E031A0D048"""
+"""DFE8541218BEBD64_84C4457EE235868F_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)CN3CCCC3)Cl""",21,"""02AA24E031A0D048"""
+"""46D88687C626C40B_9DE0617C8A59690F_6005_UN""","""CC1=C(C=C(C(=C1)F)C3=CC=C([N]2C=C(C)C=N2)C=C3)Cl""",21,"""02AA24E031A0D048"""
+"""41C6032C1A53E7AE_E0143E9E0D4FD866_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)OCCN(C)C)Cl""",21,"""02AA24E031A0D048"""
+"""CAF13874BA404D02_17C9F25C9C2D7B5D_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=C(C(C)C)C=C2)C(C)C)Cl""",21,"""02AA24E031A0D048"""
+"""C18E764EC093B108_20EECAD86B4778E9_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)C3=CC=CC=C3)Cl""",21,"""02AA24E031A0D048"""
+"""8AB37B3A8A9B41A0_F222345C4148525A_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=CC=C2F)OC(F)(F)F)Cl""",21,"""02AA24E031A0D048"""
+"""A40EABECFA89850E_22F7FAD4B4126649_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Cl""",21,"""02AA24E031A0D048"""
+"""A746F4FB52DAFCE6_0D62CE9BA735048C_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=C(OC)C=C2)C(F)(F)F)Cl""",21,"""02AA24E031A0D048"""
+"""F0AF22CB84C5A9FB_0859303E7B05D6A5_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2F)C(N(C)C)=O)Cl""",21,"""02AA24E031A0D048"""
+"""63B05F8886717791_CDA296C91B854A91_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(OC)C=C2)C(F)(F)F)Cl""",21,"""02AA24E031A0D048"""
+"""C5B41C8D36D77347_DD8E0698C46BFE65_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Cl""",21,"""02AA24E031A0D048"""
+"""27E31158B9C3934F_009D5FA16AC80A1F_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)C3=CC=CC=C3)Cl""",21,"""02AA24E031A0D048"""
+"""A835057FD7DD9BF7_90EEBBDBF33580CA_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(OC)C=C(C=C2)C(F)(F)F)Cl""",21,"""02AA24E031A0D048"""
+"""3928C8B009728366_B5CF0B68133A4E11_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C)C=C(C=C2)OC(F)(F)F)Cl""",21,"""02AA24E031A0D048"""
+"""3F43152EF34CDF19_D332BB293AB3FF71_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(OCCC(C)C)C=C2)Cl""",21,"""02AA24E031A0D048"""
+"""77A1B09E9113823C_2E5FD83FC4F96F21_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)OC3CCCC3)Cl""",21,"""02AA24E031A0D048"""
+"""14D99351D95B258E_AF6901C1730207F5_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=C(OC)C=C2)CN(C)C)Cl""",21,"""02AA24E031A0D048"""
+"""2A0702BD0C0BAF9E_DA1663F3092EA342_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(N=C2)C(F)(F)F)OC)Cl""",21,"""02AA24E031A0D048"""
+"""FFA7C7984A4820B6_25F1A47FDE2F5DAF_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C)C=C(C=C2)OCC3CC3)Cl""",21,"""02AA24E031A0D048"""
+"""2FF72504452DA046_D2764D8AF55670B1_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=CC(=C2)C3(CC3)C#N)F)Cl""",21,"""02AA24E031A0D048"""
+"""ED162B3CE742391D_A47D63963D3A77DA_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(OCC(C)(C)C)N=CC=C2)Cl""",21,"""02AA24E031A0D048"""
+"""A3B1B17B845F8ED7_614DF2ACA4DE1EA5_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)C[N]3C=NC=N3)Cl""",21,"""02AA24E031A0D048"""
+"""2C939C96B48F8AA2_0B29C78A5BE815C5_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(OCC)C=CC(=C2)[N](=O)=O)Cl""",21,"""02AA24E031A0D048"""
+"""9FC643E5FC030F46_7A1275FF4AE39B36_6005_UN""","""CC1=C(C=C(C(=C1)F)C3=CC2=C(C=C(OC)C=C2)C=C3)Cl""",21,"""02AA24E031A0D048"""
+"""0A9E32CDCBA5402E_C8D9998A88AA9274_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(C=C2C3CC3)Cl)OC)Cl""",21,"""02AA24E031A0D048"""
+"""F8800EAC2DF0014D_BD170B02B2060246_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)C3=CC=NC=C3)Cl""",21,"""02AA24E031A0D048"""
+"""6B89A280B99657E2_EEEB535B8C74A357_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=CC=C2)CN3CCCC3)Cl""",21,"""02AA24E031A0D048"""
+"""97273F0480BC547A_763F03DA30C640ED_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=N[N]2C3CCCCO3)C)Cl""",21,"""02AA24E031A0D048"""
+"""6A78D58EC701BEFA_7C3829D969BBA410_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=C(C=C2)OC(F)(F)F)F)Cl""",21,"""02AA24E031A0D048"""
+"""4E7EC7302F1F98BD_FC0CC2823D41F62F_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](CCN)(=O)=O)C2CC2""",21,"""02C4BC6DE3BA9B37"""
+"""91176EE6D94DFAF0_6775120890E2F981_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""02C4BC6DE3BA9B37"""
+"""8D8312F8CB737981_30FAFEBD7EA2DADD_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""02C4BC6DE3BA9B37"""
+"""352FC3F7BE0081B1_2DECFF05300AA315_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](CC)(=O)=O)CCCN""",21,"""02C4BC6DE3BA9B37"""
+"""DFB3022C4F5B4415_A7335AE8C6DE9634_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2CC(C2)N""",21,"""02C4BC6DE3BA9B37"""
+"""A45E86A65D3B109C_E1E952EFF6EB14B5_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""02C4BC6DE3BA9B37"""
+"""FDC58679D7DB712D_1408DEA9247981F4_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2CNCC2""",21,"""02C4BC6DE3BA9B37"""
+"""BC296C78194F4A3C_AA50D5BE9B962430_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](CC)(=O)=O)CCCBr""",21,"""02C4BC6DE3BA9B37"""
+"""13D5E657F48798B5_1E8A54BE3E98A7BE_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(CCCNC)[S](=O)(=O)C""",21,"""02C4BC6DE3BA9B37"""
+"""2ABDABA7FAC1DE9A_FBE75CD8B751BDE6_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""02C4BC6DE3BA9B37"""
+"""0DEA2006FEBC8575_A9AC36C3EB6E6E2E_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](=O)(=O)CC#N)C2CC2""",21,"""02C4BC6DE3BA9B37"""
+"""436CB4E26B99718B_2A785DB503C82C39_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""02C4BC6DE3BA9B37"""
+"""65DA978760A02BF3_EC7E0A45E79698CA_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""02C4BC6DE3BA9B37"""
+"""E33499ACE1E2DDEB_4ED857DCF7D98A8B_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""02C4BC6DE3BA9B37"""
+"""1EF5A8A274B5C137_83BF0C952897AAD4_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""02C4BC6DE3BA9B37"""
+"""01CAE94DC0F19206_77C2A322E797FA7D_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""02C4BC6DE3BA9B37"""
+"""ED29AF0603337621_7D3644227BECC27B_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""02C4BC6DE3BA9B37"""
+"""B1D17F645164F4E6_7F18110379E77250_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""02C4BC6DE3BA9B37"""
+"""9D1C68D71F745918_ECDA0E4FA31FA9B4_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""02C4BC6DE3BA9B37"""
+"""45F7259D1939F5A0_3C6B39E9A562AD90_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""02C4BC6DE3BA9B37"""
+"""35955FB2DFBAF562_76645E5832AC2A1D_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""02C4BC6DE3BA9B37"""
+"""271AAE445764031E_9A59C03A38868E12_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""02C4BC6DE3BA9B37"""
+"""8AD799094FB2A85D_93B4745E93D3A3A8_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](=O)(=O)C2CC2)CC#C""",21,"""02C4BC6DE3BA9B37"""
+"""A68A900FCD4F8810_C7B46ED574DD666E_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""02C4BC6DE3BA9B37"""
+"""E6DE5C834D5E40BA_EFDF212851D92A86_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N2CCCC(C)(C)[S]2(=O)=O""",21,"""02C4BC6DE3BA9B37"""
+"""66FCE67DFDB63BE0_24F6DA7CD81FE195_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N2CCCC(CC)[S]2(=O)=O""",21,"""02C4BC6DE3BA9B37"""
+"""06E8F71D33ECC5D6_159FAAA6BDA6573A_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""02C4BC6DE3BA9B37"""
+"""768E2AD6FA53FFA4_CA81CD08C7AE6E14_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""02C4BC6DE3BA9B37"""
+"""936441E66D30957A_61B90391133EF338_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""02C4BC6DE3BA9B37"""
+"""3A9A99F97F764334_21D5B3C116042A86_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""02C4BC6DE3BA9B37"""
+"""93C9D30C418C2AAD_899A2915ED1935EE_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N2[S](CCN(C)CC2)(=O)=O""",21,"""02C4BC6DE3BA9B37"""
+"""7CED049041DD4DAA_050D0F9885B0DE0D_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N2CC(=O)NCC[S]2(=O)=O""",21,"""02C4BC6DE3BA9B37"""
+"""0E9D9BA7024343A3_50F6129128151999_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N2[S](CCCCC2C)(=O)=O""",21,"""02C4BC6DE3BA9B37"""
+"""8DA2E85CEA8EEA3A_2A5E575D86F5F667_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(CCN)[S](=O)(=O)C2CC2""",21,"""02C4BC6DE3BA9B37"""
+"""CDA4EBF191FFE4CE_4CA4719C22D96490_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""02C4BC6DE3BA9B37"""
+"""0012A49DE516D7E0_ECA1EDF91CD29A72_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N([S](CC)(=O)=O)C2CNC2""",21,"""02C4BC6DE3BA9B37"""
+"""4FAA3E1B8B38E73F_DE3839C58B3BCE0F_6036_DP""","""C(CCCC1=CC(=CC=C1)Br)N3CC2(CNC2)C[S]3(=O)=O""",21,"""02C4BC6DE3BA9B37"""
+"""6B75685C0B14D3A4_644D405752F88A65_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""02C4BC6DE3BA9B37"""
+"""61FC33F0CB2EE3C1_98A6D8075B9A9AD5_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""02C4BC6DE3BA9B37"""
+"""E15EE4513C520F9A_A6C7BFB096A4524E_6036_UN""","""C(CCCC1=CC(=CC=C1)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""02C4BC6DE3BA9B37"""
+"""69E77141B513BFE2_030A143AB1173638_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=CC=C2)OC3CCCC3)CBr""",21,"""02FA456E408CCFE4"""
+"""7D468489A6FDAE94_AC7DEC164A079AC4_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=C(OCC)C=C2)OCC)CBr""",21,"""02FA456E408CCFE4"""
+"""C89EC4B443EA958B_507D9BD1D5EC6DEE_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=CC(=C2)OCCC(C)C)CBr""",21,"""02FA456E408CCFE4"""
+"""8117B649811C64C8_0C47638746C05BEA_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)CBr""",21,"""02FA456E408CCFE4"""
+"""3D03FF822A7BC74C_3F6F0C46C1AEAD42_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=C(C=C2)OC3CCOC3)CBr""",21,"""02FA456E408CCFE4"""
+"""8263F4635CE62417_F48EE83219D959B1_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=C(OC)C=C2)CN(C)C)CBr""",21,"""02FA456E408CCFE4"""
+"""9C0FBD04095B1A85_2CE1CC3E4D1D4839_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=CC(=C2)COCCOC)CBr""",21,"""02FA456E408CCFE4"""
+"""6E34F74B7A4037C2_A58C413F43A14355_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=CC(=C2)CN(C)C3CC3)CBr""",21,"""02FA456E408CCFE4"""
+"""578229E5AE3E0CB3_BA9755DC74EBA430_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=CC(=C2)OC(COC)C)CBr""",21,"""02FA456E408CCFE4"""
+"""BFFBD6DE001A9238_E8D6ADE8FF5E041C_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)CBr""",21,"""02FA456E408CCFE4"""
+"""2870151342643832_FD2F4BDC6423A55E_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)CBr""",21,"""02FA456E408CCFE4"""
+"""F5738D00C2EF8810_849424F093199923_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=CC=C2)CN3CCCC3)CBr""",21,"""02FA456E408CCFE4"""
+"""9F1CD361E2D48E54_9DB000F2FB7576A3_6005_UN""","""ClC1=C(C=CC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)CBr""",21,"""02FA456E408CCFE4"""
+"""50562407B49826F5_E0445F107C63C7CA_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=CC(=C2)OCCN(C)C)CBr""",21,"""02FA456E408CCFE4"""
+"""364CA0CBBF0EAE43_179993D2ED0164F1_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)CBr""",21,"""02FA456E408CCFE4"""
+"""979C78F043EC66F5_20BEAB561A6B6745_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=C(C=C2)C3=CC=CC=C3)CBr""",21,"""02FA456E408CCFE4"""
+"""71463DA5776CDD58_F27255D230644DF6_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(C=CC=C2F)OC(F)(F)F)CBr""",21,"""02FA456E408CCFE4"""
+"""2F4FD4E864365EB7_22A79B5AC53E79E5_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)CBr""",21,"""02FA456E408CCFE4"""
+"""306D000E0F1EC07F_0D32AF15D6191B20_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)CBr""",21,"""02FA456E408CCFE4"""
+"""9803826303FCF767_080951B00A29C909_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=CC(=C2F)C(N(C)C)=O)CBr""",21,"""02FA456E408CCFE4"""
+"""81DF3F7308C9C16F_CDF2F7476AA9553D_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)CBr""",21,"""02FA456E408CCFE4"""
+"""9A087A1CB3C32ECA_DDDE6716B547E1C9_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)CBr""",21,"""02FA456E408CCFE4"""
+"""1E94310AA2036512_00CD3E2F1BE415B3_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=CC=C2)C3=CC=CC=C3)CBr""",21,"""02FA456E408CCFE4"""
+"""D6386E36C10F0ABF_90BEDA5582199F66_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)CBr""",21,"""02FA456E408CCFE4"""
+"""996361A4F5267934_B59F6AE6621651BD_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)CBr""",21,"""02FA456E408CCFE4"""
+"""C8FA7CABD90CB239_D362DAA74B9FE0DD_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=C(OCCC(C)C)C=C2)CBr""",21,"""02FA456E408CCFE4"""
+"""AB18191FD4D18EF1_2E0FB9B1B5D5708D_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=C(C=C2)OC3CCCC3)CBr""",21,"""02FA456E408CCFE4"""
+"""AA096BADA79CB1CF_AF39604F022E1859_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(C=C(OC)C=C2)CN(C)C)CBr""",21,"""02FA456E408CCFE4"""
+"""234FB7EC85731F20_DA46027D7802BCEE_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)CBr""",21,"""02FA456E408CCFE4"""
+"""74C428D7AECEB1BD_25A1C5F1AF034203_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(C)C=C(C=C2)OCC3CC3)CBr""",21,"""02FA456E408CCFE4"""
+"""3937221141834B26_D2262C04847A6F1D_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)CBr""",21,"""02FA456E408CCFE4"""
+"""AC3BC7E6B7DD8427_A42D02184C166876_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(OCC(C)(C)C)N=CC=C2)CBr""",21,"""02FA456E408CCFE4"""
+"""00EC5153C9E301F5_611D9322D5F20109_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)CBr""",21,"""02FA456E408CCFE4"""
+"""BBC52E499D87A7FB_0B79A6042AC40A69_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)CBr""",21,"""02FA456E408CCFE4"""
+"""5447E965426068AC_7A4214713BCF849A_6005_UN""","""ClC1=C(C=CC(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)CBr""",21,"""02FA456E408CCFE4"""
+"""1E2053FBF324CF38_C889F804F9868DD8_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)CBr""",21,"""02FA456E408CCFE4"""
+"""6A48718D0640F0FD_BD476A8CC32A1DEA_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=CC=C2)C3=CC=NC=C3)CBr""",21,"""02FA456E408CCFE4"""
+"""8BC993D504CB1D8C_EEBB32D5FD58BCFB_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(C=CC=C2)CN3CCCC3)CBr""",21,"""02FA456E408CCFE4"""
+"""151F74F0A908B585_766F625441EA5F41_6005_UN""","""ClC1=C(C=CC(=C1)C2=CC(=N[N]2C3CCCCO3)C)CBr""",21,"""02FA456E408CCFE4"""
+"""4BFC0F84996B324D_7C6848571897BBBC_6005_UN""","""ClC1=C(C=CC(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)CBr""",21,"""02FA456E408CCFE4"""
+"""6813D8F09F86B33A_02FE3F54A3B14617_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""030E6E00522ABFCB"""
+"""5D92C550CCD5B69A_AD89C77858A1EAEB_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""030E6E00522ABFCB"""
+"""8C4D3F73AC262CEB_5189B0BFC74A1DC1_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""030E6E00522ABFCB"""
+"""08CF85CCB3BC8E23_0DB348E954662BC5_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""030E6E00522ABFCB"""
+"""2D87A8DD3F523D4D_3E9B2728D308DD6D_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""030E6E00522ABFCB"""
+"""DA861051758D6566_F57AC35C0B7F299E_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""030E6E00522ABFCB"""
+"""011D7FCF20559E3F_2D15E7505FBB3816_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=CC(=C2)COCCOC)N""",21,"""030E6E00522ABFCB"""
+"""B77DBF5C0BEA3CCF_A4786A515107337A_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""030E6E00522ABFCB"""
+"""553BD098EB68823F_BB637EB2664DD41F_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=CC(=C2)OC(COC)C)N""",21,"""030E6E00522ABFCB"""
+"""F4948AF1393A128E_E9228686EDF87433_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""030E6E00522ABFCB"""
+"""ED689D2422FFD5FC_FCDB60B27685D571_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""030E6E00522ABFCB"""
+"""06C8967C285831BC_85600F9E81BFE90C_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""030E6E00522ABFCB"""
+"""B018899A3785D464_9C442B9CE9D3068C_6005_UN""","""CC1=C(C(=CC(=C1)Br)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""030E6E00522ABFCB"""
+"""6C2361AAACD9A695_E1B0747E6EC5B7E5_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""030E6E00522ABFCB"""
+"""6554B9E900426BBD_166DB8BCFFA714DE_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""030E6E00522ABFCB"""
+"""6E998B83123B7890_214A803808CD176A_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""030E6E00522ABFCB"""
+"""6583BB6648A3D9E8_F3867EBC22C23DD9_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""030E6E00522ABFCB"""
+"""B85163B9949C870E_2353B034D79809CA_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""030E6E00522ABFCB"""
+"""AF1A5A5533CE3C15_0CC6847BC4BF6B0F_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""030E6E00522ABFCB"""
+"""FA229EBF0FA13164_09FD7ADE188FB926_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""030E6E00522ABFCB"""
+"""7D65C0DEAAEFCCA2_CC06DC29780F2512_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""030E6E00522ABFCB"""
+"""722F3D7B0CD53D5B_DC2A4C78A7E191E6_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""030E6E00522ABFCB"""
+"""A2F82AADC32197C5_013915410942659C_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""030E6E00522ABFCB"""
+"""E5C6E0B0FDB05A61_914AF13B90BFEF49_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""030E6E00522ABFCB"""
+"""01C9178684BABA37_B46B418870B02192_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""030E6E00522ABFCB"""
+"""21D902C25622642B_D296F1C9593990F2_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=C(OCCC(C)C)C=C2)N""",21,"""030E6E00522ABFCB"""
+"""983A1684FAFEA143_2FFB92DFA77300A2_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=C(C=C2)OC3CCCC3)N""",21,"""030E6E00522ABFCB"""
+"""3834E364A0842701_AECD4B2110886876_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(C=C(OC)C=C2)CN(C)C)N""",21,"""030E6E00522ABFCB"""
+"""3BF17F4460D56BCC_DBB229136AA4CCC1_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=C(N=C2)C(F)(F)F)OC)N""",21,"""030E6E00522ABFCB"""
+"""4A0DC842A5F5DE95_2455EE9FBDA5322C_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(C)C=C(C=C2)OCC3CC3)N""",21,"""030E6E00522ABFCB"""
+"""6F9A6EBD53949F7B_D3D2076A96DC1F32_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(C=CC(=C2)C3(CC3)C#N)F)N""",21,"""030E6E00522ABFCB"""
+"""978700097BDFB7FA_A5D929765EB01859_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(OCC(C)(C)C)N=CC=C2)N""",21,"""030E6E00522ABFCB"""
+"""7C7E3976B91BAE82_60E9B84CC7547126_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC=C(C=C2)C[N]3C=NC=N3)N""",21,"""030E6E00522ABFCB"""
+"""01DC5B6AF9D3173F_0A8D8D6A38627A46_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(OCC)C=CC(=C2)[N](=O)=O)N""",21,"""030E6E00522ABFCB"""
+"""717896B5DF31F31E_7BB63F1F2969F4B5_6005_UN""","""CC1=C(C(=CC(=C1)Br)C3=CC2=C(C=C(OC)C=C2)C=C3)N""",21,"""030E6E00522ABFCB"""
+"""D20A4E446636BE29_C97DD36AEB20FDF7_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=C(C=C2C3CC3)Cl)OC)N""",21,"""030E6E00522ABFCB"""
+"""642771CD3483A670_BCB341E2D18C6DC5_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=CC=C2)C3=CC=NC=C3)N""",21,"""030E6E00522ABFCB"""
+"""971AB1E193CA330D_EF4F19BBEFFECCD4_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(C=CC=C2)CN3CCCC3)N""",21,"""030E6E00522ABFCB"""
+"""D701B115A9AF83DE_779B493A534C2F6E_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=CC(=N[N]2C3CCCCO3)C)N""",21,"""030E6E00522ABFCB"""
+"""11DD2ED98502C3E4_7D9C63390A31CB93_6005_UN""","""CC1=C(C(=CC(=C1)Br)C2=C(C=C(C=C2)OC(F)(F)F)F)N""",21,"""030E6E00522ABFCB"""
+"""5D9FA83FD5654F93_022DA3D37D986E60_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC(=CC=C3)OC4CCCC4""",21,"""03DDF2878C0397BC"""
+"""60CFC91C96E6A7B8_AD5A5BFF8688C29C_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC(=C(OCC)C=C3)OCC""",21,"""03DDF2878C0397BC"""
+"""36438AE90BFA5115_515A2C38196335B6_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC=CC(=C3)OCCC(C)C""",21,"""03DDF2878C0397BC"""
+"""71FE44A5ACE60D21_0D60D46E8A4F03B2_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""03DDF2878C0397BC"""
+"""37C22AAA1FFBAA96_3E48BBAF0D21F51A_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC=C(C=C3)OC4CCOC4""",21,"""03DDF2878C0397BC"""
+"""6E2ED9F586F3A85D_F5A95FDBD55601E9_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""03DDF2878C0397BC"""
+"""D41FD0EA72EFE594_2DC67BD781921061_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC=CC(=C3)COCCOC""",21,"""03DDF2878C0397BC"""
+"""AF19AAF43B3657CF_A4ABF6D68F2E1B0D_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""03DDF2878C0397BC"""
+"""384305EAE3379F5E_BBB0E235B864FC68_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC=CC(=C3)OC(COC)C""",21,"""03DDF2878C0397BC"""
+"""FFFDE069AD6F5516_E9F11A0133D15C44_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""03DDF2878C0397BC"""
+"""4D695023A618DBAE_FC08FC35A8ACFD06_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""03DDF2878C0397BC"""
+"""9519EAA39029F8E0_85B393195F96C17B_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC(=CC=C3)CN4CCCC4""",21,"""03DDF2878C0397BC"""
+"""7E032F9E2A1984DC_9C97B71B37FA2EFB_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""03DDF2878C0397BC"""
+"""A0A5AE025172DC50_E163E8F9B0EC9F92_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC=CC(=C3)OCCN(C)C""",21,"""03DDF2878C0397BC"""
+"""0EC08C88209C0FCB_16BE243B218E3CA9_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""03DDF2878C0397BC"""
+"""7394074B1CDD5124_21991CBFD6E43F1D_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""03DDF2878C0397BC"""
+"""E9826905BE4DA9C8_F355E23BFCEB15AE_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""03DDF2878C0397BC"""
+"""AB598CE5E2A74BC9_23802CB309B121BD_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""03DDF2878C0397BC"""
+"""85A7A4B96295F32E_980F9CA3D33EC913_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C=CC3=CC(=CC=C3)C(F)(F)F""",21,"""03DDF2878C0397BC"""
+"""BF5EFC6D70F4E5AA_0C1518FC1A964378_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""03DDF2878C0397BC"""
+"""70ABB7039280CF25_092EE659C6A69151_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""03DDF2878C0397BC"""
+"""501145A7A20E6F72_CCD540AEA6260D65_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""03DDF2878C0397BC"""
+"""0122B01C5AD4157A_DCF9D0FF79C8B991_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""03DDF2878C0397BC"""
+"""77F8BF8EF72EF27B_01EA89C6D76B4DEB_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""03DDF2878C0397BC"""
+"""3C7FCA5BDC160A96_91996DBC4E96C73E_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""03DDF2878C0397BC"""
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+"""6E14048632DD3616_EF9C853C31D7E4A3_6025_UN""","""C2(=NC1=C(C=CN=C1)O2)C3=C(C=CC=C3)CN4CCCC4""",21,"""03DDF2878C0397BC"""
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+"""6661908DDCD635E9_AA214EBF92883756_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=C(OCC)C=C3)OCC""",21,"""04A6E7C798036276"""
+"""031D547E219986D2_562139780D63C07C_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=CC(=C3)OCCC(C)C""",21,"""04A6E7C798036276"""
+"""C2D34387E9234A1A_0A1BC12E9E4FF678_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""04A6E7C798036276"""
+"""FB499E231563304F_3933AEEF192100D0_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=C(C=C3)OC4CCOC4""",21,"""04A6E7C798036276"""
+"""C08021271BB32AAA_F2D24A9BC156F423_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""04A6E7C798036276"""
+"""0116D1F8AF923024_2ABD6E979592E5AB_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=CC(=C3)COCCOC""",21,"""04A6E7C798036276"""
+"""AB168EA5CB8E724A_A3D0E3969B2EEEC7_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""04A6E7C798036276"""
+"""19593ED058CC4A28_BCCBF775AC6409A2_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=CC(=C3)OC(COC)C""",21,"""04A6E7C798036276"""
+"""95EAA9A3D043DFB3_EE8A0F4127D1A98E_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""04A6E7C798036276"""
+"""D90A0381C2AE5A8E_FB73E975BCAC08CC_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""04A6E7C798036276"""
+"""E4B44873104C5A4A_82C886594B9634B1_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=CC=C3)CN4CCCC4""",21,"""04A6E7C798036276"""
+"""77E03203A58D5625_9BECA25B23FADB31_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""04A6E7C798036276"""
+"""F16006A13AC99416_E618FDB9A4EC6A58_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=CC(=C3)OCCN(C)C""",21,"""04A6E7C798036276"""
+"""212758DC010E5E27_11C5317B358EC963_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""04A6E7C798036276"""
+"""0934789A493282F7_26E209FFC2E4CAD7_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""04A6E7C798036276"""
+"""63027D11DF2ABB00_F42EF77BE8EBE064_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""04A6E7C798036276"""
+"""6F1064873B2A09C5_24FB39F31DB1D477_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""04A6E7C798036276"""
+"""353CA6D005108506_0B6E0DBC0E96B6B2_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""04A6E7C798036276"""
+"""751F7C4A29C2136B_0E55F319D2A6649B_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""04A6E7C798036276"""
+"""23A9CE051E13EE0E_CBAE55EEB226F8AF_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""04A6E7C798036276"""
+"""80F85DA5182C2978_DB82C5BF6DC84C5B_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""04A6E7C798036276"""
+"""63DE6DF634393F2C_06919C86C36BB821_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""04A6E7C798036276"""
+"""D4B74D47BD75BF39_96E278FC5A9632F4_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""04A6E7C798036276"""
+"""ED7B2B6AC2D75053_B3C3C84FBA99FC2F_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""04A6E7C798036276"""
+"""D6B7CC957090EB8A_D53E780E93104D4F_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=C(OCCC(C)C)C=C3""",21,"""04A6E7C798036276"""
+"""FD5FDA6995CF5680_28531B186D5ADD1F_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=C(C=C3)OC4CCCC4""",21,"""04A6E7C798036276"""
+"""31A1F54008773507_A965C2E6DAA1B5CB_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""04A6E7C798036276"""
+"""CF814BB3FB29F7FF_DC1AA0D4A08D117C_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""04A6E7C798036276"""
+"""58CF7216DD84B36D_23FD6758778CEF91_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""04A6E7C798036276"""
+"""26DFB2B5B887CEC5_D47A8EAD5CF5C28F_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""04A6E7C798036276"""
+"""D167235F1E72A61F_A271A0B19499C5E4_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""04A6E7C798036276"""
+"""1C69C54F2041E312_6741318B0D7DAC9B_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""04A6E7C798036276"""
+"""CB50CD9998485C2A_0D2504ADF24BA7FB_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""04A6E7C798036276"""
+"""ADF0FAE187B65406_7C1EB6D8E3402908_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""04A6E7C798036276"""
+"""BE58D208AAE4E2BF_CED55AAD2109204A_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""04A6E7C798036276"""
+"""277E1E3D470E48E1_BB1BC8251BA5B078_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""04A6E7C798036276"""
+"""20B4197673C9207B_E8E7907C25D71169_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(C=CC=C3)CN4CCCC4""",21,"""04A6E7C798036276"""
+"""00B9AEF90E714142_7033C0FD9965F2D3_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""04A6E7C798036276"""
+"""AAD43BAB472A294A_7A34EAFEC018162E_6005_UN""","""C1(=CC2=C(C=C1)CCC2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""04A6E7C798036276"""
+"""7F35A75E722A711C_FB95ABE5094A6DD5_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](CCN)(=O)=O)C2CC2""",21,"""055DD50AD7B100CD"""
+"""70F0B97663C1FF2F_60EC7B6FA4E9627B_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(C(C)C)[S](=O)(=O)CCN""",21,"""055DD50AD7B100CD"""
+"""CC663223BD3743FA_376397DA4AA94127_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](C)(=O)=O)CCN=C=S""",21,"""055DD50AD7B100CD"""
+"""368DDBBAFD527581_2A759662040138EF_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](CC)(=O)=O)CCCN""",21,"""055DD50AD7B100CD"""
+"""C57FCB57B50F12BB_A0AA338FF2D50DCE_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](C)(=O)=O)C2CC(C2)N""",21,"""055DD50AD7B100CD"""
+"""51E55E06C9AB7E3E_E6703B88C2E08F4F_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(CCCN)[S](=O)(=O)CCl""",21,"""055DD50AD7B100CD"""
+"""1E555B06FEECE190_1391B7CE10721A0E_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2CNCC2""",21,"""055DD50AD7B100CD"""
+"""00E150DD5F3059B5_ADC9BCD9AF9DBFCA_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](CC)(=O)=O)CCCBr""",21,"""055DD50AD7B100CD"""
+"""4F4E83C5426F8B61_19133DD90A933C44_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(CCCNC)[S](=O)(=O)C""",21,"""055DD50AD7B100CD"""
+"""CFBCBA0DF5BF7283_FC7E35BF835A261C_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""055DD50AD7B100CD"""
+"""3D7C9DEC974E35BC_AE355FA4DF65F5D4_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](=O)(=O)CC#N)C2CC2""",21,"""055DD50AD7B100CD"""
+"""E5CE36F130334F66_2DE134D237C3B7C3_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""055DD50AD7B100CD"""
+"""0AB74BBAA9576077_EBE76322D39D0330_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""055DD50AD7B100CD"""
+"""73752706DE54C472_49413EBBC3D21171_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""055DD50AD7B100CD"""
+"""9ED91634BF49D5F5_842665F21C9C312E_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""055DD50AD7B100CD"""
+"""4F99ED1410CFE70F_705BCA45D39C6187_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""055DD50AD7B100CD"""
+"""704B7EA025A946F1_7AAF2D454FE75981_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""055DD50AD7B100CD"""
+"""B629F98B2EBF4457_788178644DECE9AA_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""055DD50AD7B100CD"""
+"""1E64687706A5A41B_EB4367289714324E_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""055DD50AD7B100CD"""
+"""37DB8710C4A89BE0_3BF2508E9169366A_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""055DD50AD7B100CD"""
+"""73B78692BABB8757_71FD373F06A7B1E7_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""055DD50AD7B100CD"""
+"""456719F795F1431C_9DC0A95D0C8D15E8_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""055DD50AD7B100CD"""
+"""E735BA47BE224576_942D1D39A7D83852_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](=O)(=O)C2CC2)CC#C""",21,"""055DD50AD7B100CD"""
+"""A52D18F6EE9EB644_C02D07B240D6FD94_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""055DD50AD7B100CD"""
+"""43B88C0812A6CFDB_E846484F65D2B17C_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N2CCCC(C)(C)[S]2(=O)=O""",21,"""055DD50AD7B100CD"""
+"""EF198E4D067CF201_236FB31BEC147A6F_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N2CCCC(CC)[S]2(=O)=O""",21,"""055DD50AD7B100CD"""
+"""3A266D702D2F1B9C_1206C3C189ADCCC0_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""055DD50AD7B100CD"""
+"""23B29E38DBDD8FF5_CD18A46FF3A5F5EE_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""055DD50AD7B100CD"""
+"""992D1FADFABEF597_66206AF6273568C2_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""055DD50AD7B100CD"""
+"""317BE9AFC092708D_264CDAA6220FB17C_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""055DD50AD7B100CD"""
+"""0FB8F3D5D260C7C6_8E034072D912AE14_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N2[S](CCN(C)CC2)(=O)=O""",21,"""055DD50AD7B100CD"""
+"""D77645887D5C0E46_029466FFB1BB45F7_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N2CC(=O)NCC[S]2(=O)=O""",21,"""055DD50AD7B100CD"""
+"""81236C8C2BCE393B_576F7BF61C1E8263_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N2[S](CCCCC2C)(=O)=O""",21,"""055DD50AD7B100CD"""
+"""0BB410A2ED365E02_2DC73E3AB2FE6D9D_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(CCN)[S](=O)(=O)C2CC2""",21,"""055DD50AD7B100CD"""
+"""BC46390DA03D8D96_4B3D18FB16D2FF6A_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(CCN)[S](=O)(=O)C(F)F""",21,"""055DD50AD7B100CD"""
+"""BA72C8E588BB2295_EB38849E28D90188_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N([S](CC)(=O)=O)C2CNC2""",21,"""055DD50AD7B100CD"""
+"""A30F40596C56DFE7_D9A150A2BF3055F5_6036_DP""","""C(C1CCNCC1)(C(F)(F)F)N3CC2(CNC2)C[S]3(=O)=O""",21,"""055DD50AD7B100CD"""
+"""17689071830FAAC7_63D4293066F3119F_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""055DD50AD7B100CD"""
+"""3CB684E229557070_9F3FB1606F91012F_6036_UN""","""C(C1CCNCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""055DD50AD7B100CD"""
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+"""66662097B81A4658_65D45FF482E8F761_6004_UN""","""NC1(CC1)C2=CC=C(S2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""063389B81796398C"""
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+"""DE87421F7347077A_B98EA65A9430EB82_6004_UN""","""NC1(CC1)C2=CC=C(S2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""063389B81796398C"""
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+"""56FFFF77BC757FB1_EC85593BEC2E9E57_2201_UN""","""CC2=NC1=C(N=CC=C1)C(=C2CC#C)C3=CC=C(C=C3)F""",21,"""063B589A52374B8E"""
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+"""98719ADDFC1C5A16_08021E341326B3F9_2201_UN""","""CC2=NC1=C(C=C(C=C1)F)C(=C2CC#C)C3=CC=CC=C3""",21,"""063B589A52374B8E"""
+"""EC6166BCCE9FB933_384B008084C76FF9_2201_UN""","""CC2=NC1=C(C=CC=N1)C(=C2CC#C)C3=CC(=CC=C3)Cl""",21,"""063B589A52374B8E"""
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+"""271DEC11BA86B491_C6D06CA839814800_2267_UN""","""CC(=O)CCC#CC1=C([N](N=C1C)C2C[S](CC2)(=O)=O)C""",21,"""063B589A52374B8E"""
+"""FB926B8070E5FF00_0C41E96C0B7028B8_2267_UN""","""CC(=O)CCC#CC1=C(C=CC=C1)C(=O)N2CCNCC2""",21,"""063B589A52374B8E"""
+"""627CBF55D1A4A3C0_4C4419FCEFC8E38A_2267_UN""","""CC(=O)CCC#CC1=CC=C(CCC(C)CC(=O)O)C=C1""",21,"""063B589A52374B8E"""
+"""9FA3939F0C69312D_0A30DE29C274473A_2267_UN""","""CC(=O)CCC#CC1=CC=C(C=C1)CCN2CCOCC2""",21,"""063B589A52374B8E"""
+"""769B85E56B4AD0D9_D97E35F085148A5C_2267_UN""","""CC(=O)CCC#CC1=C(C(OCC)=O)C=N[N]1C(C)(C)C""",21,"""063B589A52374B8E"""
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+"""0919515B6EE9B672_22230A079480EC40_2267_UN""","""CC(=O)CCC#CC1=CC(=CC(=C1)C(F)(F)F)C(OC)=O""",21,"""063B589A52374B8E"""
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+"""E352F761C17E92A6_19BB2F9A8E93BF06_2267_UN""","""CC(=O)CCC#CC2=C(C(O)C1=CC=CC=C1)C=CC=C2""",21,"""063B589A52374B8E"""
+"""A45226253902CE4A_90F0CA6DEC3C2036_2267_UN""","""CC(=O)CCC#CC1=CC=CC(=C1)[N]2C=CC=C2C(O)=O""",21,"""063B589A52374B8E"""
+"""7B185460CF5A1CC1_AB24892539C8D27F_2267_UN""","""CC(=O)CCC#CC1=CC=CC(=C1)C(O)C2=CC=CC=C2""",21,"""063B589A52374B8E"""
+"""301B1F710E9C4620_70173980B9C50FEC_2267_UN""","""CC(=O)CCC#CC1=CC(=CC=C1)C(=O)C2=CC=CC=C2""",21,"""063B589A52374B8E"""
+"""2A376DFE670AF821_07B3A5EA3C387108_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""0643F4BECDA388D4"""
+"""EABE228E10B8D05D_A8C45DC6C728DDF4_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""0643F4BECDA388D4"""
+"""12C76F22ED3D4B02_54C42A0158C32ADE_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""0643F4BECDA388D4"""
+"""093FCEF13F8804AE_08FED257CBEF1CDA_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""0643F4BECDA388D4"""
+"""8C10DDA6AE607B79_3BD6BD964C81EA72_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""0643F4BECDA388D4"""
+"""FE7A6F550727B215_F03759E294F61E81_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""0643F4BECDA388D4"""
+"""E7B8E08AD9F90C95_28587DEEC0320F09_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=CC(=C2)COCCOC""",21,"""0643F4BECDA388D4"""
+"""DDE853842E32A7D8_A135F0EFCE8E0465_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""0643F4BECDA388D4"""
+"""DDE54AB2DE8633E2_BE2EE40CF9C4E300_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""0643F4BECDA388D4"""
+"""F6C61955DF39F098_EC6F1C387271432C_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""0643F4BECDA388D4"""
+"""5F3C1DF4AA731041_F996FA0CE90CE26E_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""0643F4BECDA388D4"""
+"""4EF0B7A96094D8DD_802D95201E36DE13_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""0643F4BECDA388D4"""
+"""4B7D121AFCF3ACAA_9909B122765A3193_6005_UN""","""COC(=O)C1=NOC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""0643F4BECDA388D4"""
+"""8F57E9C19B568D7D_E4FDEEC0F14C80FA_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""0643F4BECDA388D4"""
+"""4B357455DC00A127_13202202602E23C1_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""0643F4BECDA388D4"""
+"""BA73B87E9D2996AF_24071A8697442075_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""0643F4BECDA388D4"""
+"""E8F7F2B6E648899B_F6CBE402BD4B0AC6_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""0643F4BECDA388D4"""
+"""FB4A60EC48D64259_261E2A8A48113ED5_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""0643F4BECDA388D4"""
+"""559494BF835A8EAB_098B1EC55B365C10_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""0643F4BECDA388D4"""
+"""BD749D165017C7FA_0CB0E06087068E39_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""0643F4BECDA388D4"""
+"""725E0B8494E57063_C94B4697E786120D_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""0643F4BECDA388D4"""
+"""365BA67D6761B8EB_D967D6C63868A6F9_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""0643F4BECDA388D4"""
+"""F3688BCF480D012D_04748FFF96CB5283_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""0643F4BECDA388D4"""
+"""9212BBBBE5E3534B_94076B850F36D856_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""0643F4BECDA388D4"""
+"""BECF7B3965F9D95A_B126DB36EF39168D_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""0643F4BECDA388D4"""
+"""678E719E8F4FCD4D_D7DB6B77C6B0A7ED_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""0643F4BECDA388D4"""
+"""C2EB4831C9665021_2AB6086138FA37BD_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""0643F4BECDA388D4"""
+"""5A5D878EEA65D2AF_AB80D19F8F015F69_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""0643F4BECDA388D4"""
+"""D021ECE58B8F7E6D_DEFFB3ADF52DFBDE_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""0643F4BECDA388D4"""
+"""9EB57FB4E7F35CC1_21187421222C0533_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""0643F4BECDA388D4"""
+"""4EC8445E98A7346D_D69F9DD40955282D_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""0643F4BECDA388D4"""
+"""4B7516EC7925ADE9_A094B3C8C1392F46_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""0643F4BECDA388D4"""
+"""DB64AE059CEEB960_65A422F258DD4639_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""0643F4BECDA388D4"""
+"""3AC23F85D36B87BB_0FC017D4A7EB4D59_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""0643F4BECDA388D4"""
+"""E812FFAC192020F0_7EFBA5A1B6E0C3AA_6005_UN""","""COC(=O)C1=NOC(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""0643F4BECDA388D4"""
+"""11B1AF816BA63478_CC3049D474A9CAE8_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""0643F4BECDA388D4"""
+"""A6EC6B44A0C1B23B_B9FEDB5C4E055ADA_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""0643F4BECDA388D4"""
+"""08A6FD3AEE839144_EA0283057077FBCB_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""0643F4BECDA388D4"""
+"""18D5A09C1B8DCE97_72D6D384CCC51871_6005_UN""","""COC(=O)C1=NOC(=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""0643F4BECDA388D4"""
+"""CAE25D5DAC5FC551_78D1F98795B8FC8C_6005_UN""","""COC(=O)C1=NOC(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""0643F4BECDA388D4"""
+"""B22113EFC8AB8A96_F6E16EBD7B4355A5_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](CCN)(=O)=O)C2CC2""",21,"""08291052A5B838BD"""
+"""F56F82B1489CCFB0_6D98BE37D6E05A0B_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C(C)C)[S](=O)(=O)CCN""",21,"""08291052A5B838BD"""
+"""AC46626CACEB50B2_3A17528238A07957_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](C)(=O)=O)CCN=C=S""",21,"""08291052A5B838BD"""
+"""528D9A5225D4D7A0_2701533A7608009F_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](CC)(=O)=O)CCCN""",21,"""08291052A5B838BD"""
+"""CF72E94832D2E2A8_ADDEF6D780DC35BE_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](C)(=O)=O)C2CC(C2)N""",21,"""08291052A5B838BD"""
+"""1A1CA7CDA821E12A_EB04FED0B0E9B73F_6036_UN""","""NCCC(=O)N1CCC(CC1)N(CCCN)[S](=O)(=O)CCl""",21,"""08291052A5B838BD"""
+"""D613F5CD9099518F_1EE57296627B227E_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C)[S](=O)(=O)C2CNCC2""",21,"""08291052A5B838BD"""
+"""1E626BD244B66AE6_A0BD7981DD9487BA_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](CC)(=O)=O)CCCBr""",21,"""08291052A5B838BD"""
+"""2D44497EC2E7B63C_1467F881789A0434_6036_UN""","""NCCC(=O)N1CCC(CC1)N(CCCNC)[S](=O)(=O)C""",21,"""08291052A5B838BD"""
+"""4C5DF47E4E17811F_F10AF0E7F1531E6C_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""08291052A5B838BD"""
+"""9286BB4CE457590F_A3419AFCAD6CCDA4_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](=O)(=O)CC#N)C2CC2""",21,"""08291052A5B838BD"""
+"""53D142AA730AAAE9_2095F18A45CA8FB3_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](C)(=O)=O)C(=O)CCN""",21,"""08291052A5B838BD"""
+"""C7C365BCFB733338_E693A67AA1943B40_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""08291052A5B838BD"""
+"""6E6E2D9DAD84AAD2_4435FBE3B1DB2901_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""08291052A5B838BD"""
+"""9532EB1192974286_8952A0AA6E95095E_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""08291052A5B838BD"""
+"""0F8BDC3022073FE0_7D2F0F1DA19559F7_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""08291052A5B838BD"""
+"""94565288850964EE_77DBE81D3DEE61F1_6036_UN""","""NCCC(=O)N1CCC(CC1)N(CC(CC)N)[S](=O)(=O)C""",21,"""08291052A5B838BD"""
+"""76B3690DA6BB6780_75F5BD3C3FE5D1DA_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""08291052A5B838BD"""
+"""FCC71B059151AD7F_E637A270E51D0A3E_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](C)(=O)=O)CCN=[N]#N""",21,"""08291052A5B838BD"""
+"""F9834C81A11A2299_368695D6E3600E1A_6036_UN""","""NCCC(=O)N1CCC(CC1)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""08291052A5B838BD"""
+"""4368C8026C3505E5_7C89F26774AE8997_6036_UN""","""NCCC(=O)N1CCC(CC1)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""08291052A5B838BD"""
+"""95F11D26DC9DC6D6_90B46C057E842D98_6036_UN""","""NCCC(=O)N1CCC(CC1)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""08291052A5B838BD"""
+"""C77C4CF5119FE575_9959D861D5D10022_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](=O)(=O)C2CC2)CC#C""",21,"""08291052A5B838BD"""
+"""3388BF092F23AD21_CD59C2EA32DFC5E4_6036_UN""","""NCCC(=O)N1CCC(CC1)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""08291052A5B838BD"""
+"""106CF372FC3AB77F_E5328D1717DB890C_6036_UN""","""NCCC(=O)N1CCC(CC1)N2CCCC(C)(C)[S]2(=O)=O""",21,"""08291052A5B838BD"""
+"""8033A1B87498C13F_2E1B76439E1D421F_6036_UN""","""NCCC(=O)N1CCC(CC1)N2CCCC(CC)[S]2(=O)=O""",21,"""08291052A5B838BD"""
+"""BBD0E77D083A8F71_1F720699FBA4F4B0_6036_UN""","""NCCC(=O)N1CCC(CC1)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""08291052A5B838BD"""
+"""0B3CB8BE1501D699_C06C613781ACCD9E_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""08291052A5B838BD"""
+"""8482C7642ED88E2A_6B54AFAE553C50B2_6036_UN""","""NCCC(=O)N1CCC(CC1)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""08291052A5B838BD"""
+"""C5F79ABEBEF8689E_2B381FFE5006890C_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""08291052A5B838BD"""
+"""A01C4FEB5BBD2933_8377852AAB1B9664_6036_UN""","""NCCC(=O)N1CCC(CC1)N2[S](CCN(C)CC2)(=O)=O""",21,"""08291052A5B838BD"""
+"""6D9E6C7C4F540EFD_0FE0A3A7C3B27D87_6036_UN""","""NCCC(=O)N1CCC(CC1)N2CC(=O)NCC[S]2(=O)=O""",21,"""08291052A5B838BD"""
+"""3C13D50F045ACB76_5A1BBEAE6E17BA13_6036_UN""","""NCCC(=O)N1CCC(CC1)N2[S](CCCCC2C)(=O)=O""",21,"""08291052A5B838BD"""
+"""ED6009E3EBF90A5E_20B3FB62C0F755ED_6036_UN""","""NCCC(=O)N1CCC(CC1)N(CCN)[S](=O)(=O)C2CC2""",21,"""08291052A5B838BD"""
+"""267ABC698FC071E9_4649DDA364DBC71A_6036_UN""","""NCCC(=O)N1CCC(CC1)N(CCN)[S](=O)(=O)C(F)F""",21,"""08291052A5B838BD"""
+"""3D33A870296BC21B_E64C41C65AD039F8_6036_UN""","""NCCC(=O)N1CCC(CC1)N([S](CC)(=O)=O)C2CNC2""",21,"""08291052A5B838BD"""
+"""BA67794AA2CA4E10_D4D595FACD396D85_6036_DP""","""NCCC(=O)N1CCC(CC1)N3CC2(CNC2)C[S]3(=O)=O""",21,"""08291052A5B838BD"""
+"""A25B05FDD102EC33_6EA0EC6814FA29EF_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""08291052A5B838BD"""
+"""C67880CDEDFF0D36_924B74381D98395F_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""08291052A5B838BD"""
+"""DA004AFE132FCF10_AC2A138FD0A6F1C4_6036_UN""","""NCCC(=O)N1CCC(CC1)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""08291052A5B838BD"""
+"""20BB60A6AC0C96B3_761A0939CD34F670_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](C)(=O)=O)CCCN)C""",21,"""0885357500675151"""
+"""A822F256EC082DED_DCEF3D9FCDC8B9DE_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](CC)(=O)=O)CCBr)C""",21,"""0885357500675151"""
+"""4A9662797E98EF9A_D263CBB0D883273F_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN(CCNC)[S](=O)(=O)C)C""",21,"""0885357500675151"""
+"""A9884DF476B46D8C_2E19F7F4D3F2EA35_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](CCCC)(=O)=O)C)C""",21,"""0885357500675151"""
+"""97F774F473D9ABFE_1A0A15A90152916A_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2C(C(C)(C)[S]2(=O)=O)=O)C""",21,"""0885357500675151"""
+"""E170AF5CAE406E46_0AEC041BB060C8A7_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](C)(=O)=O)CCC#C)C""",21,"""0885357500675151"""
+"""AF38D0AF56391F0B_03AE0AAE5E5FE503_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN(C)[S](=O)(=O)CCCCl)C""",21,"""0885357500675151"""
+"""363A27C229C964E1_425240AA584F7CC8_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](CC)(=O)=O)CC#C)C""",21,"""0885357500675151"""
+"""EC6391E18FE1CA35_1B81ACFC3B8C85A8_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2[S](CCCC2=O)(=O)=O)C""",21,"""0885357500675151"""
+"""3362A47CB74A9F49_C97F3064C475BBFE_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2C(C(N)C[S]2(=O)=O)=O)C""",21,"""0885357500675151"""
+"""F7C144FBB4382031_ECB657E79A9A262A_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](C)(=O)=O)C2CNC2)C""",21,"""0885357500675151"""
+"""B4CBF1A53376FC1A_3661B814F87C8905_6036_DP""","""CCOC(=O)C1=C([NH]C(=C1)CN[S](=O)(=O)C2(CC2)C#N)C""",21,"""0885357500675151"""
+"""8556CEAF92129542_216DE13827ED1F0D_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN(C)[S](=O)(=O)CCCN)C""",21,"""0885357500675151"""
+"""5D4E501E0CC08540_8874C2DC9AA9EB32_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN(C)[S](=O)(=O)C2COC2)C""",21,"""0885357500675151"""
+"""C124B94B28B9C97C_E851133E46045BAD_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN(C)[S](=O)(=O)CCOC)C""",21,"""0885357500675151"""
+"""A72B72E9206413FB_468F8EDC923489B8_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN(C)[S](=O)(=O)CC(=O)C)C""",21,"""0885357500675151"""
+"""4536E895FA4EF4B8_CEA7E86854BABAF5_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2CCCC(C)[S]2(=O)=O)C""",21,"""0885357500675151"""
+"""6D99CCB31F7A2169_C348CE8FED838150_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2CCC(C)(C)[S]2(=O)=O)C""",21,"""0885357500675151"""
+"""FBFF4DDDBF05B7A5_F8E06F4EECB4730F_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](CC)(=O)=O)CCN)C""",21,"""0885357500675151"""
+"""2C0F895793C24012_B94DF3F4D2F275BB_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN(CC)[S](=O)(=O)CCN)C""",21,"""0885357500675151"""
+"""F59EAC22020DF558_03DE5801D3E480F6_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN(C)[S](=O)(=O)C(C)(C)C)C""",21,"""0885357500675151"""
+"""CACCF1BBB5C39AE3_8BE66B6B114995CA_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2[S](=O)(=O)C3(CC2)CC3)C""",21,"""0885357500675151"""
+"""0D8FA871989F5A9E_E4C0FD5684CFDD94_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](CCNC)(=O)=O)C)C""",21,"""0885357500675151"""
+"""0D8FA871989F5A9E_383007C07D50D6B2_6036_DP""","""CCOC(=O)C1=C([NH]C(=C1)CN(C)[S](=O)(=O)CCNC)C""",21,"""0885357500675151"""
+"""8E85D408DFA03F40_298D832C066A1169_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2[S](CCC2CI)(=O)=O)C""",21,"""0885357500675151"""
+"""B549333207B76B6F_B58B28E47C641FA4_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2C(CN)CC[S]2(=O)=O)C""",21,"""0885357500675151"""
+"""28CA04778B8E8404_26DCF71E04AEB2DC_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN(CC(C)C)[S](=O)(=O)C)C""",21,"""0885357500675151"""
+"""9A11CA209F9A21A3_BAD562B47DA4DF0B_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2[S](=O)(CCNCC2)=O)C""",21,"""0885357500675151"""
+"""054AA6C7490EA7B6_083279EA56351FA0_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](C=C)(=O)=O)C2CC2)C""",21,"""0885357500675151"""
+"""ECC17F5405EE339E_A835F9E98030165F_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2CC3(C[S]2(=O)=O)CC3)C""",21,"""0885357500675151"""
+"""6CEBA85E740055A6_647E8AD8886F071D_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](C)(=O)=O)C(=O)CN)C""",21,"""0885357500675151"""
+"""D2DA82AA2BC5A2A1_86FDC4EE581A38D3_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN2CCCCC[S]2(=O)=O)C""",21,"""0885357500675151"""
+"""CEB74CFC49C756A0_945658085A52F68F_6036_UN""","""CCOC(=O)C1=C([NH]C(=C1)CN([S](C)(=O)=O)CCCBr)C""",21,"""0885357500675151"""
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+"""C78B0DA595022AA2_249D8160760D861E_6004_UN""","""NC1=NC(=C(C=C1)C2=CC=CC(=C2)COCCOC)C#N""",21,"""0A8608307B9C01C3"""
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+"""52E674979126430C_E0AAE0B6C44ECA3B_6004_UN""","""NC1=NC(=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F)C#N""",21,"""0A8608307B9C01C3"""
+"""1011628AFC205FA3_F55306825F336B79_6004_UN""","""NC1=NC(=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)C#N""",21,"""0A8608307B9C01C3"""
+"""DE18AE017128B3AF_8CE869AEA8095704_6004_UN""","""NC1=NC(=C(C=C1)C2=CC(=CC=C2)CN3CCCC3)C#N""",21,"""0A8608307B9C01C3"""
+"""490909A4B4F798DD_95CC4DACC065B884_6004_UN""","""NC1=NC(=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)C#N""",21,"""0A8608307B9C01C3"""
+"""62F3DA75AB75E11B_E838124E477309ED_6004_UN""","""NC1=NC(=C(C=C1)C2=CC=CC(=C2)OCCN(C)C)C#N""",21,"""0A8608307B9C01C3"""
+"""308CF3F471F7EBC0_1FE5DE8CD611AAD6_6004_UN""","""NC1=NC(=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)C#N""",21,"""0A8608307B9C01C3"""
+"""0FD1BC36F658A8E1_28C2E608217BA962_6004_UN""","""NC1=NC(=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)C#N""",21,"""0A8608307B9C01C3"""
+"""C33A18AEE4EAFEBF_FA0E188C0B7483D1_6004_UN""","""NC1=NC(=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F)C#N""",21,"""0A8608307B9C01C3"""
+"""76F76FA97A7D4BD2_2ADBD604FE2EB7C2_6004_UN""","""NC1=NC(=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)C#N""",21,"""0A8608307B9C01C3"""
+"""B8123276020219C1_054EE24BED09D507_6004_UN""","""NC1=NC(=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)C#N""",21,"""0A8608307B9C01C3"""
+"""E0C952AD087C1AD1_00751CEE3139072E_6004_UN""","""NC1=NC(=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O)C#N""",21,"""0A8608307B9C01C3"""
+"""F82209F727BD8BB4_C58EBA1951B99B1A_6004_UN""","""NC1=NC(=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)C#N""",21,"""0A8608307B9C01C3"""
+"""7E5D8A3980FC5915_D5A22A488E572FEE_6004_UN""","""NC1=NC(=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)C#N""",21,"""0A8608307B9C01C3"""
+"""275B6D5EEBDD5739_08B1737120F4DB94_6004_UN""","""NC1=NC(=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3)C#N""",21,"""0A8608307B9C01C3"""
+"""722FA26B1654DFC6_98C2970BB9095141_6004_UN""","""NC1=NC(=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)C#N""",21,"""0A8608307B9C01C3"""
+"""00D7D44AB34B4614_BDE327B859069F9A_6004_UN""","""NC1=NC(=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)C#N""",21,"""0A8608307B9C01C3"""
+"""6BA470DCD8DDA2F2_DB1E97F9708F2EFA_6004_UN""","""NC1=NC(=C(C=C1)C2=CC=C(OCCC(C)C)C=C2)C#N""",21,"""0A8608307B9C01C3"""
+"""5A1AF277D75EA63C_2673F4EF8EC5BEAA_6004_UN""","""NC1=NC(=C(C=C1)C2=CC=C(C=C2)OC3CCCC3)C#N""",21,"""0A8608307B9C01C3"""
+"""89C3F44A81472CED_A7452D11393ED67E_6004_UN""","""NC1=NC(=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C)C#N""",21,"""0A8608307B9C01C3"""
+"""2E916EC61973EF0B_D23A4F23431272C9_6004_UN""","""NC1=NC(=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)C#N""",21,"""0A8608307B9C01C3"""
+"""588A13343CC9487F_2DDD88AF94138C24_6004_UN""","""NC1=NC(=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3)C#N""",21,"""0A8608307B9C01C3"""
+"""F5A5CAEEA2231F3D_DA5A615ABF6AA13A_6004_UN""","""NC1=NC(=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)C#N""",21,"""0A8608307B9C01C3"""
+"""B0B0351280D5E1CC_AC514F467706A651_6004_UN""","""NC1=NC(=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2)C#N""",21,"""0A8608307B9C01C3"""
+"""0BD5A7191680CC65_6961DE7CEEE2CF2E_6004_UN""","""NC1=NC(=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)C#N""",21,"""0A8608307B9C01C3"""
+"""EFA7298A3FE4BDD5_0305EB5A11D4C44E_6004_UN""","""NC1=NC(=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)C#N""",21,"""0A8608307B9C01C3"""
+"""4C4A1F07FB3B5A7F_723E592F00DF4ABD_6004_UN""","""NC1=NC(=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)C#N""",21,"""0A8608307B9C01C3"""
+"""AE07EBB159A49690_C0F5B55AC29643FF_6004_UN""","""NC1=NC(=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)C#N""",21,"""0A8608307B9C01C3"""
+"""91146F748F9044BB_B53B27D2F83AD3CD_6004_UN""","""NC1=NC(=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3)C#N""",21,"""0A8608307B9C01C3"""
+"""BDD530A43858C4AB_E6C77F8BC64872DC_6004_UN""","""NC1=NC(=C(C=C1)C2=C(C=CC=C2)CN3CCCC3)C#N""",21,"""0A8608307B9C01C3"""
+"""F4FF66DC1839A910_7E132F0A7AFA9166_6004_UN""","""NC1=NC(=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C)C#N""",21,"""0A8608307B9C01C3"""
+"""27FA350E749DED2A_741405092387759B_6004_UN""","""NC1=NC(=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)C#N""",21,"""0A8608307B9C01C3"""
+"""7A1E2DAA4842AB5E_0B2A000CB24781BB_6004_UN""","""CNC1=C(N=C(C=C1)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""0ADA515843DC7867"""
+"""0C403EF8F29DC592_A45DF82049572D47_6004_UN""","""CNC1=C(N=C(C=C1)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""0ADA515843DC7867"""
+"""7DC0A0D2C63AD2E0_585D8FE7D6BCDA6D_6004_UN""","""CNC1=C(N=C(C=C1)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""0ADA515843DC7867"""
+"""8A1D1CE66A6D07C5_046777B14590EC69_6004_UN""","""CNC1=C(N=C(C=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""0ADA515843DC7867"""
+"""5EAB289AF37D38CB_374F1870C2FE1AC1_6004_UN""","""CNC1=C(N=C(C=C1)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""0ADA515843DC7867"""
+"""AC8222EE46889B50_FCAEFC041A89EE32_6004_UN""","""CNC1=C(N=C(C=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""0ADA515843DC7867"""
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+"""E61DC165081009D8_DBAC754367B8AB77_6004_UN""","""NC(=N)C1=NC=CC(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""0B701C29A34E0B8E"""
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+"""46F27EC3EDE496EA_6897CA653630C563_6004_UN""","""NC(=N)C1=NC=CC(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""0B701C29A34E0B8E"""
+"""8FB6394CB15E44A6_02F3FF43C906CE03_6004_UN""","""NC(=N)C1=NC=CC(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""0B701C29A34E0B8E"""
+"""EAB31ADDD5C83E95_73C84D36D80D40F0_6004_UN""","""NC(=N)C1=NC=CC(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""0B701C29A34E0B8E"""
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+"""D85DF72E4F6F1F6E_75E21110FB557FD6_6004_UN""","""NC(=N)C1=NC=CC(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""0B701C29A34E0B8E"""
+"""B2808AA648322173_F55BD16035A7A139_6036_UN""","""CC(C(N)CN([S](CCN)(=O)=O)C1CC1)C2=CC=CC=C2""",21,"""0B93AF8FEB5CCC21"""
+"""DD47A156189AFBD1_6E2201EA9804AE97_6036_UN""","""CC(C(N)CN(C(C)C)[S](=O)(=O)CCN)C1=CC=CC=C1""",21,"""0B93AF8FEB5CCC21"""
+"""7BA036BFCD29E5C1_39ADED5F76448DCB_6036_UN""","""CC(C(N)CN([S](C)(=O)=O)CCN=C=S)C1=CC=CC=C1""",21,"""0B93AF8FEB5CCC21"""
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+"""1CB355CCAFB6F61C_AE64490ACE38C122_6036_UN""","""CC(C(N)CN([S](C)(=O)=O)C1CC(C1)N)C2=CC=CC=C2""",21,"""0B93AF8FEB5CCC21"""
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+"""12B60A7AFD5168A4_A307C65C93707326_6036_UN""","""CC(C(N)CN([S](CC)(=O)=O)CCCBr)C1=CC=CC=C1""",21,"""0B93AF8FEB5CCC21"""
+"""ED2C91091C9A25B1_17DD475C367EF0A8_6036_UN""","""CC(C(N)CN(CCCNC)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""0B93AF8FEB5CCC21"""
+"""B00FC7D8576BE41C_F2B04F3ABFB7EAF0_6036_UN""","""CC(C(N)CN(C(C)(C)C#N)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""0B93AF8FEB5CCC21"""
+"""4CDB53933A3D162F_A0FB2521E3883938_6036_UN""","""CC(C(N)CN([S](=O)(=O)CC#N)C1CC1)C2=CC=CC=C2""",21,"""0B93AF8FEB5CCC21"""
+"""CCE8C434C330D184_232F4E570B2E7B2F_6036_UN""","""CC(C(N)CN([S](C)(=O)=O)C(=O)CCN)C1=CC=CC=C1""",21,"""0B93AF8FEB5CCC21"""
+"""7394DBEBE36C44BD_E52919A7EF70CFDC_6036_UN""","""CC(C(N)CN(C)[S](=O)(=O)C1=CC=CS1)C2=CC=CC=C2""",21,"""0B93AF8FEB5CCC21"""
+"""EBF759EE608EF012_478F443EFF3FDD9D_6036_UN""","""CC(C(N)CN(C(C)(C)C)[S](=O)(=O)CCl)C1=CC=CC=C1""",21,"""0B93AF8FEB5CCC21"""
+"""D242D040EF227F72_8AE81F772071FDC2_6036_UN""","""CC(C(N)CN(C(C)(C)C)[S](=O)(=O)CBr)C1=CC=CC=C1""",21,"""0B93AF8FEB5CCC21"""
+"""4403F598D3D76783_7E95B0C0EF71AD6B_6036_UN""","""CC(C(N)CN(C(C)(C)C#C)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""0B93AF8FEB5CCC21"""
+"""1368CF0A2243AAD0_746157C0730A956D_6036_UN""","""CC(C(N)CN(CC(CC)N)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""0B93AF8FEB5CCC21"""
+"""30857C9C02188A59_764F02E171012546_6036_UN""","""CC(C(N)CN(C)[S](=O)(=O)C1=C[NH]C=N1)C2=CC=CC=C2""",21,"""0B93AF8FEB5CCC21"""
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+"""667E9691CCC87D18_AA2A6F0076CF53F1_6005_UN""","""COC1=C(C=C(N=C1)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""0CFD28767A55F463"""
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+"""F04065F3F0822E6D_B3400794F9F3266D_6005_UN""","""COC1=C(C=C(N=C1)F)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""0CFD28767A55F463"""
+"""EE21DE06ED31558A_E0BC5FCDC781877C_6005_UN""","""COC1=C(C=C(N=C1)F)C2=C(C=CC=C2)CN3CCCC3""",21,"""0CFD28767A55F463"""
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+"""727F9A841527FFDD_726F254F224E803B_6005_UN""","""COC1=C(C=C(N=C1)F)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""0CFD28767A55F463"""
+"""FA61AFE7F66F39AD_0C979DF79F3A272F_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=CC=C2)OC3CCCC3""",21,"""0D67CCA36EA1DEF3"""
+"""BAB0376CED97673D_A3E065DB642A8BD3_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=C(OCC)C=C2)OCC""",21,"""0D67CCA36EA1DEF3"""
+"""1C9CC4EB0F5C3669_5FE0121CFBC17CF9_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=CC(=C2)OCCC(C)C""",21,"""0D67CCA36EA1DEF3"""
+"""53D61D25CED04F09_03DAEA4A68ED4AFD_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""0D67CCA36EA1DEF3"""
+"""51D371469F1FD75C_30F2858BEF83BC55_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=C(C=C2)OC3CCOC3""",21,"""0D67CCA36EA1DEF3"""
+"""F9C9B9D41D827DAD_FB1361FF37F448A6_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""0D67CCA36EA1DEF3"""
+"""8B83225120D6C091_237C45F36330592E_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=CC(=C2)COCCOC""",21,"""0D67CCA36EA1DEF3"""
+"""63DDD31A3F6BAE7B_AA11C8F26D8C5242_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""0D67CCA36EA1DEF3"""
+"""F66F42FD8226DE39_B50ADC115AC6B527_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=CC(=C2)OC(COC)C""",21,"""0D67CCA36EA1DEF3"""
+"""2CF9C15604BCA9DC_E74B2425D173150B_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""0D67CCA36EA1DEF3"""
+"""900C3C820EF8347E_F2B2C2114A0EB449_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""0D67CCA36EA1DEF3"""
+"""92E0558A5E3BD876_8B09AD3DBD348834_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=CC=C2)CN3CCCC3""",21,"""0D67CCA36EA1DEF3"""
+"""35F25A05E040ECB7_922D893FD55867B4_6005_UN""","""CNC1=C(C=C(C=C1)F)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""0D67CCA36EA1DEF3"""
+"""D84A3B88BFEDC302_EFD9D6DD524ED6DD_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=CC(=C2)OCCN(C)C""",21,"""0D67CCA36EA1DEF3"""
+"""2296108C3F0DF265_18041A1FC32C75E6_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""0D67CCA36EA1DEF3"""
+"""11DB81D2CF74AC5C_2F23229B34467652_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""0D67CCA36EA1DEF3"""
+"""8509AB902FBE3A9D_FDEFDC1F1E495CE1_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""0D67CCA36EA1DEF3"""
+"""EE77BBAE8CE44B70_2D3A1297EB1368F2_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""0D67CCA36EA1DEF3"""
+"""9E82CF793B4792AA_02AF26D8F8340A37_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""0D67CCA36EA1DEF3"""
+"""708B72C174137E98_0794D87D2404D81E_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""0D67CCA36EA1DEF3"""
+"""04F30FE2844D8912_C26F7E8A4484442A_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""0D67CCA36EA1DEF3"""
+"""EAAC7537C5E6D029_D243EEDB9B6AF0DE_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""0D67CCA36EA1DEF3"""
+"""F8892BAE1992B1D1_0F50B7E235C904A4_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""0D67CCA36EA1DEF3"""
+"""E3EAFF5B5083B325_9F235398AC348E71_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""0D67CCA36EA1DEF3"""
+"""DCA3CB20B7CDF153_BA02E32B4C3B40AA_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""0D67CCA36EA1DEF3"""
+"""95DAF76DB6AE1AE2_DCFF536A65B2F1CA_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=C(OCCC(C)C)C=C2""",21,"""0D67CCA36EA1DEF3"""
+"""D9BE58BF960E159E_2192307C9BF8619A_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=C(C=C2)OC3CCCC3""",21,"""0D67CCA36EA1DEF3"""
+"""C6FA3FEE6883B3AA_A0A4E9822C03094E_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""0D67CCA36EA1DEF3"""
+"""84A49D2501C711C8_D5DB8BB0562FADF9_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""0D67CCA36EA1DEF3"""
+"""D538E68683A46074_2A3C4C3C812E5314_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""0D67CCA36EA1DEF3"""
+"""CC80B8943B2DA32B_DDBBA5C9AA577E0A_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""0D67CCA36EA1DEF3"""
+"""ADCF504B22F203C0_ABB08BD5623B7961_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""0D67CCA36EA1DEF3"""
+"""32D915DB4FC0288A_6E801AEFFBDF101E_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""0D67CCA36EA1DEF3"""
+"""2437F78AA13CA99C_04E42FC904E91B7E_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""0D67CCA36EA1DEF3"""
+"""70E3BA541FD04323_75DF9DBC15E2958D_6005_UN""","""CNC1=C(C=C(C=C1)F)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""0D67CCA36EA1DEF3"""
+"""0E1F42785C6541B1_C71471C9D7AB9CCF_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""0D67CCA36EA1DEF3"""
+"""CAC896C2B104EE04_B2DAE341ED070CFD_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""0D67CCA36EA1DEF3"""
+"""834B652E175110DC_E126BB18D375ADEC_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(C=CC=C2)CN3CCCC3""",21,"""0D67CCA36EA1DEF3"""
+"""7ECA965BE8BFB768_79F2EB996FC74E56_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=CC(=N[N]2C3CCCCO3)C""",21,"""0D67CCA36EA1DEF3"""
+"""36B30477870F9279_73F5C19A36BAAAAB_6005_UN""","""CNC1=C(C=C(C=C1)F)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""0D67CCA36EA1DEF3"""
+"""C3F5F303907B5C15_F369F6593A56FC51_6036_UN""","""CC1=C(C=CC(=C1)SCCN([S](CCN)(=O)=O)C2CC2)N""",21,"""0DA188B6E4AD9149"""
+"""B15E3DBDF6EF80D3_681026D397F5F3FF_6036_UN""","""CC1=C(C=CC(=C1)SCCN(C(C)C)[S](=O)(=O)CCN)N""",21,"""0DA188B6E4AD9149"""
+"""5C9E7019ABC141BD_3F9FCA6679B5D0A3_6036_UN""","""CC1=C(C=CC(=C1)SCCN([S](C)(=O)=O)CCN=C=S)N""",21,"""0DA188B6E4AD9149"""
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+"""DE40083C56507E98_045C66C1F65006D2_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""0EAF721FBCF5003F"""
+"""14856EC10A3D2F1B_C1A7C03696D09AE6_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""0EAF721FBCF5003F"""
+"""5D85DB418E45B6E0_D18B5067493E2E12_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""0EAF721FBCF5003F"""
+"""2F6B5060A6CB8E07_0C98095EE79DDA68_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""0EAF721FBCF5003F"""
+"""7E2D173351079753_9CEBED247E6050BD_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""0EAF721FBCF5003F"""
+"""4562115F36B95011_B9CA5D979E6F9E66_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""0EAF721FBCF5003F"""
+"""AED4E4E349CA24D1_DF37EDD6B7E62F06_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=CC=C(OCCC(C)C)C=C2""",21,"""0EAF721FBCF5003F"""
+"""7C359EEDA9E9DCD4_225A8EC049ACBF56_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=CC=C(C=C2)OC3CCCC3""",21,"""0EAF721FBCF5003F"""
+"""F0E7F74CCA110997_A36C573EFE57D782_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""0EAF721FBCF5003F"""
+"""68F472B461357272_D613350C847B7335_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""0EAF721FBCF5003F"""
+"""62D2B589DA6115E1_29F4F280537A8DD8_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""0EAF721FBCF5003F"""
+"""69B2A67E9F2822BA_DE731B757803A0C6_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""0EAF721FBCF5003F"""
+"""A0CF591C2CDEBBCE_A8783569B06FA7AD_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""0EAF721FBCF5003F"""
+"""73946DEEA25A5F8C_6D48A453298BCED2_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""0EAF721FBCF5003F"""
+"""A901D530DA3589EF_072C9175D6BDC5B2_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""0EAF721FBCF5003F"""
+"""30D497D8CB49D589_76172300C7B64B41_6004_UN""","""NC1=NC=C(C(=C1)C#N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""0EAF721FBCF5003F"""
+"""918A2D9AFE598C3B_C4DCCF7505FF4203_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""0EAF721FBCF5003F"""
+"""C05E11B4F03C5512_B1125DFD3F53D231_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""0EAF721FBCF5003F"""
+"""6FD795C305F2D202_E2EE05A401217320_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=C(C=CC=C2)CN3CCCC3""",21,"""0EAF721FBCF5003F"""
+"""5AEDB5E2AD250008_7A3A5525BD93909A_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""0EAF721FBCF5003F"""
+"""A84014D524E04BDD_703D7F26E4EE7467_6004_UN""","""NC1=NC=C(C(=C1)C#N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""0EAF721FBCF5003F"""
+"""94ECB0FD34E074D6_F0082D98A4AA7701_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](CCN)(=O)=O)C2CC2""",21,"""0EC053777A511A19"""
+"""A23B0570975685FD_6B71FD12090978AF_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C(C)C)[S](=O)(=O)CCN""",21,"""0EC053777A511A19"""
+"""507CBE3F60E85621_3CFE11A7E7495BF3_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](C)(=O)=O)CCN=C=S""",21,"""0EC053777A511A19"""
+"""B42771D1E063A1D5_21E8101FA9E1223B_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](CC)(=O)=O)CCCN""",21,"""0EC053777A511A19"""
+"""15788A2D284AEFE4_AB37B5F25F35171A_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](C)(=O)=O)C2CC(C2)N""",21,"""0EC053777A511A19"""
+"""EF0DA050EE5639AE_EDEDBDF56F00959B_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(CCCN)[S](=O)(=O)CCl""",21,"""0EC053777A511A19"""
+"""028C3672E781CD0E_180C31B3BD9200DA_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C)[S](=O)(=O)C2CNCC2""",21,"""0EC053777A511A19"""
+"""F49B1E70D7F4720A_A6543AA4027DA51E_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](CC)(=O)=O)CCCBr""",21,"""0EC053777A511A19"""
+"""ACEEDFA3BCC2B7FA_128EBBA4A7732690_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(CCCNC)[S](=O)(=O)C""",21,"""0EC053777A511A19"""
+"""2E5069B699D13259_F7E3B3C22EBA3CC8_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""0EC053777A511A19"""
+"""E8C448EB4C3DCF4A_A5A8D9D97285EF00_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](=O)(=O)CC#N)C2CC2""",21,"""0EC053777A511A19"""
+"""70FF3B0705AF8CDD_267CB2AF9A23AD17_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](C)(=O)=O)C(=O)CCN""",21,"""0EC053777A511A19"""
+"""9FB6F47FD3436A51_E07AE55F7E7D19E4_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""0EC053777A511A19"""
+"""BD740FD87A00A39A_42DCB8C66E320BA5_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""0EC053777A511A19"""
+"""145C076E20E570A0_8FBBE38FB17C2BFA_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""0EC053777A511A19"""
+"""0C315B7B10592622_7BC64C387E7C7B53_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""0EC053777A511A19"""
+"""5D75D2F6A1B67EEA_7132AB38E2074355_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(CC(CC)N)[S](=O)(=O)C""",21,"""0EC053777A511A19"""
+"""E944A8F9296F6D70_731CFE19E00CF37E_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""0EC053777A511A19"""
+"""9D57E0570604057A_E0DEE1553AF4289A_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](C)(=O)=O)CCN=[N]#N""",21,"""0EC053777A511A19"""
+"""1421BA888DB26BD5_306FD6F33C892CBE_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""0EC053777A511A19"""
+"""7FCC3BEA6C9EAC17_7A60B142AB47AB33_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""0EC053777A511A19"""
+"""6D9038B1306C903B_965D2F20A16D0F3C_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""0EC053777A511A19"""
+"""3643C952DBE7672D_9FB09B440A382286_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](=O)(=O)C2CC2)CC#C""",21,"""0EC053777A511A19"""
+"""D0EDD5D2A6ECB3F9_CBB081CFED36E740_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""0EC053777A511A19"""
+"""3B44A6EDE86AFE0D_E3DBCE32C832ABA8_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N2CCCC(C)(C)[S]2(=O)=O""",21,"""0EC053777A511A19"""
+"""81F0A22E42178632_28F2356641F460BB_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N2CCCC(CC)[S]2(=O)=O""",21,"""0EC053777A511A19"""
+"""6B776F9F9A6DA858_199B45BC244DD614_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""0EC053777A511A19"""
+"""E51B38795865C183_C68522125E45EF3A_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""0EC053777A511A19"""
+"""930E2045B7149B39_6DBDEC8B8AD57216_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""0EC053777A511A19"""
+"""D6BDD20037DC4452_2DD15CDB8FEFABA8_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""0EC053777A511A19"""
+"""B57F8E509590B382_859EC60F74F2B4C0_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N2[S](CCN(C)CC2)(=O)=O""",21,"""0EC053777A511A19"""
+"""6363C5592828E760_0909E0821C5B5F23_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N2CC(=O)NCC[S]2(=O)=O""",21,"""0EC053777A511A19"""
+"""1DD62F653B6C2A50_5CF2FD8BB1FE98B7_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N2[S](CCCCC2C)(=O)=O""",21,"""0EC053777A511A19"""
+"""E451DEBFE29EE982_265AB8471F1E7749_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(CCN)[S](=O)(=O)C2CC2""",21,"""0EC053777A511A19"""
+"""DA4716B6F6BE654B_40A09E86BB32E5BE_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(CCN)[S](=O)(=O)C(F)F""",21,"""0EC053777A511A19"""
+"""85129A1EC0E38F6B_E0A502E385391B5C_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N([S](CC)(=O)=O)C2CNC2""",21,"""0EC053777A511A19"""
+"""786355E0C08DB943_D23CD6DF12D04F21_6036_DP""","""NCC(CC1=CC(=CC=C1)Cl)N3CC2(CNC2)C[S]3(=O)=O""",21,"""0EC053777A511A19"""
+"""D00199ACD57F2D33_6849AF4DCB130B4B_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""0EC053777A511A19"""
+"""D1B9BE1A43A9A397_94A2371DC2711BFB_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""0EC053777A511A19"""
+"""8B1806546BE2AC81_AAC350AA0F4FD360_6036_UN""","""NCC(CC1=CC(=CC=C1)Cl)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""0EC053777A511A19"""
+"""39825E70FF064FAE_0ED81A23D1059FF7_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""0F284B77209E662B"""
+"""0AD756A6EA361712_A1AFE20F2A15330B_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""0F284B77209E662B"""
+"""0FF4AC57E3693C91_5DAF95C8B5FEC421_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""0F284B77209E662B"""
+"""4AD71588F466EB3B_01956D9E26D2F225_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""0F284B77209E662B"""
+"""FF53544B0611A7D6_32BD025FA1BC048D_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""0F284B77209E662B"""
+"""4B511F8022D04063_F95CE62B79CBF07E_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""0F284B77209E662B"""
+"""A654213BDF54E10D_2133C2272D0FE1F6_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=CC(=C2)COCCOC""",21,"""0F284B77209E662B"""
+"""54DD6E7C55311B9A_A85E4F2623B3EA9A_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""0F284B77209E662B"""
+"""FD72E728814DDFC0_B7455BC514F90DFF_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""0F284B77209E662B"""
+"""DD48CF265CA4F84D_E504A3F19F4CADD3_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""0F284B77209E662B"""
+"""2D6A4C1BC1A4BF1A_F0FD45C504310C91_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""0F284B77209E662B"""
+"""A30CBD835E33AF72_89462AE9F30B30EC_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""0F284B77209E662B"""
+"""0EED020B4EBAE57E_90620EEB9B67DF6C_6005_UN""","""FC(F)C1=C(C=CC=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""0F284B77209E662B"""
+"""DEF766C7B1FBA0F4_ED9651091C716E05_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""0F284B77209E662B"""
+"""12433B178BBDE3DD_1A4B9DCB8D13CD3E_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""0F284B77209E662B"""
+"""569E7AF05157B129_2D6CA54F7A79CE8A_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""0F284B77209E662B"""
+"""644FE634F9472D88_FFA05BCB5076E439_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""0F284B77209E662B"""
+"""FF37F4F07B5B4228_2F759543A52CD02A_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""0F284B77209E662B"""
+"""6EB19EF1D0DA73FA_00E0A10CB60BB2EF_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""0F284B77209E662B"""
+"""669D8201995D41A1_05DB5FA96A3B60C6_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""0F284B77209E662B"""
+"""2E21104A5CB3C806_C020F95E0ABBFCF2_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""0F284B77209E662B"""
+"""4E30565D520294AB_D00C690FD5554806_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""0F284B77209E662B"""
+"""1C72DEAB1816BB57_0D1F30367BF6BC7C_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""0F284B77209E662B"""
+"""033CB1A849A6B75D_9D6CD44CE20B36A9_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""0F284B77209E662B"""
+"""438148F4DB924F48_B84D64FF0204F872_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""0F284B77209E662B"""
+"""8843760CF89AB983_DEB0D4BE2B8D4912_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""0F284B77209E662B"""
+"""6E3423FB7C3D7523_23DDB7A8D5C7D942_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""0F284B77209E662B"""
+"""F90213C25D3AF66E_A2EB6E56623CB196_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""0F284B77209E662B"""
+"""C250C4FCB78559EA_D7940C6418101521_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""0F284B77209E662B"""
+"""3798375A1A4647FF_2873CBE8CF11EBCC_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""0F284B77209E662B"""
+"""D010B43A76D3FC90_DFF4221DE468C6D2_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""0F284B77209E662B"""
+"""FBB5EBA5369F5B45_A9FF0C012C04C1B9_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""0F284B77209E662B"""
+"""B9AD2EDACA2ACA7B_6CCF9D3BB5E0A8C6_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""0F284B77209E662B"""
+"""B032FBCC13753893_06ABA81D4AD6A3A6_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""0F284B77209E662B"""
+"""8407005DE5CBE999_77901A685BDD2D55_6005_UN""","""FC(F)C1=C(C=CC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""0F284B77209E662B"""
+"""50EF2EB023014944_C55BF61D99942417_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""0F284B77209E662B"""
+"""84D96CF736336229_B0956495A338B425_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""0F284B77209E662B"""
+"""5C3784CDF4AA0E97_E3693CCC9D4A1534_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""0F284B77209E662B"""
+"""BF6EA4E453CED7E4_7BBD6C4D21F8F68E_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""0F284B77209E662B"""
+"""E35AD5F1F8384EDB_71BA464E78851273_6005_UN""","""FC(F)C1=C(C=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""0F284B77209E662B"""
+"""276ED76287DA69C0_0E80CAC02C660301_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=CC=C2)OC3CCCC3""",21,"""0F709B94DDFDFADD"""
+"""D55B9DEE66B032A1_A1F732ECD776AFFD_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=C(OCC)C=C2)OCC""",21,"""0F709B94DDFDFADD"""
+"""1D897CD8DDA0CEAF_5DF7452B489D58D7_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=CC(=C2)OCCC(C)C""",21,"""0F709B94DDFDFADD"""
+"""381D816C5EFF11E6_01CDBD7DDBB16ED3_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""0F709B94DDFDFADD"""
+"""B4F77C3511C883EE_32E5D2BC5CDF987B_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=C(C=C2)OC3CCOC3""",21,"""0F709B94DDFDFADD"""
+"""D8A6A760B98200C0_F90436C884A86C88_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""0F709B94DDFDFADD"""
+"""4FCAADE93E73D66B_216B12C4D06C7D00_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=CC(=C2)COCCOC""",21,"""0F709B94DDFDFADD"""
+"""43435755F696884E_A8069FC5DED0766C_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""0F709B94DDFDFADD"""
+"""8A0EA026A25020D0_B71D8B26E99A9109_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=CC(=C2)OC(COC)C""",21,"""0F709B94DDFDFADD"""
+"""68236EAF4209DF40_E55C7312622F3125_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""0F709B94DDFDFADD"""
+"""9DFA0B75CC4692C4_F0A59526F9529067_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""0F709B94DDFDFADD"""
+"""C45D81D06735581F_891EFA0A0E68AC1A_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=CC=C2)CN3CCCC3""",21,"""0F709B94DDFDFADD"""
+"""B675FEE9D7723E1F_903ADE086604439A_6005_UN""","""FC(F)(F)C1=NN=C(S1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""0F709B94DDFDFADD"""
+"""B94AA1626692038F_EDCE81EAE112F2F3_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=CC(=C2)OCCN(C)C""",21,"""0F709B94DDFDFADD"""
+"""15492E4494A83470_1A134D28707051C8_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""0F709B94DDFDFADD"""
+"""2F7A26F5E5971F27_2D3475AC871A527C_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""0F709B94DDFDFADD"""
+"""70C0C151B07178EE_FFF88B28AD1578CF_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""0F709B94DDFDFADD"""
+"""4E799C1268A25F16_2F2D45A0584F4CDC_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""0F709B94DDFDFADD"""
+"""A9B917D5FEF5B5A2_00B871EF4B682E19_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""0F709B94DDFDFADD"""
+"""62811A68E0D8E28C_05838F4A9758FC30_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""0F709B94DDFDFADD"""
+"""42929416445F0029_C07829BDF7D86004_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""0F709B94DDFDFADD"""
+"""84880C7D8030A198_D054B9EC2836D4F0_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""0F709B94DDFDFADD"""
+"""3E2159D124CF9091_0D47E0D58695208A_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""0F709B94DDFDFADD"""
+"""237D45F3E40847A1_9D3404AF1F68AA5F_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""0F709B94DDFDFADD"""
+"""31F11F1578A4B3D1_B815B41CFF676484_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""0F709B94DDFDFADD"""
+"""060D15ABBB59BC24_DEE8045DD6EED5E4_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=C(OCCC(C)C)C=C2""",21,"""0F709B94DDFDFADD"""
+"""0A10B44341E3DAC2_2385674B28A445B4_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=C(C=C2)OC3CCCC3""",21,"""0F709B94DDFDFADD"""
+"""810B3B74C8489275_A2B3BEB59F5F2D60_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""0F709B94DDFDFADD"""
+"""A00BDE0BE71A5D0B_D7CCDC87E57389D7_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""0F709B94DDFDFADD"""
+"""B2D8D1C6974F1497_282B1B0B3272773A_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""0F709B94DDFDFADD"""
+"""BBFF5553DE438CF8_DFACF2FE190B5A24_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""0F709B94DDFDFADD"""
+"""6BFF2CCE38E22FE1_A9A7DCE2D1675D4F_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""0F709B94DDFDFADD"""
+"""66F71786BADB36E5_6C974DD848833430_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""0F709B94DDFDFADD"""
+"""45994A3668366710_06F378FEB7B53F50_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""0F709B94DDFDFADD"""
+"""ABA8E37F2D6DB325_77C8CA8BA6BEB1A3_6005_UN""","""FC(F)(F)C1=NN=C(S1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""0F709B94DDFDFADD"""
+"""6F9FAB6E51CA1740_C50326FE64F7B8E1_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""0F709B94DDFDFADD"""
+"""433DE2E0D5CDFB50_B0CDB4765E5B28D3_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""0F709B94DDFDFADD"""
+"""ECF2F456CD310F04_E331EC2F602989C2_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(C=CC=C2)CN3CCCC3""",21,"""0F709B94DDFDFADD"""
+"""015BF4194F03A139_7BE5BCAEDC9B6A78_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""0F709B94DDFDFADD"""
+"""D09B910869D69AB2_71E296AD85E68E85_6005_UN""","""FC(F)(F)C1=NN=C(S1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""0F709B94DDFDFADD"""
+"""A35274599159A484_F17711F26400D33D_6036_UN""","""NC(CN([S](CCN)(=O)=O)C1CC1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""9B8BAB20EFFE830C_6A0EC178C9A3DC93_6036_UN""","""NC(CN(C(C)C)[S](=O)(=O)CCN)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""0AE833A6B151C084_3D812DCD27E3FFCF_6036_UN""","""NC(CN([S](C)(=O)=O)CCN=C=S)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""BB27E5C734B853E5_20972C75694B8607_6036_UN""","""NC(CN([S](CC)(=O)=O)CCCN)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""343B70BA6B4C7C95_AA4889989F9FB326_6036_UN""","""NC(CN([S](C)(=O)=O)C1CC(C1)N)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""6E79CBAD65D33AC5_EC92819FAFAA31A7_6036_UN""","""NC(CN(CCCN)[S](=O)(=O)CCl)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""44BB8322C7C17D51_19730DD97D38A4E6_6036_UN""","""NC(CN(C)[S](=O)(=O)C1CNCC1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""8A9116307C80BB8B_A72B06CEC2D70122_6036_UN""","""NC(CN([S](CC)(=O)=O)CCCBr)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""1601F97C29D2F8EB_13F187CE67D982AC_6036_UN""","""NC(CN(CCCNC)[S](=O)(=O)C)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""10F8822BD4FAC518_F69C8FA8EE1098F4_6036_UN""","""NC(CN(C(C)(C)C#N)[S](=O)(=O)C)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""1529C9E699159CA2_A4D7E5B3B22F4B3C_6036_UN""","""NC(CN([S](=O)(=O)CC#N)C1CC1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""2B869E6368A3E7E9_27038EC55A89092B_6036_UN""","""NC(CN([S](C)(=O)=O)C(=O)CCN)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""897183BEC45CB81C_E105D935BED7BDD8_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=CC=CS1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""AA7A16EF666EB678_43A384ACAE98AF99_6036_UN""","""NC(CN(C(C)(C)C)[S](=O)(=O)CCl)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""31A45BC75524D798_8EC4DFE571D68FC6_6036_UN""","""NC(CN(C(C)(C)C)[S](=O)(=O)CBr)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""5B21044E3884E12E_7AB97052BED6DF6F_6036_UN""","""NC(CN(C(C)(C)C#C)[S](=O)(=O)C)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""C831301F32AF39ED_704D975222ADE769_6036_UN""","""NC(CN(CC(CC)N)[S](=O)(=O)C)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""C4C3A5F0B0F57BCF_7263C27320A65742_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=C[NH]C=N1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""DC6B5DA098D648CE_E1A1DD3FFA5E8CA6_6036_UN""","""NC(CN([S](C)(=O)=O)CCN=[N]#N)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""759DC4AB0E797B36_3110EA99FC238882_6036_UN""","""NC(CN(CC(C)(C)N)[S](=O)(=O)C)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""6CBD2F1ACA25E1D0_7B1F8D286BED0F0F_6036_UN""","""NC(CN1[S](CC(C)(C)C1=O)(=O)=O)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""3C021F0B9A7A08B8_9722134A61C7AB00_6036_UN""","""NC(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)C3=C(C(=CC=C3)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""171668D759776549_9ECFA72ECA9286BA_6036_UN""","""NC(CN([S](=O)(=O)C1CC1)CC#C)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""965068B57B38A1F1_CACFBDA52D9C437C_6036_UN""","""NC(CN1[S](=O)(=O)C2(CCC1)CC2)C3=C(C(=CC=C3)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""1FC97338AF3A1075_E2A4F25808980F94_6036_UN""","""NC(CN1CCCC(C)(C)[S]1(=O)=O)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""7C4F1A84090B6A70_298D090C815EC487_6036_UN""","""NC(CN1CCCC(CC)[S]1(=O)=O)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""4853E54AB99DB65F_18E479D6E4E77228_6036_UN""","""NC(CN1C(C(N)CC[S]1(=O)=O)=O)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""9D53361558D20F95_C7FA1E789EEF4B06_6036_UN""","""NC(CN([S](C)(=O)=O)[C@@H]1CNCC1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""7B5B0F6B5FC3CA3B_6CC2D0E14A7FD62A_6036_UN""","""NC(CN1CCCC(Cl)(Cl)[S]1(=O)=O)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""FCADB12C5040F011_2CAE60B14F450F94_6036_UN""","""NC(CN([S](C)(=O)=O)[C@H]1CNCC1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""95B55A40FAA5173B_84E1FA65B45810FC_6036_UN""","""NC(CN1[S](CCN(C)CC1)(=O)=O)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""DBE2363B0F05C771_0876DCE8DCF1FB1F_6036_UN""","""NC(CN1CC(=O)NCC[S]1(=O)=O)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""7A01E49225AC4CC2_5D8DC1E171543C8B_6036_UN""","""NC(CN1[S](CCCCC1C)(=O)=O)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""4259933CBC24FCF5_2725842DDFB4D375_6036_UN""","""NC(CN(CCN)[S](=O)(=O)C1CC1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""12A0651866F76424_41DFA2EC7B984182_6036_UN""","""NC(CN(CCN)[S](=O)(=O)C(F)F)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""CDFBFA0BEC3045F7_E1DA3E894593BF60_6036_UN""","""NC(CN([S](CC)(=O)=O)C1CNC1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""A5DFD2AB5A8E09C4_D343EAB5D27AEB1D_6036_DP""","""NC(CN2CC1(CNC1)C[S]2(=O)=O)C3=C(C(=CC=C3)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""D6EFF62FB5CA81D0_693693270BB9AF77_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=N[NH]C=N1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""8BA15072671937BC_95DD0B7702DBBFC7_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=C[NH]N=C1)C2=C(C(=CC=C2)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""FB7519EB556157E1_ABBC6CC0CFE5775C_6036_UN""","""NC(CN(C(C)(C)CN)[S](=O)(=O)C)C1=C(C(=CC=C1)Cl)F""",21,"""0FBF6F1DBAFBBE25"""
+"""3991FDBDFB6FCB92_EE05322EC0189EC1_6036_UN""","""NC(CN([S](CCN)(=O)=O)C1CC1)CC2=CC=C(C=C2)F""",21,"""10CD4CC11EE3F3D9"""
+"""FA260A65847DEB2F_757CE2A46DBB916F_6036_UN""","""NC(CN(C(C)C)[S](=O)(=O)CCN)CC1=CC=C(C=C1)F""",21,"""10CD4CC11EE3F3D9"""
+"""DD10B51B085FFBEE_22F30E1183FBB233_6036_UN""","""NC(CN([S](C)(=O)=O)CCN=C=S)CC1=CC=C(C=C1)F""",21,"""10CD4CC11EE3F3D9"""
+"""AA63EB9C16033B74_3FE50FA9CD53CBFB_6036_UN""","""NC(CN([S](CC)(=O)=O)CCCN)CC1=CC=C(C=C1)F""",21,"""10CD4CC11EE3F3D9"""
+"""4BF279547B60AFBE_B53AAA443B87FEDA_6036_UN""","""NC(CN([S](C)(=O)=O)C1CC(C1)N)CC2=CC=C(C=C2)F""",21,"""10CD4CC11EE3F3D9"""
+"""596C894776F16E8D_F3E0A2430BB27C5B_6036_UN""","""NC(CN(CCCN)[S](=O)(=O)CCl)CC1=CC=C(C=C1)F""",21,"""10CD4CC11EE3F3D9"""
+"""5620889D5B2DB8EC_06012E05D920E91A_6036_UN""","""NC(CN(C)[S](=O)(=O)C1CNCC1)CC2=CC=C(C=C2)F""",21,"""10CD4CC11EE3F3D9"""
+"""3323286540AFC799_B859251266CF4CDE_6036_UN""","""NC(CN([S](CC)(=O)=O)CCCBr)CC1=CC=C(C=C1)F""",21,"""10CD4CC11EE3F3D9"""
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+"""44201BF167C6104A_F39BC34D203A2E4E_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC=CC(=C3)OCCN(C)C""",21,"""1125D9331CD52660"""
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+"""078D758C254B3E5E_3361370B46328EC1_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""1125D9331CD52660"""
+"""A6DA6DC57C7507F5_E1ADC98F6C3DA472_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""1125D9331CD52660"""
+"""BBBCAF34C1F0A738_3178070799679061_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""1125D9331CD52660"""
+"""AE9845D7B2FFE150_1EED33488A40F2A4_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""1125D9331CD52660"""
+"""DF83469E04935784_1BD6CDED5670208D_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""1125D9331CD52660"""
+"""C2A4B8E3091BD427_DE2D6B1A36F0BCB9_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""1125D9331CD52660"""
+"""391F59B8C55E3C8A_CE01FB4BE91E084D_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""1125D9331CD52660"""
+"""DA4832C7A17B5ED8_1312A27247BDFC37_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""1125D9331CD52660"""
+"""E01600EC7822FE65_83614608DE4076E2_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""1125D9331CD52660"""
+"""B7ACF04FF04ED6EE_A640F6BB3E4FB839_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""1125D9331CD52660"""
+"""4712CBCC3D304574_C0BD46FA17C60959_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC=C(OCCC(C)C)C=C3""",21,"""1125D9331CD52660"""
+"""7A217D7FE02FCD62_3DD025ECE98C9909_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC=C(C=C3)OC4CCCC4""",21,"""1125D9331CD52660"""
+"""B2C0B28E470AAC85_BCE6FC125E77F1DD_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""1125D9331CD52660"""
+"""492A02D08904C057_C9999E20245B556A_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""1125D9331CD52660"""
+"""564B3E2693A36BD7_367E59ACF35AAB87_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""1125D9331CD52660"""
+"""7F21F37A610377C6_C1F9B059D8238699_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""1125D9331CD52660"""
+"""D723728BED69D4B2_B7F29E45104F81F2_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""1125D9331CD52660"""
+"""9A0A2068B69B432A_72C20F7F89ABE88D_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""1125D9331CD52660"""
+"""FD210EC68B2FC4E9_18A63A59769DE3ED_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""1125D9331CD52660"""
+"""FCBC10EAB8933CD7_699D882C67966D1E_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""1125D9331CD52660"""
+"""4BE9F9090A7848E2_DB566459A5DF645C_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""1125D9331CD52660"""
+"""DB469EA718C43133_AE98F6D19F73F46E_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""1125D9331CD52660"""
+"""D6558A5E72C427F6_FD64AE88A101557F_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(C=CC=C3)CN4CCCC4""",21,"""1125D9331CD52660"""
+"""C81ED2DDFB2AE070_65B0FE091DB3B6C5_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""1125D9331CD52660"""
+"""3A7E93BAB3BC5493_6FB7D40A44CE5238_6004_UN""","""C1(=C[N]2C(=C1)CNCC2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""1125D9331CD52660"""
+"""284C02BCCFA6A7CE_EFBFD4D354A921B2_6036_UN""","""C(CNCCOCC(F)(F)F)N([S](CCN)(=O)=O)C1CC1""",21,"""1177AA3C8A524CAA"""
+"""D71E1D7575352BBB_74C60459F90A2E1C_6036_UN""","""C(CNCCOCC(F)(F)F)N(C(C)C)[S](=O)(=O)CCN""",21,"""1177AA3C8A524CAA"""
+"""6E339A4FC392927D_2349E8EC174A0D40_6036_UN""","""C(CNCCOCC(F)(F)F)N([S](C)(=O)=O)CCN=C=S""",21,"""1177AA3C8A524CAA"""
+"""99F3A0D0BC7E2102_3E5FE95459E27488_6036_UN""","""C(CNCCOCC(F)(F)F)N([S](CC)(=O)=O)CCCN""",21,"""1177AA3C8A524CAA"""
+"""87E03C13CEA76481_B4804CB9AF3641A9_6036_UN""","""C(CNCCOCC(F)(F)F)N([S](C)(=O)=O)C1CC(C1)N""",21,"""1177AA3C8A524CAA"""
+"""EC27973C715450AD_F25A44BE9F03C328_6036_UN""","""C(CNCCOCC(F)(F)F)N(CCCN)[S](=O)(=O)CCl""",21,"""1177AA3C8A524CAA"""
+"""3BB72C2D45BF69C4_07BBC8F84D915669_6036_UN""","""C(CNCCOCC(F)(F)F)N(C)[S](=O)(=O)C1CNCC1""",21,"""1177AA3C8A524CAA"""
+"""1DA85CAB7EC68629_B9E3C3EFF27EF3AD_6036_UN""","""C(CNCCOCC(F)(F)F)N([S](CC)(=O)=O)CCCBr""",21,"""1177AA3C8A524CAA"""
+"""8AAE2728408476FE_0D3942EF57707023_6036_UN""","""C(CNCCOCC(F)(F)F)N(CCCNC)[S](=O)(=O)C""",21,"""1177AA3C8A524CAA"""
+"""9835D9FA161D76B6_E8544A89DEB96A7B_6036_UN""","""C(CNCCOCC(F)(F)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""1177AA3C8A524CAA"""
+"""847AACB01E965B91_BA1F20928286B9B3_6036_UN""","""C(CNCCOCC(F)(F)F)N([S](=O)(=O)CC#N)C1CC1""",21,"""1177AA3C8A524CAA"""
+"""FDFB52F2FF708B45_39CB4BE46A20FBA4_6036_UN""","""C(CNCCOCC(F)(F)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""1177AA3C8A524CAA"""
+"""DBF6F716C4D341D4_FFCD1C148E7E4F57_6036_UN""","""C(CNCCOCC(F)(F)F)N(C)[S](=O)(=O)C1=CC=CS1""",21,"""1177AA3C8A524CAA"""
+"""2F8E08EBA2A61E34_5D6B418D9E315D16_6036_UN""","""C(CNCCOCC(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""1177AA3C8A524CAA"""
+"""265BC946267F64B5_900C1AC4417F7D49_6036_UN""","""C(CNCCOCC(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""1177AA3C8A524CAA"""
+"""E2E68C56D35433EC_6471B5738E7F2DE0_6036_UN""","""C(CNCCOCC(F)(F)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""1177AA3C8A524CAA"""
+"""28A0F07A2BA8B611_6E855273120415E6_6036_UN""","""C(CNCCOCC(F)(F)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""1177AA3C8A524CAA"""
+"""8D3429D62B113E90_6CAB0752100FA5CD_6036_UN""","""C(CNCCOCC(F)(F)F)N(C)[S](=O)(=O)C1=C[NH]C=N1""",21,"""1177AA3C8A524CAA"""
+"""1FACEBF3780F3DD7_FF69181ECAF77E29_6036_UN""","""C(CNCCOCC(F)(F)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""1177AA3C8A524CAA"""
+"""3C72DBB93119A290_2FD82FB8CC8A7A0D_6036_UN""","""C(CNCCOCC(F)(F)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""1177AA3C8A524CAA"""
+"""D1D3546565373FF7_65D748095B44FD80_6036_UN""","""C(CNCCOCC(F)(F)F)N1[S](CC(C)(C)C1=O)(=O)=O""",21,"""1177AA3C8A524CAA"""
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+"""0E5CCF567E615CE0_D8E7904A1BE38482_6025_UN""","""C1(=C(C(NC=N1)=O)C#N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""12942D20A2E9C6BE"""
+"""E228F422B891FBEE_AD2902C2214F14B0_6025_UN""","""C1(=C(C(NC=N1)=O)C#N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""12942D20A2E9C6BE"""
+"""B17D51CBF4A3FA13_FED55A9B1F3DB5A1_6025_UN""","""C1(=C(C(NC=N1)=O)C#N)C2=C(C=CC=C2)CN3CCCC3""",21,"""12942D20A2E9C6BE"""
+"""DF3D8D3D906C3300_6C062019FAF2B2E6_6025_UN""","""C1(=C(C(NC=N1)=O)C#N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""12942D20A2E9C6BE"""
+"""1A31C51443F9C85F_ED4C2D3D5D9A39AF_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](CCN)(=O)=O)C3CC3""",21,"""138453D2836154B7"""
+"""8A98F44DF8B6D3D7_7635FDB7F0393601_6036_UN""","""C1(CCCC1N2CCNCC2)N(C(C)C)[S](=O)(=O)CCN""",21,"""138453D2836154B7"""
+"""61B271718DA78AFB_21BA11021E79155D_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](C)(=O)=O)CCN=C=S""",21,"""138453D2836154B7"""
+"""C8394F34508A0B53_3CAC10BA50D16C95_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](CC)(=O)=O)CCCN""",21,"""138453D2836154B7"""
+"""BC3D88C4BB84164A_B673B557A60559B4_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""138453D2836154B7"""
+"""4425A0CB2D296B66_F0A9BD509630DB35_6036_UN""","""C1(CCCC1N2CCNCC2)N(CCCN)[S](=O)(=O)CCl""",21,"""138453D2836154B7"""
+"""3FFB8A6A2275EB42_0548311644A24E74_6036_UN""","""C1(CCCC1N2CCNCC2)N(C)[S](=O)(=O)C3CNCC3""",21,"""138453D2836154B7"""
+"""B3F55A7E6463BCAF_BB103A01FB4DEBB0_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](CC)(=O)=O)CCCBr""",21,"""138453D2836154B7"""
+"""E525792AEDB2D1C3_0FCABB015E43683E_6036_UN""","""C1(CCCC1N2CCNCC2)N(CCCNC)[S](=O)(=O)C""",21,"""138453D2836154B7"""
+"""CCDA544BE6DD2916_EAA7B367D78A7266_6036_UN""","""C1(CCCC1N2CCNCC2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""138453D2836154B7"""
+"""4CC0A09D4323A351_B8ECD97C8BB5A1AE_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](=O)(=O)CC#N)C3CC3""",21,"""138453D2836154B7"""
+"""02DAE089253308A7_3B38B20A6313E3B9_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](C)(=O)=O)C(=O)CCN""",21,"""138453D2836154B7"""
+"""D59DC89D530B1F10_FD3EE5FA874D574A_6036_UN""","""C1(CCCC1N2CCNCC2)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""138453D2836154B7"""
+"""D4296D6B5907B663_5F98B8639702450B_6036_UN""","""C1(CCCC1N2CCNCC2)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""138453D2836154B7"""
+"""F3A48740D8B92129_92FFE32A484C6554_6036_UN""","""C1(CCCC1N2CCNCC2)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""138453D2836154B7"""
+"""DF9DCA37C6DF6638_66824C9D874C35FD_6036_UN""","""C1(CCCC1N2CCNCC2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""138453D2836154B7"""
+"""48BEAE6C25F8DF0E_6C76AB9D1B370DFB_6036_UN""","""C1(CCCC1N2CCNCC2)N(CC(CC)N)[S](=O)(=O)C""",21,"""138453D2836154B7"""
+"""AA571433C546370D_6E58FEBC193CBDD0_6036_UN""","""C1(CCCC1N2CCNCC2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""138453D2836154B7"""
+"""6002F41A10511C72_FD9AE1F0C3C46634_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""138453D2836154B7"""
+"""DC080D7709C4EBF1_2D2BD656C5B96210_6036_UN""","""C1(CCCC1N2CCNCC2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""138453D2836154B7"""
+"""832B9DD6EEDFE2C7_6724B1E75277E59D_6036_UN""","""C1(CCCC1N2CCNCC2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""138453D2836154B7"""
+"""9F5F8827309174E0_8B192F85585D4192_6036_UN""","""C1(CCCC1N2CCNCC2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""138453D2836154B7"""
+"""113EBEA31262D3AC_82F49BE1F3086C28_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](=O)(=O)C3CC3)CC#C""",21,"""138453D2836154B7"""
+"""D9190492FFF004CA_D6F4816A1406A9EE_6036_UN""","""C1(CCCC1N2CCNCC2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""138453D2836154B7"""
+"""65254106CC19C639_FE9FCE973102E506_6036_UN""","""C1(CCCC1N2CCNCC2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""138453D2836154B7"""
+"""CBD2C0C1692CD3F3_35B635C3B8C42E15_6036_UN""","""C1(CCCC1N2CCNCC2)N3CCCC(CC)[S]3(=O)=O""",21,"""138453D2836154B7"""
+"""8FBFD134D0812922_04DF4519DD7D98BA_6036_UN""","""C1(CCCC1N2CCNCC2)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""138453D2836154B7"""
+"""05E9C558296F0036_DBC122B7A775A194_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""138453D2836154B7"""
+"""57862140031A7BF2_70F9EC2E73E53CB8_6036_UN""","""C1(CCCC1N2CCNCC2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""138453D2836154B7"""
+"""89E58D2D31470B16_30955C7E76DFE506_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""138453D2836154B7"""
+"""F8AAE87E36B18721_98DAC6AA8DC2FA6E_6036_UN""","""C1(CCCC1N2CCNCC2)N3[S](CCN(C)CC3)(=O)=O""",21,"""138453D2836154B7"""
+"""AE11AF11E91D0CAB_144DE027E56B118D_6036_UN""","""C1(CCCC1N2CCNCC2)N3CC(=O)NCC[S]3(=O)=O""",21,"""138453D2836154B7"""
+"""1ED0F9FED03E195F_41B6FD2E48CED619_6036_UN""","""C1(CCCC1N2CCNCC2)N3[S](CCCCC3C)(=O)=O""",21,"""138453D2836154B7"""
+"""331189BB1AD689E1_3B1EB8E2E62E39E7_6036_UN""","""C1(CCCC1N2CCNCC2)N(CCN)[S](=O)(=O)C3CC3""",21,"""138453D2836154B7"""
+"""CDF5AD14E2DA3F49_5DE49E234202AB10_6036_UN""","""C1(CCCC1N2CCNCC2)N(CCN)[S](=O)(=O)C(F)F""",21,"""138453D2836154B7"""
+"""B6C260C1A44BE012_FDE102467C0955F2_6036_UN""","""C1(CCCC1N2CCNCC2)N([S](CC)(=O)=O)C3CNC3""",21,"""138453D2836154B7"""
+"""46129A21D10A7D4E_CF78D67AEBE0018F_6036_DP""","""C1(CCCC1N2CCNCC2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""138453D2836154B7"""
+"""F8AC29D4A07FD34D_750DAFE8322345E5_6036_UN""","""C1(CCCC1N2CCNCC2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""138453D2836154B7"""
+"""A0DB75A197C81489_89E637B83B415555_6036_UN""","""C1(CCCC1N2CCNCC2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""138453D2836154B7"""
+"""20553A582375103C_B787500FF67F9DCE_6036_UN""","""C1(CCCC1N2CCNCC2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""138453D2836154B7"""
+"""35B43C71F1C3A5FA_ED5B67E9BD6D6B16_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](CCN)(=O)=O)C3CC3""",21,"""139319066396060E"""
+"""A59FFEF2A9FEE928_7622B76310CE64B8_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C(C)C)[S](=O)(=O)CCN""",21,"""139319066396060E"""
+"""3F8B0B77D9CD637F_21AD5BD6FE8E47E4_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](C)(=O)=O)CCN=C=S""",21,"""139319066396060E"""
+"""0E903EEB51E2E35C_3CBB5A6EB0263E2C_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](CC)(=O)=O)CCCN""",21,"""139319066396060E"""
+"""6308AF6898D1B89B_B664FF8346F20B0D_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""139319066396060E"""
+"""FEE743E717832C5E_F0BEF78476C7898C_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(CCCN)[S](=O)(=O)CCl""",21,"""139319066396060E"""
+"""92E534881C663EDE_055F7BC2A4551CCD_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C)[S](=O)(=O)C3CNCC3""",21,"""139319066396060E"""
+"""490BB29B9391C849_BB0770D51BBAB909_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](CC)(=O)=O)CCCBr""",21,"""139319066396060E"""
+"""E7BC5E6C33087158_0FDDF1D5BEB43A87_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(CCCNC)[S](=O)(=O)C""",21,"""139319066396060E"""
+"""35DE2E9160D524C2_EAB0F9B3377D20DF_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""139319066396060E"""
+"""1E37F206A1A19F48_B8FB93A86B42F317_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](=O)(=O)CC#N)C3CC3""",21,"""139319066396060E"""
+"""009D0B6BA08F0AF3_3B2FF8DE83E4B100_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](C)(=O)=O)C(=O)CCN""",21,"""139319066396060E"""
+"""0E5804B0EF9FB79A_FD29AF2E67BA05F3_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""139319066396060E"""
+"""EBD7FA7D0B4F5EAD_5F8FF2B777F517B2_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""139319066396060E"""
+"""3D4A813A13776B28_92E8A9FEA8BB37ED_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""139319066396060E"""
+"""4ADB2AD27D06C5D1_6695064967BB6744_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""139319066396060E"""
+"""C623520875CCD81C_6C61E149FBC05F42_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(CC(CC)N)[S](=O)(=O)C""",21,"""139319066396060E"""
+"""1B6E746274BA57AB_6E4FB468F9CBEF69_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""139319066396060E"""
+"""48271CB06AF89A5C_FD8DAB242333348D_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""139319066396060E"""
+"""BEB44739ACD5228B_2D3C9C82254E30A9_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""139319066396060E"""
+"""E487586D1D6D4EC1_6733FB33B280B724_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""139319066396060E"""
+"""A6572EC9494DAAF6_8B0E6551B8AA132B_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""139319066396060E"""
+"""4C6BA1D209555387_82E3D13513FF3E91_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](=O)(=O)C3CC3)CC#C""",21,"""139319066396060E"""
+"""9BD05D44BC07DB67_D6E3CBBEF4F1FB57_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""139319066396060E"""
+"""C98A0A1D00D3EA2A_FE888443D1F5B7BF_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""139319066396060E"""
+"""50395E789485BD33_35A17F1758337CAC_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N3CCCC(CC)[S]3(=O)=O""",21,"""139319066396060E"""
+"""E38A2354951994F2_04C80FCD3D8ACA03_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""139319066396060E"""
+"""3E86BCC096D4A49A_DBD668634782F32D_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""139319066396060E"""
+"""D0C93D2BB1BCC7E9_70EEA6FA93126E01_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""139319066396060E"""
+"""CB73F339B6026FBC_308216AA9628B7BF_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""139319066396060E"""
+"""8A4FB1655A523C03_98CD8C7E6D35A8D7_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N3[S](CCN(C)CC3)(=O)=O""",21,"""139319066396060E"""
+"""056EAFD7AC76D949_145AAAF3059C4334_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N3CC(=O)NCC[S]3(=O)=O""",21,"""139319066396060E"""
+"""2F5246D3DE1EFDF3_41A1B7FAA83984A0_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N3[S](CCCCC3C)(=O)=O""",21,"""139319066396060E"""
+"""EB08E6162C1E3CC4_3B09F23606D96B5E_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(CCN)[S](=O)(=O)C3CC3""",21,"""139319066396060E"""
+"""4BD2A816716DF0B2_5DF3D4F7A2F5F9A9_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(CCN)[S](=O)(=O)C(F)F""",21,"""139319066396060E"""
+"""4FE06BA75F323EB2_FDF648929CFE074B_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N([S](CC)(=O)=O)C3CNC3""",21,"""139319066396060E"""
+"""AF137C034713D702_CF6F9CAE0B175336_6036_DP""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""139319066396060E"""
+"""DBF86BF62933F29D_751AE53CD2D4175C_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""139319066396060E"""
+"""BB454C0A4FED24D7_89F17D6CDBB607EC_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""139319066396060E"""
+"""120D69897AB3C885_B7901ADB1688CF77_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)S2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""139319066396060E"""
+"""536C7B4681B48BE7_15F0AD1B990581BD_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC(=CC=C2)OC3CCCC3""",21,"""1400FC4F689E7861"""
+"""F1CCF7F2CEA33B18_BA87553762152D41_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC(=C(OCC)C=C2)OCC""",21,"""1400FC4F689E7861"""
+"""2F912FAB8810D5E0_468722F0FDFEDA6B_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC=CC(=C2)OCCC(C)C""",21,"""1400FC4F689E7861"""
+"""711F6202EDD26DA5_1ABDDAA66ED2EC6F_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""1400FC4F689E7861"""
+"""DF7142CEADBA10E7_2995B567E9BC1AC7_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC=C(C=C2)OC3CCOC3""",21,"""1400FC4F689E7861"""
+"""F8BCC56D8A4DF885_E274511331CBEE34_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""1400FC4F689E7861"""
+"""48FCE323D7934B80_3A1B751F650FFFBC_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC=CC(=C2)COCCOC""",21,"""1400FC4F689E7861"""
+"""1207451BED4BE825_B376F81E6BB3F4D0_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""1400FC4F689E7861"""
+"""C3A95E716B5D5690_AC6DECFD5CF913B5_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC=CC(=C2)OC(COC)C""",21,"""1400FC4F689E7861"""
+"""E60B5429B23EFF1D_FE2C14C9D74CB399_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""1400FC4F689E7861"""
+"""2A0556FC774DF986_EBD5F2FD4C3112DB_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""1400FC4F689E7861"""
+"""FB4FF41FF6D8443D_926E9DD1BB0B2EA6_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC(=CC=C2)CN3CCCC3""",21,"""1400FC4F689E7861"""
+"""288627A5257F946F_8B4AB9D3D367C126_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""1400FC4F689E7861"""
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+"""6307E10EE9A5B79C_364412773279D0C0_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""1400FC4F689E7861"""
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+"""1038386105B49916_345D227BED2CCE60_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""1400FC4F689E7861"""
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+"""0E7FCCDADC26FC9F_1EF3E891223B7E8C_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""1400FC4F689E7861"""
+"""F820A16D811E3B2B_DB084E6642BBE2B8_6004_UN""","""CC1=C(C=C(C(=N1)Cl)N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""1400FC4F689E7861"""
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+"""775DFEA94ACD0C40_60A5003F172E053C_6005_UN""","""NC1=C(C(=CC=C1)C2=CC(=N[N]2C3CCCCO3)C)CO""",21,"""1430270516489599"""
+"""E59260C9D42442F7_6AA22A3C4E53E1C1_6005_UN""","""NC1=C(C(=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)CO""",21,"""1430270516489599"""
+"""80B516CDF4C6F04F_15768524E30F3F54_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=CC(=CC=C3)OC4CCCC4""",21,"""1486D4701294C688"""
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+"""146176FFEA09047F_ACEBC4C226F3AD5C_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=CC=CC(=C3)OC(COC)C""",21,"""1486D4701294C688"""
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+"""EAC0D3EAAC406C90_92E8B5EEC101904F_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=CC(=CC=C3)CN4CCCC4""",21,"""1486D4701294C688"""
+"""A41DBFC0D1E338E9_8BCC91ECA96D7FCF_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""1486D4701294C688"""
+"""912689366CE3508C_F638CE0E2E7BCEA6_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=CC=CC(=C3)OCCN(C)C""",21,"""1486D4701294C688"""
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+"""6035A512AFE80190_1B4E3E0B8401124C_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""1486D4701294C688"""
+"""D9267B2D574238A4_1E75C0AE5831C065_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""1486D4701294C688"""
+"""077A819118974681_DB8E665938B15C51_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""1486D4701294C688"""
+"""1E87E4F1FDBC2FA8_CBA2F608E75FE8A5_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""1486D4701294C688"""
+"""D24F061DC5AF4584_16B1AF3149FC1CDF_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""1486D4701294C688"""
+"""AC50350FDC683910_86C24B4BD001960A_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""1486D4701294C688"""
+"""50BDBD715B7DFCEF_A3E3FBF8300E58D1_6005_UN""","""C2(=C1C=CC=C[N]1N=C2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""1486D4701294C688"""
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+"""F121021D03E86FD9_E581647E35E559DC_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""150974C2450DDBCE"""
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+"""7CB4EEDA3C907289_CA2D56BAB0C6F5E3_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""150974C2450DDBCE"""
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+"""3EF4C888D193D4EF_874DEBF987988B4C_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""150974C2450DDBCE"""
+"""8AD4DF72743C3D11_A26C5B4A67974597_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""150974C2450DDBCE"""
+"""E27F9C5F67A5C832_C491EB0B4E1EF4F7_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""150974C2450DDBCE"""
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+"""F8776C652C7F154B_3252F45DAA825629_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""150974C2450DDBCE"""
+"""AC6D6EA731930D55_C5D51DA881FB7B37_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""150974C2450DDBCE"""
+"""2B691F0831167EED_B3DE33B449977C5C_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""150974C2450DDBCE"""
+"""911FF7648CB4787B_76EEA28ED0731523_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""150974C2450DDBCE"""
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+"""CF16F00B84955489_6DB125DD3E4E90B0_6005_UN""","""NC(=O)C1=C(C=CC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""150974C2450DDBCE"""
+"""4DE5BF0CFD47C16D_DF7AC9A8FC0799F2_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""150974C2450DDBCE"""
+"""763A43F93EA4AA2E_AAB45B20C6AB09C0_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""150974C2450DDBCE"""
+"""5A3E2ED4857804D4_F9480379F8D9A8D1_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""150974C2450DDBCE"""
+"""F2C6B3B18CC61984_619C53F8446B4B6B_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""150974C2450DDBCE"""
+"""A241DC0A34088641_6B9B79FB1D16AF96_6005_UN""","""NC(=O)C1=C(C=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""150974C2450DDBCE"""
+"""B70633178196CC76_17BA4D483D9BC53A_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=CC=C2)OC3CCCC3""",21,"""164A1C1CCC003CE6"""
+"""19AE3C62721A6B02_B8CDB564C68B69C6_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(OCC)C=C2)OCC""",21,"""164A1C1CCC003CE6"""
+"""F17A225C1A86BDC9_44CDC2A359609EEC_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)OCCC(C)C""",21,"""164A1C1CCC003CE6"""
+"""D4693A41D82314C6_18F73AF5CA4CA8E8_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""164A1C1CCC003CE6"""
+"""DDE86DAB543266BE_2BDF55344D225E40_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)OC3CCOC3""",21,"""164A1C1CCC003CE6"""
+"""60D98018AD80DA86_E03EB1409555AAB3_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""164A1C1CCC003CE6"""
+"""FA80DA44AE479B05_3851954CC191BB3B_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)COCCOC""",21,"""164A1C1CCC003CE6"""
+"""858524EF3243DB61_B13C184DCF2DB057_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""164A1C1CCC003CE6"""
+"""268D2D4BC7381F0A_AE270CAEF8675732_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)OC(COC)C""",21,"""164A1C1CCC003CE6"""
+"""484B490EBC58D469_FC66F49A73D2F71E_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""164A1C1CCC003CE6"""
+"""F6E07CA4BE91E59D_E99F12AEE8AF565C_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""164A1C1CCC003CE6"""
+"""A2C5630FAB46255A_90247D821F956A21_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=CC=C2)CN3CCCC3""",21,"""164A1C1CCC003CE6"""
+"""504D64962D09AFE8_8900598077F985A1_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""164A1C1CCC003CE6"""
+"""D18ECEB7AA8C3C8B_F4F40662F0EF34C8_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)OCCN(C)C""",21,"""164A1C1CCC003CE6"""
+"""055ACB90AEA47E52_0329CAA0618D97F3_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""164A1C1CCC003CE6"""
+"""0EA6250EBA95FC6F_340EF22496E79447_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""164A1C1CCC003CE6"""
+"""7E5AF8EDC6DE236C_E6C20CA0BCE8BEF4_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""164A1C1CCC003CE6"""
+"""16DD6B7036D9C65C_3617C22849B28AE7_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""164A1C1CCC003CE6"""
+"""25F86E04DBF44666_1982F6675A95E822_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""164A1C1CCC003CE6"""
+"""15130AB000142316_1CB908C286A53A0B_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""164A1C1CCC003CE6"""
+"""37A6C0BEDB781E7C_D942AE35E625A63F_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""164A1C1CCC003CE6"""
+"""779125B23C49C7FF_C96E3E6439CB12CB_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""164A1C1CCC003CE6"""
+"""6CE7B3FF62745F6B_147D675D9768E6B1_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""164A1C1CCC003CE6"""
+"""E6DE304276715D80_840E83270E956C64_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""164A1C1CCC003CE6"""
+"""370B1972FDECE0D4_A12F3394EE9AA2BF_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""164A1C1CCC003CE6"""
+"""C057EA10A76BA6F8_C7D283D5C71313DF_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=C(OCCC(C)C)C=C2""",21,"""164A1C1CCC003CE6"""
+"""6C12F790D0F2B9BD_3ABFE0C33959838F_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)OC3CCCC3""",21,"""164A1C1CCC003CE6"""
+"""E128770ACD865E6E_BB89393D8EA2EB5B_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""164A1C1CCC003CE6"""
+"""D2A8754B49C558CF_CEF65B0FF48E4FEC_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""164A1C1CCC003CE6"""
+"""3CB0F104236FA0B4_31119C83238FB101_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""164A1C1CCC003CE6"""
+"""2244A2F60D0202BE_C696757608F69C1F_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""164A1C1CCC003CE6"""
+"""AE013F27BEBE5197_B09D5B6AC09A9B74_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""164A1C1CCC003CE6"""
+"""065AC4BC9DBCD801_75ADCA50597EF20B_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""164A1C1CCC003CE6"""
+"""8FDB2DE603977AE1_1FC9FF76A648F96B_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""164A1C1CCC003CE6"""
+"""2FACEB276EAC0CC9_6EF24D03B7437798_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""164A1C1CCC003CE6"""
+"""B5FA3B64D8E694C7_DC39A176750A7EDA_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""164A1C1CCC003CE6"""
+"""270BB665575D1775_A9F733FE4FA6EEE8_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""164A1C1CCC003CE6"""
+"""CCBE3B0E0BD0E28F_FA0B6BA771D44FF9_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(C=CC=C2)CN3CCCC3""",21,"""164A1C1CCC003CE6"""
+"""EB4CEF69D0F40B08_62DF3B26CD66AC43_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""164A1C1CCC003CE6"""
+"""2A05ECB1F92A12BA_68D81125941B48BE_6005_UN""","""Cl[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""164A1C1CCC003CE6"""
+"""575581FB7E9DF6C5_E8612BA239356C7C_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](CCN)(=O)=O)C3CC3""",21,"""16A9554DE7CE0164"""
+"""DCEA9073581A1936_7318FB28949663D2_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""16A9554DE7CE0164"""
+"""C9D74762D20776BC_2497179D7AD6408E_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""16A9554DE7CE0164"""
+"""149D8446ED4A63CF_39811625347E3946_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](CC)(=O)=O)CCCN""",21,"""16A9554DE7CE0164"""
+"""D27577ECA5069168_B35EB3C8C2AA0C67_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](C)(=O)=O)C3CC(C3)N""",21,"""16A9554DE7CE0164"""
+"""8A60F2C1BC6FE865_F584BBCFF29F8EE6_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""16A9554DE7CE0164"""
+"""B12631611160662E_00653789200D1BA7_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C)[S](=O)(=O)C3CNCC3""",21,"""16A9554DE7CE0164"""
+"""CBAE36E2F15D0585_BE3D3C9E9FE2BE63_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](CC)(=O)=O)CCCBr""",21,"""16A9554DE7CE0164"""
+"""67235EF22558D39F_0AE7BD9E3AEC3DED_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(CCCNC)[S](=O)(=O)C""",21,"""16A9554DE7CE0164"""
+"""2257A2CD89F365C7_EF8AB5F8B32527B5_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""16A9554DE7CE0164"""
+"""11A5315961ACCB91_BDC1DFE3EF1AF47D_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](=O)(=O)CC#N)C3CC3""",21,"""16A9554DE7CE0164"""
+"""313EC95344773F5F_3E15B49507BCB66A_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""16A9554DE7CE0164"""
+"""31B99ED6E5CCA071_F813E365E3E20299_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""16A9554DE7CE0164"""
+"""C19DE3E897933DBE_5AB5BEFCF3AD10D8_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""16A9554DE7CE0164"""
+"""5CB570CDA16AA45D_97D2E5B52CE33087_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""16A9554DE7CE0164"""
+"""6E09A9BC2637CC0D_63AF4A02E3E3602E_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""16A9554DE7CE0164"""
+"""E1D43D121212D47A_695BAD027F985828_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""16A9554DE7CE0164"""
+"""3DE56EE9C0B0993F_6B75F8237D93E803_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""16A9554DE7CE0164"""
+"""6CBFAD7AB15327B0_F8B7E76FA76B33E7_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""16A9554DE7CE0164"""
+"""68C424ED7710565E_2806D0C9A11637C3_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""16A9554DE7CE0164"""
+"""64CF083B83A8A5F7_6209B77836D8B04E_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""16A9554DE7CE0164"""
+"""DD67174AC3505666_8E34291A3CF21441_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""16A9554DE7CE0164"""
+"""2F9B0F5830A43A61_87D99D7E97A739FB_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](=O)(=O)C3CC3)CC#C""",21,"""16A9554DE7CE0164"""
+"""684E50FB794A7B6B_D3D987F570A9FC3D_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""16A9554DE7CE0164"""
+"""802985ED69C55C76_FBB2C80855ADB0D5_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N3CCCC(C)(C)[S]3(=O)=O""",21,"""16A9554DE7CE0164"""
+"""A4DC33AA883ACCB6_309B335CDC6B7BC6_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N3CCCC(CC)[S]3(=O)=O""",21,"""16A9554DE7CE0164"""
+"""2AA0EEB3F96624F7_01F24386B9D2CD69_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""16A9554DE7CE0164"""
+"""DE59E39C97EA1C43_DEEC2428C3DAF447_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""16A9554DE7CE0164"""
+"""1E60AA4D3B13F4C7_75D4EAB1174A696B_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""16A9554DE7CE0164"""
+"""E61153A2F4D87029_35B85AE11270B0D5_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""16A9554DE7CE0164"""
+"""4D3F68A831025B34_9DF7C035E96DAFBD_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N3[S](CCN(C)CC3)(=O)=O""",21,"""16A9554DE7CE0164"""
+"""5083606E8CE1E90A_1160E6B881C4445E_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N3CC(=O)NCC[S]3(=O)=O""",21,"""16A9554DE7CE0164"""
+"""12360984B81EC147_449BFBB12C6183CA_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N3[S](CCCCC3C)(=O)=O""",21,"""16A9554DE7CE0164"""
+"""00BF82627393C8E7_3E33BE7D82816C34_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(CCN)[S](=O)(=O)C3CC3""",21,"""16A9554DE7CE0164"""
+"""41025F9485387EAE_58C998BC26ADFEC3_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""16A9554DE7CE0164"""
+"""B8DB38813E1ED69A_F8CC04D918A60021_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N([S](CC)(=O)=O)C3CNC3""",21,"""16A9554DE7CE0164"""
+"""55ECB0689B319FE1_CA55D0E58F4F545C_6036_DP""","""C1(CCOC2=C1C=C(C=C2)Br)N4CC3(CNC3)C[S]4(=O)=O""",21,"""16A9554DE7CE0164"""
+"""B6BB770D79EF6678_7020A977568C1036_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""16A9554DE7CE0164"""
+"""9B88391F7F1FBBDF_8CCB31275FEE0086_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""16A9554DE7CE0164"""
+"""292DB8C5DF5EDCE3_B2AA569092D0C81D_6036_UN""","""C1(CCOC2=C1C=C(C=C2)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""16A9554DE7CE0164"""
+"""58E428AB9E241CC8_169B49B4D1CABB5A_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=CC=C2)OC3CCCC3""",21,"""176B18E020514286"""
+"""0A1EC3B48F299598_B9ECB1982ADA17A6_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=C(OCC)C=C2)OCC""",21,"""176B18E020514286"""
+"""B857E72884CED6ED_45ECC65FB531E08C_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=CC(=C2)OCCC(C)C""",21,"""176B18E020514286"""
+"""6C3C574F3C8D15CD_19D63E09261DD688_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""176B18E020514286"""
+"""179355AF86686176_2AFE51C8A1732020_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=C(C=C2)OC3CCOC3""",21,"""176B18E020514286"""
+"""BF9FC69C08693A0C_E11FB5BC7904D4D3_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""176B18E020514286"""
+"""18850028CD687D6C_397091B02DC0C55B_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=CC(=C2)COCCOC""",21,"""176B18E020514286"""
+"""BE0D7E7FECC3DFB9_B01D1CB1237CCE37_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""176B18E020514286"""
+"""A01D2A3E2F384174_AF06085214362952_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=CC(=C2)OC(COC)C""",21,"""176B18E020514286"""
+"""7F6D909D52D24225_FD47F0669F83897E_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""176B18E020514286"""
+"""016E85E6CBEC2473_E8BE165204FE283C_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""176B18E020514286"""
+"""5E7B529171ABF19D_9105797EF3C41441_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=CC=C2)CN3CCCC3""",21,"""176B18E020514286"""
+"""67DC88E24C9F9E9A_88215D7C9BA8FBC1_6005_UN""","""COC1=CC(=C(N=C1)F)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""176B18E020514286"""
+"""7E0E70E4B32427A3_F5D5029E1CBE4AA8_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=CC(=C2)OCCN(C)C""",21,"""176B18E020514286"""
+"""7CB522EA7B882B6C_0208CE5C8DDCE993_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""176B18E020514286"""
+"""AFF0A4F16968BBC2_352FF6D87AB6EA27_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""176B18E020514286"""
+"""1CDC0BE87F34A0C5_E7E3085C50B9C094_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""176B18E020514286"""
+"""92BC307056C7D7A5_3736C6D4A5E3F487_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""176B18E020514286"""
+"""D8F3E51AAC46EC34_18A3F29BB6C49642_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""176B18E020514286"""
+"""014ADE9703DEB1F5_1D980C3E6AF4446B_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""176B18E020514286"""
+"""99E5F083DFC1AE27_D863AAC90A74D85F_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""176B18E020514286"""
+"""8F9EF2946F8A69AC_C84F3A98D59A6CAB_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""176B18E020514286"""
+"""7261A839814C8E3B_155C63A17B3998D1_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""176B18E020514286"""
+"""AFC60DDBED9F444D_852F87DBE2C41204_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""176B18E020514286"""
+"""867F1B7DAA889B33_A00E376802CBDCDF_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""176B18E020514286"""
+"""CBEF587AA43F5012_C6F387292B426DBF_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=C(OCCC(C)C)C=C2""",21,"""176B18E020514286"""
+"""2900594B7E45CBCF_3B9EE43FD508FDEF_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=C(C=C2)OC3CCCC3""",21,"""176B18E020514286"""
+"""70F395BE49615F6A_BAA83DC162F3953B_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""176B18E020514286"""
+"""CE28EC0F98689BD4_CFD75FF318DF318C_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""176B18E020514286"""
+"""C6A1EF6A33794D2F_3030987FCFDECF61_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""176B18E020514286"""
+"""252993ED1D4ED5AA_C7B7718AE4A7E27F_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""176B18E020514286"""
+"""9318E5B82D0E211C_B1BC5F962CCBE514_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""176B18E020514286"""
+"""D4F56668782C4E32_748CCEACB52F8C6B_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""176B18E020514286"""
+"""E51521126444AC61_1EE8FB8A4A19870B_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""176B18E020514286"""
+"""492F2A6D32A81437_6FD349FF5B1209F8_6005_UN""","""COC1=CC(=C(N=C1)F)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""176B18E020514286"""
+"""9FA9B7ED918C4933_DD18A58A995B00BA_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""176B18E020514286"""
+"""BC7B5880403E20DA_A8D63702A3F79088_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""176B18E020514286"""
+"""1046CF59B055EF44_FB2A6F5B9D853199_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(C=CC=C2)CN3CCCC3""",21,"""176B18E020514286"""
+"""2F13150A402FEB74_63FE3FDA2137D223_6005_UN""","""COC1=CC(=C(N=C1)F)C2=CC(=N[N]2C3CCCCO3)C""",21,"""176B18E020514286"""
+"""309255190C1A5C7A_69F915D9784A36DE_6005_UN""","""COC1=CC(=C(N=C1)F)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""176B18E020514286"""
+"""1A358A9D70714303_16745DC764607A8F_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC(=CC=C2)OC3CCCC3""",21,"""17840C9395FB8353"""
+"""37CC8C684CF3D527_B903A5EB9F70D673_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC(=C(OCC)C=C2)OCC""",21,"""17840C9395FB8353"""
+"""1D9AC7D3CF90F274_4503D22C009B2159_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=CC(=C2)OCCC(C)C""",21,"""17840C9395FB8353"""
+"""F5A916A690CD97E1_19392A7A93B7175D_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""17840C9395FB8353"""
+"""94F43768C7107010_2A1145BB14D9E1F5_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=C(C=C2)OC3CCOC3""",21,"""17840C9395FB8353"""
+"""91B622C45636CEDE_E1F0A1CFCCAE1506_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""17840C9395FB8353"""
+"""629C557743A890C6_399F85C3986A048E_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=CC(=C2)COCCOC""",21,"""17840C9395FB8353"""
+"""FC9ADB3B63B563B4_B0F208C296D60FE2_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""17840C9395FB8353"""
+"""BCE9CF72703B1051_AFE91C21A19CE887_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=CC(=C2)OC(COC)C""",21,"""17840C9395FB8353"""
+"""D4FB06BBB82A97E4_FDA8E4152A2948AB_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""17840C9395FB8353"""
+"""E87AB7B9E4EC0160_E8510221B154E9E9_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""17840C9395FB8353"""
+"""CC25B670CDB0AC9F_91EA6D0D466ED594_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC(=CC=C2)CN3CCCC3""",21,"""17840C9395FB8353"""
+"""ACCE46EA8F50D949_88CE490F2E023A14_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""17840C9395FB8353"""
+"""F37BCE19CC813219_F53A16EDA9148B7D_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=CC(=C2)OCCN(C)C""",21,"""17840C9395FB8353"""
+"""E65BFCC865FCFE87_02E7DA2F38762846_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""17840C9395FB8353"""
+"""EE985A87AB31F248_35C0E2ABCF1C2BF2_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""17840C9395FB8353"""
+"""7F5B3AA7CA372DBB_E70C1C2FE5130141_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""17840C9395FB8353"""
+"""8C6E097234881B04_37D9D2A710493552_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""17840C9395FB8353"""
+"""EBD6A1A9F3BD7E4A_184CE6E8036E5797_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""17840C9395FB8353"""
+"""F91D3FF136926E80_1D77184DDF5E85BE_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""17840C9395FB8353"""
+"""1C634BAA73F35F08_D88CBEBABFDE198A_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""17840C9395FB8353"""
+"""0F4D932E727E9CE1_C8A02EEB6030AD7E_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""17840C9395FB8353"""
+"""B966A53107CD9908_15B377D2CE935904_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""17840C9395FB8353"""
+"""DDA5B50B33E3351B_85C093A8576ED3D1_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""17840C9395FB8353"""
+"""F618A44B9583F377_A0E1231BB7611D0A_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""17840C9395FB8353"""
+"""EE1323DE9D07600E_C61C935A9EE8AC6A_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=C(OCCC(C)C)C=C2""",21,"""17840C9395FB8353"""
+"""B84A2B8A123A6984_3B71F04C60A23C3A_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC=C(C=C2)OC3CCCC3""",21,"""17840C9395FB8353"""
+"""19B313CEBBEA4521_BA4729B2D75954EE_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""17840C9395FB8353"""
+"""3CB5C428C1E0A099_CF384B80AD75F059_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""17840C9395FB8353"""
+"""5B7A2F6D58956481_30DF8C0C7A740EB4_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""17840C9395FB8353"""
+"""CE15311AA050670C_C75865F9510D23AA_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""17840C9395FB8353"""
+"""836A723B8B854766_B1534BE5996124C1_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""17840C9395FB8353"""
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+"""513CA6B3559F37A0_1E07EFF9FFB346DE_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""17840C9395FB8353"""
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+"""19BD14D6E08C4104_DDF7B1F92CF1C16F_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""17840C9395FB8353"""
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+"""8EE7BFF63CCA5621_691601AACDE0F70B_6004_UN""","""NC1=C(C(=N[NH]1)C(=O)O)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""17840C9395FB8353"""
+"""B39C0ED6668FB9BB_167823D8783AF9D2_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC(=CC=C2)OC3CCCC3""",21,"""1788728C89A1000E"""
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+"""C637CD6118BF101F_AFE5623EBDC66BDA_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC=CC(=C2)OC(COC)C""",21,"""1788728C89A1000E"""
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+"""13BEE42383B4FF53_91E613125A3456C9_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC(=CC=C2)CN3CCCC3""",21,"""1788728C89A1000E"""
+"""5A8C1DFEEFA7E8EE_88C237103258B949_6004_UN""","""NC(=NO)C1=NN=C(S1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""1788728C89A1000E"""
+"""F8ADC5D525E935DA_F53668F2B54E0820_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC=CC(=C2)OCCN(C)C""",21,"""1788728C89A1000E"""
+"""16DF95AE8F232CA5_02EBA430242CAB1B_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""1788728C89A1000E"""
+"""BD158F4E55095E09_35CC9CB4D346A8AF_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""1788728C89A1000E"""
+"""5060ACBC95677088_E7006230F949821C_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""1788728C89A1000E"""
+"""F5A040FA60010EFE_37D5ACB80C13B60F_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""1788728C89A1000E"""
+"""A391404FDDF023BD_184098F71F34D4CA_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""1788728C89A1000E"""
+"""A109B9B91554ACE6_1D7B6652C30406E3_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""1788728C89A1000E"""
+"""1B0049A3014E8B3F_D880C0A5A3849AD7_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""1788728C89A1000E"""
+"""21F9F2B176ADF8F7_C8AC50F47C6A2E23_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""1788728C89A1000E"""
+"""0E3661A50864BCD2_15BF09CDD2C9DA59_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""1788728C89A1000E"""
+"""AAFD63E3DB16692C_85CCEDB74B34508C_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""1788728C89A1000E"""
+"""AD9E29863B88B4F7_A0ED5D04AB3B9E57_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""1788728C89A1000E"""
+"""303A3A12A0AB8BEF_C610ED4582B22F37_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC=C(OCCC(C)C)C=C2""",21,"""1788728C89A1000E"""
+"""ED6C8C4AAAE1D3E2_3B7D8E537CF8BF67_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC=C(C=C2)OC3CCCC3""",21,"""1788728C89A1000E"""
+"""A44207850A64CE2E_BA4B57ADCB03D7B3_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""1788728C89A1000E"""
+"""F3B63778EEF77190_CF34359FB12F7304_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""1788728C89A1000E"""
+"""2F0B6EFF3310AA4E_30D3F213662E8DE9_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""1788728C89A1000E"""
+"""48B64AC5EC0079B9_C7541BE64D57A0F7_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""1788728C89A1000E"""
+"""EA0B935544D28A01_B15F35FA853BA79C_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""1788728C89A1000E"""
+"""CF04B17510632A47_746FA4C01CDFCEE3_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""1788728C89A1000E"""
+"""5F7EF271EC618088_1E0B91E6E3E9C583_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""1788728C89A1000E"""
+"""5C9FDB7455B02A05_6F302393F2E24B70_6004_UN""","""NC(=NO)C1=NN=C(S1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""1788728C89A1000E"""
+"""575482DDCAE90ACE_DDFBCFE630AB4232_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""1788728C89A1000E"""
+"""F0223A196EF8EA69_A8355D6E0A07D200_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""1788728C89A1000E"""
+"""0C79441BB8394A84_FBC9053734757311_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(C=CC=C2)CN3CCCC3""",21,"""1788728C89A1000E"""
+"""495959FD2D024FCB_631D55B688C790AB_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""1788728C89A1000E"""
+"""3C4CA98378C2C371_691A7FB5D1BA7456_6004_UN""","""NC(=NO)C1=NN=C(S1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""1788728C89A1000E"""
+"""057170192F14B5E5_928172EB9675FD68_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CN=C(OC)C=C3""",21,"""19BA8A913D99FA0F"""
+"""ABE65963B09A383E_9050108A64A60859_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CC(=C(N=C3)O)C""",21,"""19BA8A913D99FA0F"""
+"""F877C2F8D066D5C0_4C56DB1414C3D415_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C=CC=C3F)F""",21,"""19BA8A913D99FA0F"""
+"""CB805AF6FBAAED95_6071DE53D7429030_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C=CC(=C3)C)C""",21,"""19BA8A913D99FA0F"""
+"""CF6B598B60D21D19_36A470D3E1C772CC_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CC=C(SC)C=C3""",21,"""19BA8A913D99FA0F"""
+"""17E746450905F4B6_D14B2612CF518528_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C(=CC=C3)Cl)Cl""",21,"""19BA8A913D99FA0F"""
+"""CAACD8F5ADBD4988_66CDF0927C0750C4_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(N=C(C=C3)O)F""",21,"""19BA8A913D99FA0F"""
+"""F2F080CC9B294AAE_217E049B4A39EB7A_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C)C=NC(=C3)F""",21,"""19BA8A913D99FA0F"""
+"""9FAE5A92AC4ED335_4B1B4B29CCCCD076_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CC(=C(C=C3)F)F""",21,"""19BA8A913D99FA0F"""
+"""BB916A7114A07B99_62A20A336A2F5EA0_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CC(=C(C)C=C3)C""",21,"""19BA8A913D99FA0F"""
+"""E1BCB69864026304_B2B06D4A1EAC84CC_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(SC)C=CC=C3""",21,"""19BA8A913D99FA0F"""
+"""4DA56A6575103866_18CB7FEED6EE0658_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C)C=CC=C3C""",21,"""19BA8A913D99FA0F"""
+"""9D98717B71AEACC9_97BBCB05CF50C491_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C)C(=NC=C3)F""",21,"""19BA8A913D99FA0F"""
+"""F5C9BF24DC880196_A8324EB505F04A49_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CSC=C3C(F)F""",21,"""19BA8A913D99FA0F"""
+"""C6857B95BEF3AFD6_8BB35FE25F10882E_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C(=CC=C3)Cl)F""",21,"""19BA8A913D99FA0F"""
+"""F500A83EDE719872_4EB10C7DC265735B_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CC(=C(C=C3)F)Cl""",21,"""19BA8A913D99FA0F"""
+"""371AA824339DCE40_0F5B7F7A1DF7656D_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CC(=CC=C3)CF""",21,"""19BA8A913D99FA0F"""
+"""6169F741DB0E3169_1E6755B0454B7919_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CC=C(C=C3)CF""",21,"""19BA8A913D99FA0F"""
+"""9595FECA70DC9D0B_79450A34A4DAC6AF_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C)C=C(C=C3)F""",21,"""19BA8A913D99FA0F"""
+"""C4B2C7D0660928A6_CA3B2ECB18E980EC_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(CC)C=CC=C3""",21,"""19BA8A913D99FA0F"""
+"""C0B035F5590E50C3_187FC0E2AAC4C430_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C=CC(=C3)F)F""",21,"""19BA8A913D99FA0F"""
+"""D85028B0333C987D_B5FF1BB6F6E966CF_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(OC)N=CC=C3""",21,"""19BA8A913D99FA0F"""
+"""174AF64E42DBF0A1_D8407051F24B6459_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CC(=NC=C3)OC""",21,"""19BA8A913D99FA0F"""
+"""09DCC5ABB32EFA07_BFE1BB0069479F89_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C=C(C)C=C3)F""",21,"""19BA8A913D99FA0F"""
+"""02F12F51FE35C635_94F7DC3017D76CD4_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C(=CC=C3)Br)F""",21,"""19BA8A913D99FA0F"""
+"""5A73942E45C02D6D_80308B7FD33C8C97_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C=C(C)C=C3)C""",21,"""19BA8A913D99FA0F"""
+"""EDCF0F6355E75097_384FFD8C46A5B206_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CC=CC(=C3)CC""",21,"""19BA8A913D99FA0F"""
+"""776B55CC97D226C9_FA57A1D1997D9E8B_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C([N](C)N=C3)C#N""",21,"""19BA8A913D99FA0F"""
+"""5695BAD3BF07F895_1C7124EAF9D15414_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=C(C)C=CC(=C3)F""",21,"""19BA8A913D99FA0F"""
+"""4CF5CA16CCB9ABC3_19FAAD2A7CCC0488_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CC(=C(C=C3)Cl)F""",21,"""19BA8A913D99FA0F"""
+"""9B7D65C2687E570A_05C7462F103DFD79_6006_UN""","""FC1=C(C=C(C=C1)C(=O)CC2CC2)C3=CN=C(NC)C=C3""",21,"""19BA8A913D99FA0F"""
+"""37C70F22E896E853_B9BF9A74D8F9F328_2201_UN""","""FC1=C(C=C(C=C1)C3=NC2=C(C=CC=N2)C=C3C4CC4)Cl""",21,"""19BA8A913D99FA0F"""
+"""B5C352FE29F4036A_0F22675FBC8E24C1_2201_UN""","""FC1=C(C=C(C=C1)C3=NC2=C(C=NC=C2)C=C3C4CC4)Cl""",21,"""19BA8A913D99FA0F"""
+"""F55A541A9F21E64F_D56E2FDACF51DDB2_2201_UN""","""FC1=C(C=C(C=C1)C3=NC2=NON=C2C(=C3C4CC4)C)Cl""",21,"""19BA8A913D99FA0F"""
+"""1F4BF4B0CA95D566_388A1E9022769C8B_2201_UN""","""FC1=C(C=C(C=C1)C2=NC4=C(C(=C2C3CC3)C)C=CS4)Cl""",21,"""19BA8A913D99FA0F"""
+"""396B424DABAB13E2_30B7E42FC1060D65_2201_UN""","""FC1=C(C=C(C=C1)C3=NC2=C(C=N[N]2C)C=C3C4CC4)Cl""",21,"""19BA8A913D99FA0F"""
+"""ECE8FF58DCE96B38_CC3039602697F3B0_2201_UN""","""FC1=C(C=C(C=C1)C3=NC2=C(C=CN=C2)C=C3C4CC4)Cl""",21,"""19BA8A913D99FA0F"""
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+"""ADC885458FFB8A8C_FF8CDE0A400FF7D5_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC=CC(=C2)OCCN(C)C""",21,"""1D32C4747CE0FFFB"""
+"""316A3076D32A70A2_085112C8D16D54EE_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""1D32C4747CE0FFFB"""
+"""E419F908AE49C579_3F762A4C2607575A_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""1D32C4747CE0FFFB"""
+"""53B5F0C2A8A19A61_EDBAD4C80C087DE9_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""1D32C4747CE0FFFB"""
+"""AA71A6D82E7B94DA_3D6F1A40F95249FA_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""1D32C4747CE0FFFB"""
+"""595FF32EA81D7B27_12FA2E0FEA752B3F_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""1D32C4747CE0FFFB"""
+"""88DB229AD594C514_17C1D0AA3645F916_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""1D32C4747CE0FFFB"""
+"""DB6DBC2B24E26E0E_D23A765D56C56522_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""1D32C4747CE0FFFB"""
+"""C308364EA0B52E4D_C216E60C892BD1D6_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""1D32C4747CE0FFFB"""
+"""720F592C0854A696_1F05BF35278825AC_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""1D32C4747CE0FFFB"""
+"""5B4CDD831D9A6516_8F765B4FBE75AF79_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""1D32C4747CE0FFFB"""
+"""1D2ACF79430E2DD1_AA57EBFC5E7A61A2_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""1D32C4747CE0FFFB"""
+"""903EA64759179B9B_CCAA5BBD77F3D0C2_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC=C(OCCC(C)C)C=C2""",21,"""1D32C4747CE0FFFB"""
+"""78BC141F0E068CD9_31C738AB89B94092_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC=C(C=C2)OC3CCCC3""",21,"""1D32C4747CE0FFFB"""
+"""D52D96C634315931_B0F1E1553E422846_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""1D32C4747CE0FFFB"""
+"""19209AFB046B47E7_C58E8367446E8CF1_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""1D32C4747CE0FFFB"""
+"""942C3BD34031F92E_3A6944EB936F721C_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""1D32C4747CE0FFFB"""
+"""3C18735349304521_CDEEAD1EB8165F02_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""1D32C4747CE0FFFB"""
+"""7288413C4DB91679_BBE58302707A5869_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""1D32C4747CE0FFFB"""
+"""3B0CFFAF8029D348_7ED51238E99E3116_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""1D32C4747CE0FFFB"""
+"""5D8920DEBC463567_14B1271E16A83A76_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""1D32C4747CE0FFFB"""
+"""13B73EB83CEA6B5F_658A956B07A3B485_6005_UN""","""COC1=C(C(=CC=C1)F)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""1D32C4747CE0FFFB"""
+"""B504D0EC6A6945E2_D741791EC5EABDC7_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""1D32C4747CE0FFFB"""
+"""97AACC5CA74B1DF6_A28FEB96FF462DF5_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""1D32C4747CE0FFFB"""
+"""721B3223C8AC1576_F173B3CFC1348CE4_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(C=CC=C2)CN3CCCC3""",21,"""1D32C4747CE0FFFB"""
+"""BEADD6227DE81471_69A7E34E7D866F5E_6005_UN""","""COC1=C(C(=CC=C1)F)C2=CC(=N[N]2C3CCCCO3)C""",21,"""1D32C4747CE0FFFB"""
+"""62F0A6528AB25E18_63A0C94D24FB8BA3_6005_UN""","""COC1=C(C(=CC=C1)F)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""1D32C4747CE0FFFB"""
+"""FB7ED23092CB3992_1C945319A1337691_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=CC=C2)OC3CCCC3""",21,"""1D64024D50A88F4D"""
+"""5077CF2F9B167090_B3E3AB355A23DA6D_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=C(OCC)C=C2)OCC""",21,"""1D64024D50A88F4D"""
+"""9D0B4CC393951F54_4FE3DCF2C5C82D47_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=CC(=C2)OCCC(C)C""",21,"""1D64024D50A88F4D"""
+"""F42B9B456D5AE425_13D924A456E41B43_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""1D64024D50A88F4D"""
+"""3DBFCA4DC7310CEE_20F14B65D18AEDEB_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=C(C=C2)OC3CCOC3""",21,"""1D64024D50A88F4D"""
+"""4E2BB3EAC8821D19_EB10AF1109FD1918_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""1D64024D50A88F4D"""
+"""CF1DAD1C7ACB6220_337F8B1D5D390890_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=CC(=C2)COCCOC""",21,"""1D64024D50A88F4D"""
+"""2156CB16C4DD36B5_BA12061C538503FC_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""1D64024D50A88F4D"""
+"""AB06B3C3D83CB907_A50912FF64CFE499_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=CC(=C2)OC(COC)C""",21,"""1D64024D50A88F4D"""
+"""1810D84947A432CF_F748EACBEF7A44B5_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""1D64024D50A88F4D"""
+"""6659FE2E480AACE6_E2B10CFF7407E5F7_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""1D64024D50A88F4D"""
+"""06D4E70B34333CAD_9B0A63D3833DD98A_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=CC=C2)CN3CCCC3""",21,"""1D64024D50A88F4D"""
+"""473072CD36A413DB_822E47D1EB51360A_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""1D64024D50A88F4D"""
+"""DD715854D6BBB47F_FFDA18336C478763_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=CC(=C2)OCCN(C)C""",21,"""1D64024D50A88F4D"""
+"""090E3F6B11EB77EF_0807D4F1FD252458_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""1D64024D50A88F4D"""
+"""62BDEEA4736929DB_3F20EC750A4F27EC_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""1D64024D50A88F4D"""
+"""3B83235588F28D23_EDEC12F120400D5F_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""1D64024D50A88F4D"""
+"""9C180FD700AADD81_3D39DC79D51A394C_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""1D64024D50A88F4D"""
+"""F54788722247CB0F_12ACE836C63D5B89_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""1D64024D50A88F4D"""
+"""9F042DEE624C8F03_179716931A0D89A0_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""1D64024D50A88F4D"""
+"""4396A51E5B1EBF05_D26CB0647A8D1594_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""1D64024D50A88F4D"""
+"""6369B357CB5D8B1D_C2402035A563A160_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""1D64024D50A88F4D"""
+"""AE32C75FEF329B9E_1F53790C0BC0551A_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""1D64024D50A88F4D"""
+"""2A430DEFA0EA07A7_8F209D76923DDFCF_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""1D64024D50A88F4D"""
+"""FEDB43B3B40DDE25_AA012DC572321114_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""1D64024D50A88F4D"""
+"""B46C02A7AB60E898_CCFC9D845BBBA074_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=C(OCCC(C)C)C=C2""",21,"""1D64024D50A88F4D"""
+"""9E32968F0B16EE8D_3191FE92A5F13024_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=C(C=C2)OC3CCCC3""",21,"""1D64024D50A88F4D"""
+"""BB99EAE855ECA481_B0A7276C120A58F0_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""1D64024D50A88F4D"""
+"""A5C3D96F30D7B146_C5D8455E6826FC47_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""1D64024D50A88F4D"""
+"""B389F539E5A861C8_3A3F82D2BF2702AA_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""1D64024D50A88F4D"""
+"""E25250C47A088170_CDB86B27945E2FB4_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""1D64024D50A88F4D"""
+"""0B84C0EDCC61C5D2_BBB3453B5C3228DF_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""1D64024D50A88F4D"""
+"""09F1A86BC883F1DD_7E83D401C5D641A0_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""1D64024D50A88F4D"""
+"""AF78F9EFDD0B905B_14E7E1273AE04AC0_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""1D64024D50A88F4D"""
+"""BB020E77E75C05C7_65DC53522BEBC433_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""1D64024D50A88F4D"""
+"""F0A20BDB59CC970B_D717BF27E9A2CD71_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""1D64024D50A88F4D"""
+"""86D6232713CEEC8C_A2D92DAFD30E5D43_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""1D64024D50A88F4D"""
+"""06AD3B86F09D7FB6_F12575F6ED7CFC52_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(C=CC=C2)CN3CCCC3""",21,"""1D64024D50A88F4D"""
+"""0C08199563EA38FE_69F1257751CE1FE8_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""1D64024D50A88F4D"""
+"""88E4A3C0F2FFA6A7_63F60F7408B3FB15_6005_UN""","""FC(F)(F)[N]1C=C(C=N1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""1D64024D50A88F4D"""
+"""4C1196592B8A6845_1C82E2F20BBC688E_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC(=CC=C3)OC4CCCC4""",21,"""1D72B3A6FA279152"""
+"""F85E457163BE20FB_B3F51ADEF0ACC472_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC(=C(OCC)C=C3)OCC""",21,"""1D72B3A6FA279152"""
+"""76AB0E6D60003400_4FF56D196F473358_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC=CC(=C3)OCCC(C)C""",21,"""1D72B3A6FA279152"""
+"""9C046CA5E56C29D3_13CF954FFC6B055C_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""1D72B3A6FA279152"""
+"""3C38D9D6A24B3F5C_20E7FA8E7B05F3F4_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC=C(C=C3)OC4CCOC4""",21,"""1D72B3A6FA279152"""
+"""ACE5D1481E918649_EB061EFAA3720707_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""1D72B3A6FA279152"""
+"""0CA6A3817829D6DA_33693AF6F7B6168F_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC=CC(=C3)COCCOC""",21,"""1D72B3A6FA279152"""
+"""D3F90EFAD9AB9BE1_BA04B7F7F90A1DE3_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""1D72B3A6FA279152"""
+"""7BE9F513AEAE89E5_A51FA314CE40FA86_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC=CC(=C3)OC(COC)C""",21,"""1D72B3A6FA279152"""
+"""F9F014A66953C277_F75E5B2045F55AAA_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""1D72B3A6FA279152"""
+"""A36424DC40DAC007_E2A7BD14DE88FBE8_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""1D72B3A6FA279152"""
+"""3B808B1478CAB558_9B1CD23829B2C795_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC(=CC=C3)CN4CCCC4""",21,"""1D72B3A6FA279152"""
+"""54B0D6147B498473_8238F63A41DE2815_6005_UN""","""C2(=C[N]1CCOCC1=N2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""1D72B3A6FA279152"""
+"""7BC13A41ABDDBBE5_FFCCA9D8C6C8997C_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC=CC(=C3)OCCN(C)C""",21,"""1D72B3A6FA279152"""
+"""3A99FE9AAD90C835_0811651A57AA3A47_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""1D72B3A6FA279152"""
+"""38B2AE4CFCF01878_3F365D9EA0C039F3_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""1D72B3A6FA279152"""
+"""DD00B1CC14DAA8E0_EDFAA31A8ACF1340_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""1D72B3A6FA279152"""
+"""AE99B92A0CDEC6ED_3D2F6D927F952753_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""1D72B3A6FA279152"""
+"""5CFA077FFF90D54E_12BA59DD6CB24596_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""1D72B3A6FA279152"""
+"""C0791E6944075C35_1781A778B08297BF_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""1D72B3A6FA279152"""
+"""8C36A204E5B1E869_D27A018FD0020B8B_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""1D72B3A6FA279152"""
+"""0872095CDB9900AA_C25691DE0FECBF7F_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""1D72B3A6FA279152"""
+"""5DA83E8997CC5B92_1F45C8E7A14F4B05_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""1D72B3A6FA279152"""
+"""9128FFE31AC6984C_8F362C9D38B2C1D0_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""1D72B3A6FA279152"""
+"""276C47791A64D821_AA179C2ED8BD0F0B_6005_UN""","""C2(=C[N]1CCOCC1=N2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""1D72B3A6FA279152"""
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+"""9E9BE23C9DB847CF_CA36525FB620CB4E_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""201ABAD909F200B6"""
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+"""67EBF535E209059C_BF50FF45B20BB9F1_6005_UN""","""CSC1=CC(=C(C=C1)N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""201ABAD909F200B6"""
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+"""91E81E0229D0D363_35796C65A47FABA3_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""201ABAD909F200B6"""
+"""7075959B80C20865_025E54E15315A817_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""201ABAD909F200B6"""
+"""F1AACD58E7715257_D092AA65791A82A4_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""201ABAD909F200B6"""
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+"""6374C24B180C2192_2FD250A29F67D472_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""201ABAD909F200B6"""
+"""91C0BE214EA85581_2AE9AE074357065B_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""201ABAD909F200B6"""
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+"""C9D07A88C49F2C27_FF3E98A1FC392E9B_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""201ABAD909F200B6"""
+"""767C894C536CBD0E_222DC198529ADAE1_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""201ABAD909F200B6"""
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+"""3782BF471C203DE8_F182251002E12F8F_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC=C(OCCC(C)C)C=C2""",21,"""201ABAD909F200B6"""
+"""30480255B7017178_0CEF4606FCABBFDF_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC=C(C=C2)OC3CCCC3""",21,"""201ABAD909F200B6"""
+"""0677F088CA2FE09F_8DD99FF84B50D70B_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""201ABAD909F200B6"""
+"""E0C83FD49A270CB5_F8A6FDCA317C73BC_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""201ABAD909F200B6"""
+"""D8C22F68868476E9_07413A46E67D8D51_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""201ABAD909F200B6"""
+"""125C9BF4750A6E91_F0C6D3B3CD04A04F_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""201ABAD909F200B6"""
+"""26C80EDC2DCF7D64_86CDFDAF0568A724_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""201ABAD909F200B6"""
+"""15F1ABF6BA42449F_43FD6C959C8CCE5B_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""201ABAD909F200B6"""
+"""CCB85DC81DAAF39D_299959B363BAC53B_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""201ABAD909F200B6"""
+"""6473D5366D352ADF_58A2EBC672B14BC8_6005_UN""","""CSC1=CC(=C(C=C1)N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""201ABAD909F200B6"""
+"""4A97DE5F4E08DCB7_EA6907B3B0F8428A_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""201ABAD909F200B6"""
+"""8F1AACF09BCE6F26_9FA7953B8A54D2B8_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""201ABAD909F200B6"""
+"""4F910E4BD55C47C2_CC5BCD62B42673A9_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(C=CC=C2)CN3CCCC3""",21,"""201ABAD909F200B6"""
+"""81F2C8A26F678827_548F9DE308949013_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""201ABAD909F200B6"""
+"""D41789B08101EFCF_5E88B7E051E974EE_6005_UN""","""CSC1=CC(=C(C=C1)N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""201ABAD909F200B6"""
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+"""332C4C8655133C54_96A245302E26422C_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NOC=C3""",21,"""20D5FD142855FDA8"""
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+"""89C5B87C47B34028_B383DE86376F2DDA_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=C(C(=C(C)[NH]2)C(OCC)=O)C""",21,"""20D5FD142855FDA8"""
+"""D1FD8F14F44868D1_BF1FF0320190C894_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=CC=C(C(C)NC(=O)C)C=C2""",21,"""20D5FD142855FDA8"""
+"""C592F71E4D75796E_388BDD007F5E6F57_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=C([N](CCC(C)C)C(=C2)C)C""",21,"""20D5FD142855FDA8"""
+"""1FF93A1AE4354893_5D00134DBD273954_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=C(C)[N](C(=C2)C)CC(F)(F)F""",21,"""20D5FD142855FDA8"""
+"""9508DA91671127FB_0BA04C428171D610_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=CC=C(NC(C(C)C)=O)C=C2""",21,"""20D5FD142855FDA8"""
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+"""840E09577B9369FA_1287E4A88FF5A950_1171_UN""","""CC(C)(C)C1=NC(=CS1)C3=CC2=C(NC(C2(C)C)=O)C=C3""",21,"""20D5FD142855FDA8"""
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+"""5DE377572E90A28D_C0B6224C05CCA263_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=CC=C(N(C)[S](=O)(=O)C)C=C2""",21,"""20D5FD142855FDA8"""
+"""92218DDB94036F88_A1AC3F2F2FCFE8D2_1171_UN""","""CC(C)(C)C1=NC(=CS1)C3=CC2=C(N(C)C(=O)CC2)C=C3""",21,"""20D5FD142855FDA8"""
+"""7D8133697A49D615_20FB198CC8842702_1171_UN""","""CC(C)(C)C1=NC(=CS1)C3=C[N](C2=CC=CC(=C2)C)N=N3""",21,"""20D5FD142855FDA8"""
+"""7718A52F61DEB493_10D284BB688D52D6_1171_UN""","""CC(C)(C)C1=NC(=CS1)C3=CC2=C(CCN(C(C)=O)C2)S3""",21,"""20D5FD142855FDA8"""
+"""98FBAF8AA62B71F5_F0B98335445BD405_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=CC3=C(C=C2)NC(N(C)C3)=O""",21,"""20D5FD142855FDA8"""
+"""233E161C83595A56_80D82343DD80893E_1171_UN""","""CC(C)(C)C1=NC(=CS1)C3=C2OCC(C2=C(OC)C=C3)=O""",21,"""20D5FD142855FDA8"""
+"""CDDAF272F82A1C86_656F2E08FC45AD81_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=CC=C([S](N(C)C)(=O)=O)C=C2""",21,"""20D5FD142855FDA8"""
+"""6951B43D0E90EEB6_7B250BB4BBE9459A_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2(NC(C(F)(F)F)=O)CCCC2""",21,"""20D5FD142855FDA8"""
+"""3A35E0ADED78E7A6_6CA6B05790B07183_1171_UN""","""CC(C)(C)C1=NC(=CS1)C3=C[N](C2=CC=C(F)C=C2)N=N3""",21,"""20D5FD142855FDA8"""
+"""43E4142D2DFE6A4B_EB306545A0CE8A29_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2CCN(C(C(F)(F)F)=O)CC2""",21,"""20D5FD142855FDA8"""
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+"""F93EB21BCB12D9D3_5C4586B06978EF87_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=CC(=C(C=C2)NC(=O)C)SC""",21,"""20D5FD142855FDA8"""
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+"""EC9B2818AF5A490D_08EE5E1EF2A0BBBB_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=C([NH]C(=C2C)C(OCC)=O)C""",21,"""20D5FD142855FDA8"""
+"""40D6BFA8A4E4B222_7A06E133B7B80770_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=CC=C(CCNC(C)=O)C=C2""",21,"""20D5FD142855FDA8"""
+"""FBBBAD45B802CA17_D6460948697BCB9D_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=CC=C(CN(C)C(=O)C)C=C2""",21,"""20D5FD142855FDA8"""
+"""1B27B71E34069DF2_6DC0CBF62DDC07F3_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=CC(=NO2)C3=CC=C(F)C=C3""",21,"""20D5FD142855FDA8"""
+"""D2C93D59C3C3EB2D_2CDF8DEAF57CA831_1171_UN""","""CC(C)(C)C2=NC(=C(CC1=CC=CC=C1)S2)C(OCC)=O""",21,"""20D5FD142855FDA8"""
+"""23320C37916BFB53_D8F85A639001A8CF_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=C([N](CC(OC)=O)C(=C2)C)C""",21,"""20D5FD142855FDA8"""
+"""A49B754CEF9EED02_DCB27999402410FD_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=CC=CC(=C2)[S](N(C)C)(=O)=O""",21,"""20D5FD142855FDA8"""
+"""07A734E81ABD4612_B10B5B084C61D634_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=C([N](C(COC)C)C(=C2)C)C""",21,"""20D5FD142855FDA8"""
+"""D24C8EB5F287F5BF_D3197668D57887BC_1171_UN""","""CC(C)(C)C1=NC(=CS1)C2=C(C)[N](N=C2)C3=CC=CC=C3""",21,"""20D5FD142855FDA8"""
+"""5C2403259765CCED_20E0EBA51297799B_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC(=CC=C2)OC3CCCC3""",21,"""2110BAF1E30C8047"""
+"""3357F9C952508879_8F971389E987D567_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC(=C(OCC)C=C2)OCC""",21,"""2110BAF1E30C8047"""
+"""4AF8F6D1ADF29335_7397644E766C224D_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC=CC(=C2)OCCC(C)C""",21,"""2110BAF1E30C8047"""
+"""4D0F23EFD0ACAE40_2FAD9C18E5401449_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""2110BAF1E30C8047"""
+"""DF7495C1C769AE45_1C85F3D9622EE2E1_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC=C(C=C2)OC3CCOC3""",21,"""2110BAF1E30C8047"""
+"""64DDC0AB95D3B7C1_D76417ADBA591612_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""2110BAF1E30C8047"""
+"""73A00B278B88EE7A_0F0B33A1EE9D079A_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC=CC(=C2)COCCOC""",21,"""2110BAF1E30C8047"""
+"""4F7AD987EFCDC547_8666BEA0E0210CF6_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""2110BAF1E30C8047"""
+"""605CD514DF99E38F_997DAA43D76BEB93_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC=CC(=C2)OC(COC)C""",21,"""2110BAF1E30C8047"""
+"""3A42E05D88645632_CB3C52775CDE4BBF_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""2110BAF1E30C8047"""
+"""C4A36B4EE87B244E_DEC5B443C7A3EAFD_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""2110BAF1E30C8047"""
+"""6479AFD715366B2E_A77EDB6F3099D680_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC(=CC=C2)CN3CCCC3""",21,"""2110BAF1E30C8047"""
+"""37D3A65C2A79DEE5_BE5AFF6D58F53900_6005_UN""","""NCC1=CC(=CC(=C1)F)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""2110BAF1E30C8047"""
+"""D00DF9CDFCB649AB_C3AEA08FDFE38869_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC=CC(=C2)OCCN(C)C""",21,"""2110BAF1E30C8047"""
+"""6CE7C5BFCE17E981_34736C4D4E812B52_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""2110BAF1E30C8047"""
+"""8502D1BDE0719EA5_035454C9B9EB28E6_6005_UN""","""NCC1=CC(=CC(=C1)F)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""2110BAF1E30C8047"""
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+"""863AB7E495DE3C40_EE34EC4578729132_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""213C5E6C52570BEB"""
+"""90820BBEBBEB6C38_FE187C14A79C25C6_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""213C5E6C52570BEB"""
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+"""BE9FC93B8DD901BE_965971E470CD95B2_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""213C5E6C52570BEB"""
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+"""711931CE12706241_F1E0370696A1AB12_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""213C5E6C52570BEB"""
+"""9B90205CF0CAE3B8_87EB191A5ECDAC79_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""213C5E6C52570BEB"""
+"""D1CB16CE461B66F7_42DB8820C729C506_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""213C5E6C52570BEB"""
+"""724A5FE19AFA9B9D_28BFBD06381FCE66_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""213C5E6C52570BEB"""
+"""9F587F41BDB594D1_59840F7329144095_6005_UN""","""OC(=O)C1=C(N=CC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""213C5E6C52570BEB"""
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+"""F5AFE2DE56F14158_9E81718ED1F1D9E5_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""213C5E6C52570BEB"""
+"""253F9EDF558F6772_CD7D29D7EF8378F4_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""213C5E6C52570BEB"""
+"""618D5227009B7C9E_55A9795653319B4E_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""213C5E6C52570BEB"""
+"""8369F089F42643F6_5FAE53550A4C7FB3_6005_UN""","""OC(=O)C1=C(N=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""213C5E6C52570BEB"""
+"""66637AA2E242AB27_DFA250424BF7AD24_6036_UN""","""CNC(C)(CN([S](CCN)(=O)=O)C1CC1)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""8D1226BDA1255BAC_44DB80C8E654A28A_6036_UN""","""CNC(C)(CN(C(C)C)[S](=O)(=O)CCN)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""E559EBE342691968_13546C7D081481D6_6036_UN""","""CNC(C)(CN([S](C)(=O)=O)CCN=C=S)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""C0E43999DC3A8313_0E426DC546BCF81E_6036_UN""","""CNC(C)(CN([S](CC)(=O)=O)CCCN)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""55166E0B5E5B580D_849DC828B068CD3F_6036_UN""","""CNC(C)(CN([S](C)(=O)=O)C1CC(C1)N)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""5143F93D1CC9E44F_C247C02F805D4FBE_6036_UN""","""CNC(C)(CN(CCCN)[S](=O)(=O)CCl)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""E5595715F45CFF24_37A64C6952CFDAFF_6036_UN""","""CNC(C)(CN(C)[S](=O)(=O)C1CNCC1)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""BD54E47E4AEA254D_89FE477EED207F3B_6036_UN""","""CNC(C)(CN([S](CC)(=O)=O)CCCBr)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""8833D15CBD8F97A4_3D24C67E482EFCB5_6036_UN""","""CNC(C)(CN(CCCNC)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""9664DE0A07B05A70_D849CE18C1E7E6ED_6036_UN""","""CNC(C)(CN(C(C)(C)C#N)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""9206FF0D96D8F7B3_8A02A4039DD83525_6036_UN""","""CNC(C)(CN([S](=O)(=O)CC#N)C1CC1)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""13CED4F697D7FC41_09D6CF75757E7732_6036_UN""","""CNC(C)(CN([S](C)(=O)=O)C(=O)CCN)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""FA75AD949C6F56DA_CFD098859120C3C1_6036_UN""","""CNC(C)(CN(C)[S](=O)(=O)C1=CC=CS1)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""B3A0297B65D751C0_6D76C51C816FD180_6036_UN""","""CNC(C)(CN(C(C)(C)C)[S](=O)(=O)CCl)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""1E712460339EADEA_A0119E555E21F1DF_6036_UN""","""CNC(C)(CN(C(C)(C)C)[S](=O)(=O)CBr)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""B820E7A5267630E0_546C31E29121A176_6036_UN""","""CNC(C)(CN(C(C)(C)C#C)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""F19860EDDF03E544_5E98D6E20D5A9970_6036_UN""","""CNC(C)(CN(CC(CC)N)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""CC0E78D91C1332AF_5CB683C30F51295B_6036_UN""","""CNC(C)(CN(C)[S](=O)(=O)C1=C[NH]C=N1)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""2BD915DDEFD9DC97_CF749C8FD5A9F2BF_6036_UN""","""CNC(C)(CN([S](C)(=O)=O)CCN=[N]#N)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""A0996288251C1F2E_1FC5AB29D3D4F69B_6036_UN""","""CNC(C)(CN(CC(C)(C)N)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""216A2EAD950CC03C"""
+"""20EC9BFBEB3329A0_55CACC98441A7116_6036_UN""","""CNC(C)(CN1[S](CC(C)(C)C1=O)(=O)=O)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""6FAE32290CA76E82_B9F752FA4E30D519_6036_UN""","""CNC(C)(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)C3=CC=CC=C3""",21,"""216A2EAD950CC03C"""
+"""188C0A4734A834F2_B01AE69EE565F8A3_6036_UN""","""CNC(C)(CN([S](=O)(=O)C1CC1)CC#C)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""117F5B3373E31D84_E41AFC15026B3D65_6036_UN""","""CNC(C)(CN1[S](=O)(=O)C2(CCC1)CC2)C3=CC=CC=C3""",21,"""216A2EAD950CC03C"""
+"""408B7870F62DD9E5_CC71B3E8276F718D_6036_UN""","""CNC(C)(CN1CCCC(C)(C)[S]1(=O)=O)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""C853D76248327136_075848BCAEA9BA9E_6036_UN""","""CNC(C)(CN1CCCC(CC)[S]1(=O)=O)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""F5FD0E613A4B8A28_36313866CB100C31_6036_UN""","""CNC(C)(CN1C(C(N)CC[S]1(=O)=O)=O)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""79E238870C2B2FD6_E92F5FC8B118351F_6036_UN""","""CNC(C)(CN([S](C)(=O)=O)[C@@H]1CNCC1)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""491C9E55FEE92EC7_421791516588A833_6036_UN""","""CNC(C)(CN1CCCC(Cl)(Cl)[S]1(=O)=O)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
+"""B36913936F35C755_027B210160B2718D_6036_UN""","""CNC(C)(CN([S](C)(=O)=O)[C@H]1CNCC1)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
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+"""DB232015C5422E35_26A39D58F3068506_6036_UN""","""CNC(C)(CN1CC(=O)NCC[S]1(=O)=O)C2=CC=CC=C2""",21,"""216A2EAD950CC03C"""
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+"""2E4B55518040F698_BA45F06976DA2A62_6036_UN""","""NCC(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)CC3=CN=CC=C3""",21,"""22D88C3EADE63F47"""
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+"""464D4957DDEFEBFE_04EAEA2F964345E5_6036_UN""","""NCC(CN1CCCC(CC)[S]1(=O)=O)CC2=CN=CC=C2""",21,"""22D88C3EADE63F47"""
+"""722AF7EE935A5EA9_35839AF5F3FAF34A_6036_UN""","""NCC(CN1C(C(N)CC[S]1(=O)=O)=O)CC2=CN=CC=C2""",21,"""22D88C3EADE63F47"""
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+"""8188F61FFCD986CB_A9861946A345919E_6036_UN""","""NCC(CN1[S](CCN(C)CC1)(=O)=O)CC2=CN=CC=C2""",21,"""22D88C3EADE63F47"""
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+"""C01703A93BE447F6_CCBDDDAA528E3E02_6036_UN""","""NCC(CN([S](CC)(=O)=O)C1CNC1)CC2=CN=CC=C2""",21,"""22D88C3EADE63F47"""
+"""8BDF24DF59B251D5_FE240996C5676A7F_6036_DP""","""NCC(CN2CC1(CNC1)C[S]2(=O)=O)CC3=CN=CC=C3""",21,"""22D88C3EADE63F47"""
+"""8B77BE69265B6272_445170041CA42E15_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=N[NH]C=N1)CC2=CN=CC=C2""",21,"""22D88C3EADE63F47"""
+"""F4234FEB6D824244_B8BAE85415C63EA5_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=C[NH]N=C1)CC2=CN=CC=C2""",21,"""22D88C3EADE63F47"""
+"""1C4727DF51803133_86DB8FE3D8F8F63E_6036_UN""","""NCC(CN(C(C)(C)CN)[S](=O)(=O)C)CC1=CN=CC=C1""",21,"""22D88C3EADE63F47"""
+"""B5186BEC6A908C82_25CE5AFE503CACED_6004_DP""","""C[N]1C(=NN=C1CCN)C2=CC(=CC=C2)OC3CCCC3""",21,"""243E0BAAA1A75531"""
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+"""C00BB83EDDA95C30_2A832D43A7EBC13F_6004_DP""","""C[N]1C(=NN=C1CCN)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""243E0BAAA1A75531"""
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+"""2A8436B6231FC4E2_A2506A34723203F6_6004_DP""","""C[N]1C(=NN=C1CCN)C2=CC(=CC=C2)CN3CCCC3""",21,"""243E0BAAA1A75531"""
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+"""7A9F1750075F511D_067AE592FB40FD90_6004_DP""","""C[N]1C(=NN=C1CCN)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""243E0BAAA1A75531"""
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+"""46F30CDCCC304CD0_2ECD1F74EB0253DC_6004_DP""","""C[N]1C(=NN=C1CCN)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""243E0BAAA1A75531"""
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+"""3ABA2F45A2CFB49F_F5A69463AAB47A08_6004_DP""","""C[N]1C(=NN=C1CCN)C2=CC=C(OCCC(C)C)C=C2""",21,"""243E0BAAA1A75531"""
+"""D561024D1B74F7CD_08CBF77554FEEA58_6004_DP""","""C[N]1C(=NN=C1CCN)C2=CC=C(C=C2)OC3CCCC3""",21,"""243E0BAAA1A75531"""
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+"""6BD463167C14A888_F4E262C06551F5C8_6004_DP""","""C[N]1C(=NN=C1CCN)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""243E0BAAA1A75531"""
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+"""E150CE5788528394_EE4DB6C018AD170D_6004_DP""","""C[N]1C(=NN=C1CCN)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""243E0BAAA1A75531"""
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+"""9C55871C8B39E40C_C87F7C111C73262E_6004_DP""","""C[N]1C(=NN=C1CCN)C2=C(C=CC=C2)CN3CCCC3""",21,"""243E0BAAA1A75531"""
+"""E0F62328EC16B846_50AB2C90A0C1C594_6004_DP""","""C[N]1C(=NN=C1CCN)C2=CC(=N[N]2C3CCCCO3)C""",21,"""243E0BAAA1A75531"""
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+"""A2238F88AA8851A2_246527A3B6E1B474_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""259576F7477A4DA8"""
+"""150B1BAC8429B5B5_8B12DF8F4DF11888_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""259576F7477A4DA8"""
+"""9EC0EE68DE701962_7712A848D21AEFA2_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""259576F7477A4DA8"""
+"""54EB4E47DFAA162B_2B28501E4136D9A6_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""259576F7477A4DA8"""
+"""53702D13D6DCDAEE_18003FDFC6582F0E_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""259576F7477A4DA8"""
+"""76395925FF958269_D3E1DBAB1E2FDBFD_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""259576F7477A4DA8"""
+"""C05EA8823E6CCF49_0B8EFFA74AEBCA75_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=CC(=C2)COCCOC""",21,"""259576F7477A4DA8"""
+"""867994A54C9F5BBD_82E372A64457C119_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""259576F7477A4DA8"""
+"""0C1F5734860B7E8A_9DF86645731D267C_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""259576F7477A4DA8"""
+"""D8F1E2040EDAE72D_CFB99E71F8A88650_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""259576F7477A4DA8"""
+"""B00A5CAF84C0D0D2_DA40784563D52712_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""259576F7477A4DA8"""
+"""2F9B39B8B123F680_A3FB176994EF1B6F_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""259576F7477A4DA8"""
+"""3F98139ED1F4A0FD_BADF336BFC83F4EF_6004_UN""","""NC(=S)C1=NC=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""259576F7477A4DA8"""
+"""F923FBEB34150FCE_C72B6C897B954586_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""259576F7477A4DA8"""
+"""474C247CCC690ED2_30F6A04BEAF7E6BD_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""259576F7477A4DA8"""
+"""3BDBE3CB6CF7502D_07D198CF1D9DE509_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""259576F7477A4DA8"""
+"""330E1BCBB3C78761_D51D664B3792CFBA_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""259576F7477A4DA8"""
+"""2169E7727BEBABCF_05C8A8C3C2C8FBA9_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""259576F7477A4DA8"""
+"""04956A4C16929E23_2A5D9C8CD1EF996C_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""259576F7477A4DA8"""
+"""2D1740E81EB1AA3F_2F6662290DDF4B45_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""259576F7477A4DA8"""
+"""AEEC1460ECEA8F58_EA9DC4DE6D5FD771_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""259576F7477A4DA8"""
+"""D005E9B777BDA6C4_FAB1548FB2B16385_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""259576F7477A4DA8"""
+"""5B38A810DDB406BF_27A20DB61C1297FF_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""259576F7477A4DA8"""
+"""784E0A336605C40B_B7D1E9CC85EF1D2A_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""259576F7477A4DA8"""
+"""977CB3A84D911C76_92F0597F65E0D3F1_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""259576F7477A4DA8"""
+"""FC26499692656A91_F40DE93E4C696291_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""259576F7477A4DA8"""
+"""AF82598513A29AFF_09608A28B223F2C1_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""259576F7477A4DA8"""
+"""6AE7748B5DB7FCB4_885653D605D89A15_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""259576F7477A4DA8"""
+"""862AF7487ECAD8AC_FD2931E47FF43EA2_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""259576F7477A4DA8"""
+"""68D20A4887E3A774_02CEF668A8F5C04F_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""259576F7477A4DA8"""
+"""CBCD4011602CAD92_F5491F9D838CED51_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""259576F7477A4DA8"""
+"""149B45403E854B9C_834231814BE0EA3A_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""259576F7477A4DA8"""
+"""C4BEB0C7D8897880_4672A0BBD2048345_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""259576F7477A4DA8"""
+"""092685BF671DFF21_2C16959D2D328825_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""259576F7477A4DA8"""
+"""83FA54822B564240_5D2D27E83C3906D6_6004_UN""","""NC(=S)C1=NC=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""259576F7477A4DA8"""
+"""9AB102979215ACA0_EFE6CB9DFE700F94_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""259576F7477A4DA8"""
+"""DD37A7C66149E83E_9A285915C4DC9FA6_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""259576F7477A4DA8"""
+"""CE3889966DAB82FA_C9D4014CFAAE3EB7_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""259576F7477A4DA8"""
+"""CF91C5E793819F8A_510051CD461CDD0D_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""259576F7477A4DA8"""
+"""FA2CA9798C2AD1FA_5B077BCE1F6139F0_6004_UN""","""NC(=S)C1=NC=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""259576F7477A4DA8"""
+"""11206352E00C50E6_DB1AD63DB97A95CB_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](CCN)(=O)=O)C2CC2""",21,"""25D2A8D26781F8D3"""
+"""6D1BA1B6188A01EC_406306B714D99A65_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C(C)C)[S](=O)(=O)CCN""",21,"""25D2A8D26781F8D3"""
+"""06DFE001693E9576_17ECEA02FA99B939_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](C)(=O)=O)CCN=C=S""",21,"""25D2A8D26781F8D3"""
+"""E3C4BCF70D6FE53F_0AFAEBBAB431C0F1_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](CC)(=O)=O)CCCN""",21,"""25D2A8D26781F8D3"""
+"""4719D88AFC9FBA01_80254E5742E5F5D0_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](C)(=O)=O)C2CC(C2)N""",21,"""25D2A8D26781F8D3"""
+"""75C4C98079D4B70D_C6FF465072D07751_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(CCCN)[S](=O)(=O)CCl""",21,"""25D2A8D26781F8D3"""
+"""4DD5B7829A83146B_331ECA16A042E210_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C)[S](=O)(=O)C2CNCC2""",21,"""25D2A8D26781F8D3"""
+"""4C147F7FFC1779A0_8D46C1011FAD47D4_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](CC)(=O)=O)CCCBr""",21,"""25D2A8D26781F8D3"""
+"""FF2219DF34C08A14_399C4001BAA3C45A_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(CCCNC)[S](=O)(=O)C""",21,"""25D2A8D26781F8D3"""
+"""6D6E4FFAC8B9B804_DCF14867336ADE02_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""25D2A8D26781F8D3"""
+"""AE6DE25C23BD86F9_8EBA227C6F550DCA_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](=O)(=O)CC#N)C2CC2""",21,"""25D2A8D26781F8D3"""
+"""A96ED7394487E211_0D6E490A87F34FDD_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""25D2A8D26781F8D3"""
+"""01B22BF1CBE79819_CB681EFA63ADFB2E_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""25D2A8D26781F8D3"""
+"""B746A542EFEA4A49_69CE436373E2E96F_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""25D2A8D26781F8D3"""
+"""3EBB50067DE050DE_A4A9182AACACC930_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""25D2A8D26781F8D3"""
+"""1B4CAA7947E670B9_50D4B79D63AC9999_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""25D2A8D26781F8D3"""
+"""0D721C1AB2A53669_5A20509DFFD7A19F_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""25D2A8D26781F8D3"""
+"""AE488BC43520AF7F_580E05BCFDDC11B4_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""25D2A8D26781F8D3"""
+"""4D04D9D8C3689796_CBCC1AF02724CA50_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""25D2A8D26781F8D3"""
+"""AF82AE8858438C00_1B7D2D562159CE74_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""25D2A8D26781F8D3"""
+"""3E5887129F8DC03B_51724AE7B69749F9_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""25D2A8D26781F8D3"""
+"""89BCED11989EA5FB_BD4FD485BCBDEDF6_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""25D2A8D26781F8D3"""
+"""6F4A2F4091F8568E_B4A260E117E8C04C_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](=O)(=O)C2CC2)CC#C""",21,"""25D2A8D26781F8D3"""
+"""F5561E7F376ACAB3_E0A27A6AF0E6058A_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""25D2A8D26781F8D3"""
+"""FF3C70ACE7DE7A86_C8C93597D5E24962_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N2CCCC(C)(C)[S]2(=O)=O""",21,"""25D2A8D26781F8D3"""
+"""FFD959D747A12E39_03E0CEC35C248271_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N2CCCC(CC)[S]2(=O)=O""",21,"""25D2A8D26781F8D3"""
+"""2C236303B1DF1D04_3289BE19399D34DE_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""25D2A8D26781F8D3"""
+"""2BEBFF532979EBB6_ED97D9B743950DF0_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""25D2A8D26781F8D3"""
+"""EF99719D93519A7B_46AF172E970590DC_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""25D2A8D26781F8D3"""
+"""868135195858C686_06C3A77E923F4962_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""25D2A8D26781F8D3"""
+"""0875FF83B60C2B83_AE8C3DAA6922560A_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N2[S](CCN(C)CC2)(=O)=O""",21,"""25D2A8D26781F8D3"""
+"""47AAE20A40092663_221B1B27018BBDE9_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N2CC(=O)NCC[S]2(=O)=O""",21,"""25D2A8D26781F8D3"""
+"""6C6B3268157B4C7C_77E0062EAC2E7A7D_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N2[S](CCCCC2C)(=O)=O""",21,"""25D2A8D26781F8D3"""
+"""47A6836DA8A56A7E_0D4843E202CE9583_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(CCN)[S](=O)(=O)C2CC2""",21,"""25D2A8D26781F8D3"""
+"""D600B82E2921A2F3_6BB26523A6E20774_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(CCN)[S](=O)(=O)C(F)F""",21,"""25D2A8D26781F8D3"""
+"""5704CCD11E8D13C4_CBB7F94698E9F996_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N([S](CC)(=O)=O)C2CNC2""",21,"""25D2A8D26781F8D3"""
+"""87D9D9893B67EFD2_F92E2D7A0F00ADEB_6036_DP""","""NCC(C1=CC(=C(C=C1)Cl)F)N3CC2(CNC2)C[S]3(=O)=O""",21,"""25D2A8D26781F8D3"""
+"""E707D7481602B338_435B54E8D6C3E981_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""25D2A8D26781F8D3"""
+"""D4AD8814FCA7709E_BFB0CCB8DFA1F931_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""25D2A8D26781F8D3"""
+"""49CA2DC8EBFA8FB5_81D1AB0F129F31AA_6036_UN""","""NCC(C1=CC(=C(C=C1)Cl)F)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""25D2A8D26781F8D3"""
+"""22522FBAF2DD86BA_275E1B2683FBE03A_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC(=CC=C2)OC3CCCC3""",21,"""26AE4A72726019E6"""
+"""E87B5017E85124EF_8829E30A78EB4CC6_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC(=C(OCC)C=C2)OCC""",21,"""26AE4A72726019E6"""
+"""B1EF8F46FFA98389_742994CDE700BBEC_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC=CC(=C2)OCCC(C)C""",21,"""26AE4A72726019E6"""
+"""E73D332E5909F084_28136C9B742C8DE8_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""26AE4A72726019E6"""
+"""AB69F944910F29C1_1B3B035AF3427B40_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC=C(C=C2)OC3CCOC3""",21,"""26AE4A72726019E6"""
+"""31933DCDC1C46472_D0DAE72E2B358FB3_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""26AE4A72726019E6"""
+"""B098C3783C2FB7F0_08B5C3227FF19E3B_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC=CC(=C2)COCCOC""",21,"""26AE4A72726019E6"""
+"""F9FC1518DCF74972_81D84E23714D9557_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""26AE4A72726019E6"""
+"""6D3B94EE51A279F7_9EC35AC046077232_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC=CC(=C2)OC(COC)C""",21,"""26AE4A72726019E6"""
+"""7833BEB892C67B84_CC82A2F4CDB2D21E_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""26AE4A72726019E6"""
+"""EFFFBD02D0B317EA_D97B44C056CF735C_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""26AE4A72726019E6"""
+"""9F79681DD35EA78F_A0C02BECA1F54F21_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC(=CC=C2)CN3CCCC3""",21,"""26AE4A72726019E6"""
+"""D316341B6D2537C1_B9E40FEEC999A0A1_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""26AE4A72726019E6"""
+"""9A1C1CFFD7758D0B_C410500C4E8F11C8_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC=CC(=C2)OCCN(C)C""",21,"""26AE4A72726019E6"""
+"""631F02DB06A9C2BE_33CD9CCEDFEDB2F3_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""26AE4A72726019E6"""
+"""D3B5EE6C24C9AB8B_04EAA44A2887B147_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""26AE4A72726019E6"""
+"""B5E57C293DFD079D_D6265ACE02889BF4_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""26AE4A72726019E6"""
+"""2C3A919AFE1BAE77_06F39446F7D2AFE7_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""26AE4A72726019E6"""
+"""99B938FA8FC297F1_BD7C24562D5D4749_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""26AE4A72726019E6"""
+"""893E8263E0336169_2966A009E4F5CD22_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""26AE4A72726019E6"""
+"""A4237FA5704C81DD_2C5D5EAC38C51F0B_6025_UN""","""C1(=NC(=CC(=O)N1)CCl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""26AE4A72726019E6"""
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+"""F30D6BE27EF4465F_D89D216BD68E06D9_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""27482FD9F2216C63"""
+"""BA780E0C639F3685_A1264E4721B43AA4_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=CC(=CC=C3)CN4CCCC4""",21,"""27482FD9F2216C63"""
+"""2A9C836277CFA558_B8026A4549D8D524_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""27482FD9F2216C63"""
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+"""543086220ECBA134_2880C5A264B4B8A7_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""27482FD9F2216C63"""
+"""2C06B1E57D9C42FD_2DBB3B07B8846A8E_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""27482FD9F2216C63"""
+"""384E6C764CAC9878_E8409DF0D804F6BA_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""27482FD9F2216C63"""
+"""87A84AA4C22D6CC2_F86C0DA107EA424E_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""27482FD9F2216C63"""
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+"""77D666AA4D0C9543_B50CB0E230B43CE1_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""27482FD9F2216C63"""
+"""5087FF85038592C1_902D0051D0BBF23A_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""27482FD9F2216C63"""
+"""9EF154238C1D53CB_F6D0B010F932435A_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=CC=C(OCCC(C)C)C=C3""",21,"""27482FD9F2216C63"""
+"""EBD4FF9CA0B7BFBE_0BBDD3060778D30A_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=CC=C(C=C3)OC4CCCC4""",21,"""27482FD9F2216C63"""
+"""65F4233440F15F17_8A8B0AF8B083BBDE_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""27482FD9F2216C63"""
+"""4DE48850158972B1_FFF468CACAAF1F69_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""27482FD9F2216C63"""
+"""C989192DE77A8A05_0013AF461DAEE184_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""27482FD9F2216C63"""
+"""3D37395CE1CE0661_F79446B336D7CC9A_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""27482FD9F2216C63"""
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+"""642EFE872274581E_44AFF995675FA28E_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""27482FD9F2216C63"""
+"""10943452C8EE9312_2ECBCCB39869A9EE_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""27482FD9F2216C63"""
+"""BBC173894B188E2C_5FF07EC68962271D_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""27482FD9F2216C63"""
+"""EB46D3EBF3F80EDD_ED3B92B34B2B2E5F_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""27482FD9F2216C63"""
+"""456004165F73676B_98F5003B7187BE6D_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""27482FD9F2216C63"""
+"""6D0E5E1B72691652_CB0958624FF51F7C_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(C=CC=C3)CN4CCCC4""",21,"""27482FD9F2216C63"""
+"""0C929798B4D06BF4_59DA22E0AA3A183B_6025_UN""","""C2(=NC1=C(C=CC=N1)O2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""27482FD9F2216C63"""
+"""A97964C410298FDF_263A10E73EC2F166_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=CC=C2)OC3CCCC3)Cl""",21,"""27CA41B3CF5908BA"""
+"""882E182B941E9CA3_894DE8CBC5D25D9A_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=C(OCC)C=C2)OCC)Cl""",21,"""27CA41B3CF5908BA"""
+"""70D0EE8B4579D364_754D9F0C5A39AAB0_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2)OCCC(C)C)Cl""",21,"""27CA41B3CF5908BA"""
+"""739AC4E9A02F0972_2977675AC9159CB4_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3)Cl""",21,"""27CA41B3CF5908BA"""
+"""925B3166C97308C3_1A5F089B4E7B6A1C_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=C(C=C2)OC3CCOC3)Cl""",21,"""27CA41B3CF5908BA"""
+"""275D79B1222822BE_D1BEECEF960C9EEF_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=C(OC)C=C2)CN(C)C)Cl""",21,"""27CA41B3CF5908BA"""
+"""AC851ACA065ACD73_09D1C8E3C2C88F67_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2)COCCOC)Cl""",21,"""27CA41B3CF5908BA"""
+"""C299663A46FF30ED_80BC45E2CC74840B_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2)CN(C)C3CC3)Cl""",21,"""27CA41B3CF5908BA"""
+"""1953301538363BA8_9FA75101FB3E636E_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2)OC(COC)C)Cl""",21,"""27CA41B3CF5908BA"""
+"""2FEC4C0E7930BB8D_CDE6A935708BC342_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F)Cl""",21,"""27CA41B3CF5908BA"""
+"""14C54E87E0BB692A_D81F4F01EBF66200_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F)Cl""",21,"""27CA41B3CF5908BA"""
+"""A55C4C815A6C0DDD_A1A4202D1CCC5E7D_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=CC=C2)CN3CCCC3)Cl""",21,"""27CA41B3CF5908BA"""
+"""AC58EA0B124897A2_B880042F74A0B1FD_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3)Cl""",21,"""27CA41B3CF5908BA"""
+"""745F845298E2CD36_C5745BCDF3B60094_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2)OCCN(C)C)Cl""",21,"""27CA41B3CF5908BA"""
+"""DF849EC443B0CE04_32A9970F62D4A3AF_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C)Cl""",21,"""27CA41B3CF5908BA"""
+"""A0EA15D2331275A6_058EAF8B95BEA01B_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3)Cl""",21,"""27CA41B3CF5908BA"""
+"""449F45FBCEA6C567_D742510FBFB18AA8_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(C=CC=C2F)OC(F)(F)F)Cl""",21,"""27CA41B3CF5908BA"""
+"""46F4A15AAC6120A1_07979F874AEBBEBB_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Cl""",21,"""27CA41B3CF5908BA"""
+"""AABB5B35073BFEE0_2802ABC859CCDC7E_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F)Cl""",21,"""27CA41B3CF5908BA"""
+"""3E81B8709653B930_2D39556D85FC0E57_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O)Cl""",21,"""27CA41B3CF5908BA"""
+"""E121C51466B82C32_E8C2F39AE57C9263_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F)Cl""",21,"""27CA41B3CF5908BA"""
+"""4643EEA274DBCC1A_F8EE63CB3A922697_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Cl""",21,"""27CA41B3CF5908BA"""
+"""E06ED3EB991FA9DD_25FD3AF29431D2ED_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3)Cl""",21,"""27CA41B3CF5908BA"""
+"""13100FB758C66532_B58EDE880DCC5838_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F)Cl""",21,"""27CA41B3CF5908BA"""
+"""B49EF164367979DE_90AF6E3BEDC396E3_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F)Cl""",21,"""27CA41B3CF5908BA"""
+"""CC6BEA79DF00E215_F652DE7AC44A2783_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=C(OCCC(C)C)C=C2)Cl""",21,"""27CA41B3CF5908BA"""
+"""1599B867A8E23C54_0B3FBD6C3A00B7D3_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=C(C=C2)OC3CCCC3)Cl""",21,"""27CA41B3CF5908BA"""
+"""801C6CF6E226FE54_8A0964928DFBDF07_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(C=C(OC)C=C2)CN(C)C)Cl""",21,"""27CA41B3CF5908BA"""
+"""872F13521A55551C_FF7606A0F7D77BB0_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC)Cl""",21,"""27CA41B3CF5908BA"""
+"""94EAA0C7505B32B3_0091C12C20D6855D_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(C)C=C(C=C2)OCC3CC3)Cl""",21,"""27CA41B3CF5908BA"""
+"""D8AA530F99E4D883_F71628D90BAFA843_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F)Cl""",21,"""27CA41B3CF5908BA"""
+"""C8A19D65304F1EA3_811D06C5C3C3AF28_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(OCC(C)(C)C)N=CC=C2)Cl""",21,"""27CA41B3CF5908BA"""
+"""021021A52D8CB2DB_442D97FF5A27C657_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3)Cl""",21,"""27CA41B3CF5908BA"""
+"""60F1D24EAB1D0543_2E49A2D9A511CD37_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O)Cl""",21,"""27CA41B3CF5908BA"""
+"""265C532A4D6A2C93_5F7210ACB41A43C4_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3)Cl""",21,"""27CA41B3CF5908BA"""
+"""74924038C0B1A6D7_EDB9FCD976534A86_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC)Cl""",21,"""27CA41B3CF5908BA"""
+"""A003CD218C7FEB98_98776E514CFFDAB4_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3)Cl""",21,"""27CA41B3CF5908BA"""
+"""5C2A77BCA64CCF72_CB8B3608728D7BA5_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(C=CC=C2)CN3CCCC3)Cl""",21,"""27CA41B3CF5908BA"""
+"""B34388EE1B23DF7C_535F6689CE3F981F_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=CC(=N[N]2C3CCCCO3)C)Cl""",21,"""27CA41B3CF5908BA"""
+"""E92160859D970761_59584C8A97427CE2_6005_UN""","""ClC1=NC(=C(C(=N1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F)Cl""",21,"""27CA41B3CF5908BA"""
+"""3DECD3598F7C4AB7_29F8FA32C2DDD198_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=CC=C2)OC3CCCC3""",21,"""2808AB6633462844"""
+"""9E80A6501BBA974C_868F021E39CD7D64_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=C(OCC)C=C2)OCC""",21,"""2808AB6633462844"""
+"""CF178202013D13F3_7A8F75D9A6268A4E_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=CC(=C2)OCCC(C)C""",21,"""2808AB6633462844"""
+"""A163D9448A5305F6_26B58D8F350ABC4A_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""2808AB6633462844"""
+"""84AA23FBB810D13D_159DE24EB2644AE2_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=C(C=C2)OC3CCOC3""",21,"""2808AB6633462844"""
+"""1EAA8A001E084919_DE7C063A6A13BE11_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""2808AB6633462844"""
+"""C11EA16456B652CF_061322363ED7AF99_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=CC(=C2)COCCOC""",21,"""2808AB6633462844"""
+"""B6076C32F77E2AE2_8F7EAF37306BA4F5_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""2808AB6633462844"""
+"""5FAC5F19D7AFC533_9065BBD407214390_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=CC(=C2)OC(COC)C""",21,"""2808AB6633462844"""
+"""274115F5174FA13C_C22443E08C94E3BC_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""2808AB6633462844"""
+"""4F17DE1AB5B60032_D7DDA5D417E942FE_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""2808AB6633462844"""
+"""2641205253108CE1_AE66CAF8E0D37E83_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=CC=C2)CN3CCCC3""",21,"""2808AB6633462844"""
+"""5321D7879379A8B8_B742EEFA88BF9103_6005_UN""","""FC(F)(F)C1=CSC(=N1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""2808AB6633462844"""
+"""CFBEE06369E01009_CAB6B1180FA9206A_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=CC(=C2)OCCN(C)C""",21,"""2808AB6633462844"""
+"""61D390D23BFF81A8_3D6B7DDA9ECB8351_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""2808AB6633462844"""
+"""767574A64CED4C80_0A4C455E69A180E5_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""2808AB6633462844"""
+"""BF72257C27716AAF_D880BBDA43AEAA56_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""2808AB6633462844"""
+"""C551089931B9A032_08557552B6F49E45_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""2808AB6633462844"""
+"""D293B7D8F7392B19_27C0411DA5D3FC80_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""2808AB6633462844"""
+"""6DDB946D9E7D530E_22FBBFB879E32EA9_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""2808AB6633462844"""
+"""888EB282D0E3B73A_E700194F1963B29D_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""2808AB6633462844"""
+"""7EA1FBD8A02BD625_F72C891EC68D0669_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""2808AB6633462844"""
+"""EDA4937B2D616AF1_2A3FD027682EF213_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""2808AB6633462844"""
+"""397022E071365217_BA4C345DF1D378C6_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""2808AB6633462844"""
+"""E6EC802805A85933_9F6D84EE11DCB61D_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""2808AB6633462844"""
+"""9D0DB0A4F46C2A90_F99034AF3855077D_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=C(OCCC(C)C)C=C2""",21,"""2808AB6633462844"""
+"""CEFE162CBB4F2DB7_04FD57B9C61F972D_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=C(C=C2)OC3CCCC3""",21,"""2808AB6633462844"""
+"""ABC368A7FF8B2BA3_85CB8E4771E4FFF9_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""2808AB6633462844"""
+"""248FEC7A5C3FEF02_F0B4EC750BC85B4E_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""2808AB6633462844"""
+"""3989FD945E637901_0F532BF9DCC9A5A3_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""2808AB6633462844"""
+"""00E255A6E22CFF0A_F8D4C20CF7B088BD_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""2808AB6633462844"""
+"""94DD6500A0132A5F_8EDFEC103FDC8FD6_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""2808AB6633462844"""
+"""E763105E98783083_4BEF7D2AA638E6A9_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""2808AB6633462844"""
+"""BAA4C38514BF75A0_218B480C590EEDC9_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""2808AB6633462844"""
+"""BFBEE4BA83CEF4B6_50B0FA794805633A_6005_UN""","""FC(F)(F)C1=CSC(=N1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""2808AB6633462844"""
+"""8ECAA11128AD783F_E27B160C8A4C6A78_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""2808AB6633462844"""
+"""895A585BCFA21000_97B58484B0E0FA4A_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""2808AB6633462844"""
+"""94F2E8A52281E5E6_C449DCDD8E925B5B_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(C=CC=C2)CN3CCCC3""",21,"""2808AB6633462844"""
+"""F2180C8655B29087_5C9D8C5C3220B8E1_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""2808AB6633462844"""
+"""ADBE68F169265B6B_569AA65F6B5D5C1C_6005_UN""","""FC(F)(F)C1=CSC(=N1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""2808AB6633462844"""
+"""B9793DC6691A72A0_28EEFCAB285CBEB6_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=CC=C2)OC3CCCC3""",21,"""291EADFFD9C7476A"""
+"""40FCA0A3B8BC03E1_87990487D34C124A_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=C(OCC)C=C2)OCC""",21,"""291EADFFD9C7476A"""
+"""E29CAB688BE2B13A_7B9973404CA7E560_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=CC(=C2)OCCC(C)C""",21,"""291EADFFD9C7476A"""
+"""D17CBFB0E502FAA3_27A38B16DF8BD364_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""291EADFFD9C7476A"""
+"""55C4C1238B3CF8DA_148BE4D758E525CC_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=C(C=C2)OC3CCOC3""",21,"""291EADFFD9C7476A"""
+"""CBCB22E28D8A3F01_DF6A00A38092D13F_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""291EADFFD9C7476A"""
+"""DEA934A803266600_070524AFD456C0B7_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=CC(=C2)COCCOC""",21,"""291EADFFD9C7476A"""
+"""FA50D46E7D7A829C_8E68A9AEDAEACBDB_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""291EADFFD9C7476A"""
+"""FFC8C2D0FF236BE1_9173BD4DEDA02CBE_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=CC(=C2)OC(COC)C""",21,"""291EADFFD9C7476A"""
+"""240639A4CFAECAFE_C332457966158C92_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""291EADFFD9C7476A"""
+"""73A243608377FCEA_D6CBA34DFD682DD0_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""291EADFFD9C7476A"""
+"""20E5F8066FB76E8E_AF70CC610A5211AD_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=CC=C2)CN3CCCC3""",21,"""291EADFFD9C7476A"""
+"""079ECE6F69AB473B_B654E863623EFE2D_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""291EADFFD9C7476A"""
+"""5CF78D997D303817_CBA0B781E5284F44_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=CC(=C2)OCCN(C)C""",21,"""291EADFFD9C7476A"""
+"""7121719264B46A49_3C7D7B43744AEC7F_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""291EADFFD9C7476A"""
+"""7E1974897B47E998_0B5A43C78320EFCB_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""291EADFFD9C7476A"""
+"""A3D7594E0C1DD762_D996BD43A92FC578_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""291EADFFD9C7476A"""
+"""316510D51BCC8559_094373CB5C75F16B_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""291EADFFD9C7476A"""
+"""80D00C37E8A47CA5_B2CCC3DB86FA19C5_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""291EADFFD9C7476A"""
+"""FDF944B179613A8C_26D647844F5293AE_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""291EADFFD9C7476A"""
+"""9AA0EACA573ABDE8_23EDB92193624187_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""291EADFFD9C7476A"""
+"""4F8486A20F2B60D7_E6161FD6F3E2DDB3_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""291EADFFD9C7476A"""
+"""DF11692EF75414F4_F63A8F872C0C6947_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""291EADFFD9C7476A"""
+"""3AB17F02C146B6E7_2B29D6BE82AF9D3D_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""291EADFFD9C7476A"""
+"""E35E5F1DF1392FF7_BB5A32C41B5217E8_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""291EADFFD9C7476A"""
+"""847E6743E532C9AE_9E7B8277FB5DD933_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""291EADFFD9C7476A"""
+"""059088610363F016_F8863236D2D46853_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=C(OCCC(C)C)C=C2""",21,"""291EADFFD9C7476A"""
+"""E73704E3E97A1221_05EB51202C9EF803_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=C(C=C2)OC3CCCC3""",21,"""291EADFFD9C7476A"""
+"""037A07AA396EF7DA_84DD88DE9B6590D7_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""291EADFFD9C7476A"""
+"""1FF1DE63AADD2F68_F1A2EAECE1493460_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""291EADFFD9C7476A"""
+"""F1A651B63D4B34B4_0E452D603648CA8D_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""291EADFFD9C7476A"""
+"""DCF9FF9A55690813_F9C2C4951D31E793_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""291EADFFD9C7476A"""
+"""B06E8DD2223599B9_8FC9EA89D55DE0F8_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""291EADFFD9C7476A"""
+"""F5F9A55D9776DA8A_4AF97BB34CB98987_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""291EADFFD9C7476A"""
+"""D73C23A2968A2489_209D4E95B38F82E7_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""291EADFFD9C7476A"""
+"""0900145169A88114_51A6FCE0A2840C14_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""291EADFFD9C7476A"""
+"""AF139A80A780B00D_E36D109560CD0556_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""291EADFFD9C7476A"""
+"""92D7A0E858E89134_96A3821D5A619564_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""291EADFFD9C7476A"""
+"""0EAF1AEA43CB0A3E_C55FDA4464133475_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(C=CC=C2)CN3CCCC3""",21,"""291EADFFD9C7476A"""
+"""0E270C42CA65DB9F_578CA0C681DC3332_6025_UN""","""C1(=CC(=C(O1)C(=O)O)C)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""291EADFFD9C7476A"""
+"""8723CFC2547CFDD0_28342A4AA7BA8495_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)OC3CCCC3)Br""",21,"""29C47B1E56217D49"""
+"""7390A1AF8522A6C1_8743D2665CAA2869_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=C(OCC)C=C2)OCC)Br""",21,"""29C47B1E56217D49"""
+"""CA4FDA6DD6180DA9_7B43A5A1C341DF43_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)OCCC(C)C)Br""",21,"""29C47B1E56217D49"""
+"""0F7787AB1F984136_27795DF7506DE947_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)C[N]3C=CN=C3)Br""",21,"""29C47B1E56217D49"""
+"""20400BDD8DF82B5E_14513236D7031FEF_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)OC3CCOC3)Br""",21,"""29C47B1E56217D49"""
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+"""841A51586324C9D0_8EB27F4F550CF1F8_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)CN(C)C3CC3)Br""",21,"""29C47B1E56217D49"""
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+"""DB900C91651DFC32_C3E89398E9F3B6B1_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=C(C(NOC)=O)C=C2)F)Br""",21,"""29C47B1E56217D49"""
+"""9C2C49281DD2D50C_D61175AC728E17F3_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(OC)N=C(C=C2)C(F)(F)F)Br""",21,"""29C47B1E56217D49"""
+"""37164B3A26051407_AFAA1A8085B42B8E_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)CN3CCCC3)Br""",21,"""29C47B1E56217D49"""
+"""E373BBFAD14CEF97_B68E3E82EDD8C40E_6005_UN""","""OC1=C(C=C(C(=C1)F)C3=CC=C([N]2C=C(C)C=N2)C=C3)Br""",21,"""29C47B1E56217D49"""
+"""076836359B38CA88_CB7A61606ACE7567_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)OCCN(C)C)Br""",21,"""29C47B1E56217D49"""
+"""61D94D6F3F879958_3CA7ADA2FBACD65C_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(C=C(C(C)C)C=C2)C(C)C)Br""",21,"""29C47B1E56217D49"""
+"""ED72E3DBC1C46F92_0B8095260CC6D5E8_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)C3=CC=CC=C3)Br""",21,"""29C47B1E56217D49"""
+"""78B1B8E72049AEB6_D94C6BA226C9FF5B_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(C=CC=C2F)OC(F)(F)F)Br""",21,"""29C47B1E56217D49"""
+"""C474CDE3A1D8748B_0999A52AD393CB48_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Br""",21,"""29C47B1E56217D49"""
+"""F5DF47FFF56CDE0F_260C9165C0B4A98D_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(C=C(OC)C=C2)C(F)(F)F)Br""",21,"""29C47B1E56217D49"""
+"""F74FDEE8739F06E9_23376FC01C847BA4_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC=CC(=C2F)C(N(C)C)=O)Br""",21,"""29C47B1E56217D49"""
+"""C78EBA7C8C5C33E1_E6CCC9377C04E790_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=C(OC)C=C2)C(F)(F)F)Br""",21,"""29C47B1E56217D49"""
+"""335175A84129BBBA_F6E05966A3EA5364_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Br""",21,"""29C47B1E56217D49"""
+"""A7A1DA2580E8E8E3_2BF3005F0D49A71E_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)C3=CC=CC=C3)Br""",21,"""29C47B1E56217D49"""
+"""B2678D3B522C81BA_BB80E42594B42DCB_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(OC)C=C(C=C2)C(F)(F)F)Br""",21,"""29C47B1E56217D49"""
+"""707D07E176DD8631_9EA1549674BBE310_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(C)C=C(C=C2)OC(F)(F)F)Br""",21,"""29C47B1E56217D49"""
+"""CDB14908588524DE_F85CE4D75D325270_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC=C(OCCC(C)C)C=C2)Br""",21,"""29C47B1E56217D49"""
+"""25AAEE2D1FED9218_053187C1A378C220_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)OC3CCCC3)Br""",21,"""29C47B1E56217D49"""
+"""957A3423558D6D58_84075E3F1483AAF4_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(C=C(OC)C=C2)CN(C)C)Br""",21,"""29C47B1E56217D49"""
+"""353F593747B50A7E_F1783C0D6EAF0E43_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=C(N=C2)C(F)(F)F)OC)Br""",21,"""29C47B1E56217D49"""
+"""981EA53A53A3A00B_0E9FFB81B9AEF0AE_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(C)C=C(C=C2)OCC3CC3)Br""",21,"""29C47B1E56217D49"""
+"""57FEF2E8A91D7F08_F918127492D7DDB0_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(C=CC(=C2)C3(CC3)C#N)F)Br""",21,"""29C47B1E56217D49"""
+"""51D9F50E26244BB1_8F133C685ABBDADB_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(OCC(C)(C)C)N=CC=C2)Br""",21,"""29C47B1E56217D49"""
+"""F324DD1B54CCD877_4A23AD52C35FB3A4_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)C[N]3C=NC=N3)Br""",21,"""29C47B1E56217D49"""
+"""B8A79AB2C4DA93B6_204798743C69B8C4_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(OCC)C=CC(=C2)[N](=O)=O)Br""",21,"""29C47B1E56217D49"""
+"""2E6288037154D5E2_517C2A012D623637_6005_UN""","""OC1=C(C=C(C(=C1)F)C3=CC2=C(C=C(OC)C=C2)C=C3)Br""",21,"""29C47B1E56217D49"""
+"""60F92F18983C0CAC_E3B7C674EF2B3F75_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=C(C=C2C3CC3)Cl)OC)Br""",21,"""29C47B1E56217D49"""
+"""E46F9BAEEC8067BF_967954FCD587AF47_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)C3=CC=NC=C3)Br""",21,"""29C47B1E56217D49"""
+"""2FBB67B457D00707_C5850CA5EBF50E56_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(C=CC=C2)CN3CCCC3)Br""",21,"""29C47B1E56217D49"""
+"""CCCF6596A0564C9E_5D515C245747EDEC_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=CC(=N[N]2C3CCCCO3)C)Br""",21,"""29C47B1E56217D49"""
+"""74FCBDD7BE8B1CA8_575676270E3A0911_6005_UN""","""OC1=C(C=C(C(=C1)F)C2=C(C=C(C=C2)OC(F)(F)F)F)Br""",21,"""29C47B1E56217D49"""
+"""3EB5680CC3FAD394_2BD1643A1E1755C6_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""2A21356EEF8CAC1A"""
+"""012558BD53CB5C7B_84A69C16E507F93A_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""2A21356EEF8CAC1A"""
+"""84BFBCCEB8A7234F_78A6EBD17AEC0E10_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""2A21356EEF8CAC1A"""
+"""2219230D50CC1DCD_249C1387E9C03814_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""2A21356EEF8CAC1A"""
+"""7EFBA7BDE3B67C6D_17B47C466EAECEBC_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""2A21356EEF8CAC1A"""
+"""31D32C4A7B018327_DC559832B6D93A4F_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""2A21356EEF8CAC1A"""
+"""EFF2D1757A14AA2E_043ABC3EE21D2BC7_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=CC(=C2)COCCOC)N""",21,"""2A21356EEF8CAC1A"""
+"""DE0A18A468993108_8D57313FECA120AB_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""2A21356EEF8CAC1A"""
+"""D7423B5D383773DC_924C25DCDBEBC7CE_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=CC(=C2)OC(COC)C)N""",21,"""2A21356EEF8CAC1A"""
+"""F77F7CCEF13507B9_C00DDDE8505E67E2_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""2A21356EEF8CAC1A"""
+"""383AF6E307CB3E8F_D5F43BDCCB23C6A0_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""2A21356EEF8CAC1A"""
+"""04E0F8CEDD01D425_AC4F54F03C19FADD_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""2A21356EEF8CAC1A"""
+"""EAC5208358B6E437_B56B70F25475155D_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""2A21356EEF8CAC1A"""
+"""A79C68A34CCDB4FA_C89F2F10D363A434_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""2A21356EEF8CAC1A"""
+"""A440B4F7761B5696_3F42E3D24201070F_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""2A21356EEF8CAC1A"""
+"""E6293C2E3F2FBC70_0865DB56B56B04BB_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""2A21356EEF8CAC1A"""
+"""3CB1BCA607CA0BE5_DAA925D29F642E08_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""2A21356EEF8CAC1A"""
+"""DAAD441017CF9F7D_0A7CEB5A6A3E1A1B_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""2A21356EEF8CAC1A"""
+"""BBD14A2CF8E86627_25E9DF15791978DE_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""2A21356EEF8CAC1A"""
+"""9C72FFCCEB5E4DC1_20D221B0A529AAF7_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""2A21356EEF8CAC1A"""
+"""E76750DB71A984D6_E5298747C5A936C3_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""2A21356EEF8CAC1A"""
+"""AE64F5363062D149_F50517161A478237_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""2A21356EEF8CAC1A"""
+"""6A2722A5000A399E_28164E2FB4E4764D_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""2A21356EEF8CAC1A"""
+"""A6AC0BDB0D5CA0D6_B865AA552D19FC98_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""2A21356EEF8CAC1A"""
+"""5AD2B93E0A97A246_9D441AE6CD163243_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""2A21356EEF8CAC1A"""
+"""966FE476913064A2_FBB9AAA7E49F8323_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=C(OCCC(C)C)C=C2)N""",21,"""2A21356EEF8CAC1A"""
+"""28918354A6079384_06D4C9B11AD51373_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=C(C=C2)OC3CCCC3)N""",21,"""2A21356EEF8CAC1A"""
+"""C47AAE062E59B912_87E2104FAD2E7BA7_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(C=C(OC)C=C2)CN(C)C)N""",21,"""2A21356EEF8CAC1A"""
+"""61B0D6ACA269DC72_F29D727DD702DF10_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC)N""",21,"""2A21356EEF8CAC1A"""
+"""16065C205EB75D29_0D7AB5F1000321FD_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(C)C=C(C=C2)OCC3CC3)N""",21,"""2A21356EEF8CAC1A"""
+"""01AAB63163D8F8D4_FAFD5C042B7A0CE3_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F)N""",21,"""2A21356EEF8CAC1A"""
+"""6D243A7BE91572DA_8CF67218E3160B88_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(OCC(C)(C)C)N=CC=C2)N""",21,"""2A21356EEF8CAC1A"""
+"""D693CC25475A7BEA_49C6E3227AF262F7_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3)N""",21,"""2A21356EEF8CAC1A"""
+"""DDF9112B0D866855_23A2D60485C46997_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O)N""",21,"""2A21356EEF8CAC1A"""
+"""A2C588700494EFB5_5299647194CFE764_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3)N""",21,"""2A21356EEF8CAC1A"""
+"""BA0E55B0320C931D_E05288045686EE26_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC)N""",21,"""2A21356EEF8CAC1A"""
+"""818CF2421D9A3F40_959C1A8C6C2A7E14_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3)N""",21,"""2A21356EEF8CAC1A"""
+"""53A65789FE3CEEBC_C66042D55258DF05_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(C=CC=C2)CN3CCCC3)N""",21,"""2A21356EEF8CAC1A"""
+"""C8363E9120162D63_5EB41254EEEA3CBF_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=CC(=N[N]2C3CCCCO3)C)N""",21,"""2A21356EEF8CAC1A"""
+"""33FE8B8C7B6D6A33_54B33857B797D842_6004_UN""","""CC1=C(C=C(C(=N1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F)N""",21,"""2A21356EEF8CAC1A"""
+"""26988501029E72A3_D46B80AF8DD19C9D_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN([S](CCN)(=O)=O)C2CC2""",21,"""2AA3FE40532AF185"""
+"""94C5BC316813CEE7_4F12502520729333_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN(C(C)C)[S](=O)(=O)CCN""",21,"""2AA3FE40532AF185"""
+"""4CB2A62858E913C5_189DBC90CE32B06F_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN([S](C)(=O)=O)CCN=C=S""",21,"""2AA3FE40532AF185"""
+"""1B50B607CEC23B6F_058BBD28809AC9A7_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN([S](CC)(=O)=O)CCCN""",21,"""2AA3FE40532AF185"""
+"""D5F149CE0794EB8D_8F5418C5764EFC86_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN([S](C)(=O)=O)C2CC(C2)N""",21,"""2AA3FE40532AF185"""
+"""7948ABC64C053364_C98E10C2467B7E07_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN(CCCN)[S](=O)(=O)CCl""",21,"""2AA3FE40532AF185"""
+"""00CADA6BB85BF2C9_3C6F9C8494E9EB46_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN(C)[S](=O)(=O)C2CNCC2""",21,"""2AA3FE40532AF185"""
+"""434862A46C0FA300_823797932B064E82_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN([S](CC)(=O)=O)CCCBr""",21,"""2AA3FE40532AF185"""
+"""B18123F143F87B28_36ED16938E08CD0C_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN(CCCNC)[S](=O)(=O)C""",21,"""2AA3FE40532AF185"""
+"""8872E5921D9EFD57_D3801EF507C1D754_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""2AA3FE40532AF185"""
+"""9B9DD8A82169B554_81CB74EE5BFE049C_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN([S](=O)(=O)CC#N)C2CC2""",21,"""2AA3FE40532AF185"""
+"""D32955417BFE2DDE_021F1F98B358468B_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN([S](C)(=O)=O)C(=O)CCN""",21,"""2AA3FE40532AF185"""
+"""919E2B04D1715E68_C41948685706F278_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN(C)[S](=O)(=O)C2=CC=CS2""",21,"""2AA3FE40532AF185"""
+"""99532A9A9202C925_66BF15F14749E039_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""2AA3FE40532AF185"""
+"""935479126DC3698B_ABD84EB89807C066_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""2AA3FE40532AF185"""
+"""94207C4D6CAE53AD_5FA5E10F570790CF_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""2AA3FE40532AF185"""
+"""FE527C042E7D6507_5551060FCB7CA8C9_6036_UN""","""CC1=CC(=CC(=C1)N)OCCN(CC(CC)N)[S](=O)(=O)C""",21,"""2AA3FE40532AF185"""
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+"""EFFC79F0CA4C15A2_F2731D0D73A03769_6004_DP""","""NCC1=C(C=CC(=N1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""2ACF5A1E4B2E4463"""
+"""A382A811EF8A83CE_0D94DA81A4A1C984_6004_DP""","""NCC1=C(C=CC(=N1)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""2ACF5A1E4B2E4463"""
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+"""2727D56E60FF6C84_DB04E5BD6DB2CB89_6004_UN""","""C[N]1C(=C(C(=N1)CN)C2=CC(=C(OC)C=C2)CN(C)C)Cl""",21,"""2D7048E134E75DDC"""
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+"""40B1D19C8FEC35E6_B23A0D7D8F1EE49B_6004_UN""","""C[N]1C(=C(C(=N1)CN)C3=CC=C([N]2C=C(C)C=N2)C=C3)Cl""",21,"""2D7048E134E75DDC"""
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+"""6A436429CC270915_27835C3F7E425B31_6004_UN""","""C[N]1C(=C(C(=N1)CN)C2=CC=CC(=C2F)C(N(C)C)=O)Cl""",21,"""2D7048E134E75DDC"""
+"""94AFDC0CA8BCD0B9_E278FAC81EC2C705_6004_UN""","""C[N]1C(=C(C(=N1)CN)C2=CC(=C(OC)C=C2)C(F)(F)F)Cl""",21,"""2D7048E134E75DDC"""
+"""DA1E109809E11D89_F2546A99C12C73F1_6004_UN""","""C[N]1C(=C(C(=N1)CN)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Cl""",21,"""2D7048E134E75DDC"""
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+"""0187E3E41C88C4D7_BF34D7DAF6720D5E_6004_UN""","""C[N]1C(=C(C(=N1)CN)C2=C(OC)C=C(C=C2)C(F)(F)F)Cl""",21,"""2D7048E134E75DDC"""
+"""06C86DB4D8205420_9A156769167DC385_6004_UN""","""C[N]1C(=C(C(=N1)CN)C2=C(C)C=C(C=C2)OC(F)(F)F)Cl""",21,"""2D7048E134E75DDC"""
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+"""CD893C2500CB448E_0185B43EC1BEE2B5_6004_UN""","""C[N]1C(=C(C(=N1)CN)C2=CC=C(C=C2)OC3CCCC3)Cl""",21,"""2D7048E134E75DDC"""
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+"""A3232F158C9E99C7_F5CC0FF20C692ED6_6004_UN""","""C[N]1C(=C(C(=N1)CN)C2=CC(=C(N=C2)C(F)(F)F)OC)Cl""",21,"""2D7048E134E75DDC"""
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+"""00510A2DC548A34A_ACF3FD87FCEB827E_6036_UN""","""NC(CCN(C(C)(C)C)[S](=O)(=O)CBr)C1=C(C=CC=C1)Br""",21,"""2D884D7F37C6B39D"""
+"""D0A98A1417E7E8C8_588E523033EBD2D7_6036_UN""","""NC(CCN(C(C)(C)C#C)[S](=O)(=O)C)C1=C(C=CC=C1)Br""",21,"""2D884D7F37C6B39D"""
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+"""497B771905C190E9_5054E011AD9B5AFA_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1=C[NH]C=N1)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""0CC7D76449EB88FE_C396FF5D7763811E_6036_UN""","""NC(CCN([S](C)(=O)=O)CCN=[N]#N)C1=C(C=CC=C1)Br""",21,"""2D884D7F37C6B39D"""
+"""96C4DA8D71D57567_1327C8FB711E853A_6036_UN""","""NC(CCN(CC(C)(C)N)[S](=O)(=O)C)C1=C(C=CC=C1)Br""",21,"""2D884D7F37C6B39D"""
+"""F9B40D44469C34A2_5928AF4AE6D002B7_6036_UN""","""NC(CCN1[S](CC(C)(C)C1=O)(=O)=O)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""4A3047D40F1F70AB_B5153128ECFAA6B8_6036_UN""","""NC(CCN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)C3=C(C=CC=C3)Br""",21,"""2D884D7F37C6B39D"""
+"""E8DCAF3386DB0503_BCF8854C47AF8B02_6036_UN""","""NC(CCN([S](=O)(=O)C1CC1)CC#C)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""F2D0ED00D93CF80D_E8F89FC7A0A14EC4_6036_UN""","""NC(CCN1[S](=O)(=O)C2(CCC1)CC2)C3=C(C=CC=C3)Br""",21,"""2D884D7F37C6B39D"""
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+"""38C3EB982253F7DF_0BBA2B6E0C63C93F_6036_UN""","""NC(CCN1CCCC(CC)[S]1(=O)=O)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
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+"""564461271B66A9E7_4EF5F283C742DB92_6036_UN""","""NC(CCN1CCCC(Cl)(Cl)[S]1(=O)=O)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""07DD143CC8E7CA29_0E9942D3C278022C_6036_UN""","""NC(CCN([S](C)(=O)=O)[C@H]1CNCC1)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""6A3E8D5136003098_A6D6D80739651D44_6036_UN""","""NC(CCN1[S](CCN(C)CC1)(=O)=O)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""E7C1A92054B7F1B7_2A41FE8A51CCF6A7_6036_UN""","""NC(CCN1CC(=O)NCC[S]1(=O)=O)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""62408A2C4EE49791_7FBAE383FC693133_6036_UN""","""NC(CCN1[S](CCCCC1C)(=O)=O)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""E66023FC7FF08796_0512A64F5289DECD_6036_UN""","""NC(CCN(CCN)[S](=O)(=O)C1CC1)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""D386DF59ACA3B728_63E8808EF6A54C3A_6036_UN""","""NC(CCN(CCN)[S](=O)(=O)C(F)F)C1=C(C=CC=C1)Br""",21,"""2D884D7F37C6B39D"""
+"""FBD0952DF6AEFC30_C3ED1CEBC8AEB2D8_6036_UN""","""NC(CCN([S](CC)(=O)=O)C1CNC1)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""38CEEDD07205A05B_F174C8D75F47E6A5_6036_DP""","""NC(CCN2CC1(CNC1)C[S]2(=O)=O)C3=C(C=CC=C3)Br""",21,"""2D884D7F37C6B39D"""
+"""E317BE142F331F3A_4B01B1458684A2CF_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1=N[NH]C=N1)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""9A4509C4954E08DF_B7EA29158FE6B27F_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1=C[NH]N=C1)C2=C(C=CC=C2)Br""",21,"""2D884D7F37C6B39D"""
+"""A227C072D0236C32_898B4EA242D87AE4_6036_UN""","""NC(CCN(C(C)(C)CN)[S](=O)(=O)C)C1=C(C=CC=C1)Br""",21,"""2D884D7F37C6B39D"""
+"""2292124A9846EFBE_2C2A3194594478CD_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=CC=C2)OC3CCCC3""",21,"""2DDA60C0A8DF8111"""
+"""32F3EA09A68A782E_835DC9B8A254D431_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=C(OCC)C=C2)OCC""",21,"""2DDA60C0A8DF8111"""
+"""96BC8734AD488F64_7F5DBE7F3DBF231B_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC=CC(=C2)OCCC(C)C""",21,"""2DDA60C0A8DF8111"""
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+"""65477539F413E616_03C1E990A54E06CC_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC=CC(=C2)COCCOC""",21,"""2DDA60C0A8DF8111"""
+"""908248F6878031F3_8AAC6491ABF20DA0_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""2DDA60C0A8DF8111"""
+"""3A350C47EA0E403D_95B770729CB8EAC5_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC=CC(=C2)OC(COC)C""",21,"""2DDA60C0A8DF8111"""
+"""6F4C34FCA32C485E_C7F68846170D4AE9_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""2DDA60C0A8DF8111"""
+"""5A0F4F4C399C7559_D20F6E728C70EBAB_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""2DDA60C0A8DF8111"""
+"""36E90BCCBC08CE4F_ABB4015E7B4AD7D6_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=CC=C2)CN3CCCC3""",21,"""2DDA60C0A8DF8111"""
+"""D7D4D919F29D6E0E_B290255C13263856_6004_UN""","""NC(=NO)C1=CC=C(S1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""2DDA60C0A8DF8111"""
+"""9DD08CFA39D45744_CF647ABE9430893F_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC=CC(=C2)OCCN(C)C""",21,"""2DDA60C0A8DF8111"""
+"""25E9CB1615CD8D47_38B9B67C05522A04_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""2DDA60C0A8DF8111"""
+"""B6007B28D0CFA1B5_0F9E8EF8F23829B0_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""2DDA60C0A8DF8111"""
+"""6BBB27E10A1A09FC_DD52707CD8370303_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""2DDA60C0A8DF8111"""
+"""ADC7487F02ACEA56_0D87BEF42D6D3710_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""2DDA60C0A8DF8111"""
+"""EAC40F1E2AE5E1F8_22128ABB3E4A55D5_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""2DDA60C0A8DF8111"""
+"""37BABA64F7D96E51_2729741EE27A87FC_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""2DDA60C0A8DF8111"""
+"""3132EB568AD7665C_E2D2D2E982FA1BC8_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""2DDA60C0A8DF8111"""
+"""8AF72E0099281239_F2FE42B85D14AF3C_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""2DDA60C0A8DF8111"""
+"""DEC1DD33FFEFFDE8_2FED1B81F3B75B46_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""2DDA60C0A8DF8111"""
+"""1A6B60EC54873BDA_BF9EFFFB6A4AD193_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""2DDA60C0A8DF8111"""
+"""93931C666FEF47A7_9ABF4F488A451F48_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""2DDA60C0A8DF8111"""
+"""7CE1EA1614B2A882_FC42FF09A3CCAE28_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC=C(OCCC(C)C)C=C2""",21,"""2DDA60C0A8DF8111"""
+"""5EA4AE84F3E28120_012F9C1F5D863E78_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC=C(C=C2)OC3CCCC3""",21,"""2DDA60C0A8DF8111"""
+"""8542DADCED2F817E_801945E1EA7D56AC_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""2DDA60C0A8DF8111"""
+"""B1E299FBE577BFFD_F56627D39051F21B_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""2DDA60C0A8DF8111"""
+"""258E6B59E9D20BF5_0A81E05F47500CF6_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""2DDA60C0A8DF8111"""
+"""9FC6F93403FA8354_FD0609AA6C2921E8_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""2DDA60C0A8DF8111"""
+"""BC219F74C066341F_8B0D27B6A4452683_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""2DDA60C0A8DF8111"""
+"""ADABE3B2DE85D02A_4E3DB68C3DA14FFC_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""2DDA60C0A8DF8111"""
+"""DA392A555345D213_245983AAC297449C_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""2DDA60C0A8DF8111"""
+"""A0C06158543719D5_556231DFD39CCA6F_6004_UN""","""NC(=NO)C1=CC=C(S1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""2DDA60C0A8DF8111"""
+"""6DF9451D30F417D8_E7A9DDAA11D5C32D_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""2DDA60C0A8DF8111"""
+"""2250C7821237AFDF_92674F222B79531F_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""2DDA60C0A8DF8111"""
+"""0DD8EAEC166A016C_C19B177B150BF20E_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(C=CC=C2)CN3CCCC3""",21,"""2DDA60C0A8DF8111"""
+"""D0D5E6250DAA3D9B_594F47FAA9B911B4_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""2DDA60C0A8DF8111"""
+"""16CED801D5D593A5_53486DF9F0C4F549_6004_UN""","""NC(=NO)C1=CC=C(S1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""2DDA60C0A8DF8111"""
+"""920A6401EC3309A4_2FB3E335C2E61836_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=CC=C2)OC3CCCC3)Br""",21,"""2E43B261337DE1EA"""
+"""43F4A46E573EC0B2_80C41B1939F6B4CA_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=C(OCC)C=C2)OCC)Br""",21,"""2E43B261337DE1EA"""
+"""A005D458DBAC1C27_7CC46CDEA61D43E0_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=CC(=C2)OCCC(C)C)Br""",21,"""2E43B261337DE1EA"""
+"""8E6EFCECF81C0776_20FE9488353175E4_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=C(C=C2)C[N]3C=CN=C3)Br""",21,"""2E43B261337DE1EA"""
+"""E1D0F706C30D3959_13D6FB49B25F834C_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=C(C=C2)OC3CCOC3)Br""",21,"""2E43B261337DE1EA"""
+"""BE1942A78EE23606_D8371F3D6A2877BF_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=C(OC)C=C2)CN(C)C)Br""",21,"""2E43B261337DE1EA"""
+"""4C43CBA1093E053A_00583B313EEC6637_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=CC(=C2)COCCOC)Br""",21,"""2E43B261337DE1EA"""
+"""1031D9FB69817881_8935B63030506D5B_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=CC(=C2)CN(C)C3CC3)Br""",21,"""2E43B261337DE1EA"""
+"""44DFC3E8CBC0D32F_962EA2D3071A8A3E_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=CC(=C2)OC(COC)C)Br""",21,"""2E43B261337DE1EA"""
+"""3DC361911849C2A7_C46F5AE78CAF2A12_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=C(C(NOC)=O)C=C2)F)Br""",21,"""2E43B261337DE1EA"""
+"""482273AA59C60FBC_D196BCD317D28B50_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(OC)N=C(C=C2)C(F)(F)F)Br""",21,"""2E43B261337DE1EA"""
+"""6C97A500D1B71755_A82DD3FFE0E8B72D_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=CC=C2)CN3CCCC3)Br""",21,"""2E43B261337DE1EA"""
+"""D0CFD1B168DE3F0A_B109F7FD888458AD_6005_UN""","""FC1=CC(=C(C(=C1)F)C3=CC=C([N]2C=C(C)C=N2)C=C3)Br""",21,"""2E43B261337DE1EA"""
+"""2C288711F54033A4_CCFDA81F0F92E9C4_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=CC(=C2)OCCN(C)C)Br""",21,"""2E43B261337DE1EA"""
+"""5D2ACA7E1033643D_3B2064DD9EF04AFF_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(C=C(C(C)C)C=C2)C(C)C)Br""",21,"""2E43B261337DE1EA"""
+"""32CCE8723D3089CD_0C075C59699A494B_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=C(C=C2)C3=CC=CC=C3)Br""",21,"""2E43B261337DE1EA"""
+"""D05A02BC6C6917D6_DECBA2DD439563F8_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(C=CC=C2F)OC(F)(F)F)Br""",21,"""2E43B261337DE1EA"""
+"""CA15414F7FBEB741_0E1E6C55B6CF57EB_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Br""",21,"""2E43B261337DE1EA"""
+"""BB81A114A11CCE16_218B581AA5E8352E_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(C=C(OC)C=C2)C(F)(F)F)Br""",21,"""2E43B261337DE1EA"""
+"""634F51E9B579E419_24B0A6BF79D8E707_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=CC(=C2F)C(N(C)C)=O)Br""",21,"""2E43B261337DE1EA"""
+"""E378EFD65BECA5BC_E14B004819587B33_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=C(OC)C=C2)C(F)(F)F)Br""",21,"""2E43B261337DE1EA"""
+"""50ADEF9FA1B6D0F8_F1679019C6B6CFC7_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Br""",21,"""2E43B261337DE1EA"""
+"""B73D237DED06DA88_2C74C92068153BBD_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=CC=C2)C3=CC=CC=C3)Br""",21,"""2E43B261337DE1EA"""
+"""8060DC61970F7C0C_BC072D5AF1E8B168_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(OC)C=C(C=C2)C(F)(F)F)Br""",21,"""2E43B261337DE1EA"""
+"""DFCAB734A9C37DC0_99269DE911E77FB3_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(C)C=C(C=C2)OC(F)(F)F)Br""",21,"""2E43B261337DE1EA"""
+"""8691DF0381389346_FFDB2DA8386ECED3_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=C(OCCC(C)C)C=C2)Br""",21,"""2E43B261337DE1EA"""
+"""AF5DFDB2DCF068CC_02B64EBEC6245E83_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=C(C=C2)OC3CCCC3)Br""",21,"""2E43B261337DE1EA"""
+"""A7A809BD2C322F54_8380974071DF3657_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(C=C(OC)C=C2)CN(C)C)Br""",21,"""2E43B261337DE1EA"""
+"""5B791717270EE60B_F6FFF5720BF392E0_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=C(N=C2)C(F)(F)F)OC)Br""",21,"""2E43B261337DE1EA"""
+"""2A4A0BD77B251B34_091832FEDCF26C0D_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(C)C=C(C=C2)OCC3CC3)Br""",21,"""2E43B261337DE1EA"""
+"""6E3B245EC593C697_FE9FDB0BF78B4113_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(C=CC(=C2)C3(CC3)C#N)F)Br""",21,"""2E43B261337DE1EA"""
+"""77166C59A049303E_8894F5173FE74678_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(OCC(C)(C)C)N=CC=C2)Br""",21,"""2E43B261337DE1EA"""
+"""95319A237DDFF2FA_4DA4642DA6032F07_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC=C(C=C2)C[N]3C=NC=N3)Br""",21,"""2E43B261337DE1EA"""
+"""964C2880739DE8D3_27C0510B59352467_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(OCC)C=CC(=C2)[N](=O)=O)Br""",21,"""2E43B261337DE1EA"""
+"""A629BC73C3ECE352_56FBE37E483EAA94_6005_UN""","""FC1=CC(=C(C(=C1)F)C3=CC2=C(C=C(OC)C=C2)C=C3)Br""",21,"""2E43B261337DE1EA"""
+"""D93F0054A717BB63_E4300F0B8A77A3D6_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=C(C=C2C3CC3)Cl)OC)Br""",21,"""2E43B261337DE1EA"""
+"""D5228D90940A0340_91FE9D83B0DB33E4_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=CC=C2)C3=CC=NC=C3)Br""",21,"""2E43B261337DE1EA"""
+"""5915C686B20EE0DC_C202C5DA8EA992F5_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(C=CC=C2)CN3CCCC3)Br""",21,"""2E43B261337DE1EA"""
+"""161DD2DD75C95CC2_5AD6955B321B714F_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=CC(=N[N]2C3CCCCO3)C)Br""",21,"""2E43B261337DE1EA"""
+"""1C12187C7C5A02E0_50D1BF586B6695B2_6005_UN""","""FC1=CC(=C(C(=C1)F)C2=C(C=C(C=C2)OC(F)(F)F)F)Br""",21,"""2E43B261337DE1EA"""
+"""2ADAB564E383D492_2E50841420742A86_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=CC=C2)OC3CCCC3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""5D3D3F0AEE118047_81277C38DB64867A_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=C(OCC)C=C2)OCC)CBr""",21,"""2FA0D540D1EFD35A"""
+"""913AB8951F61F908_7D270BFF448F7150_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=CC(=C2)OCCC(C)C)CBr""",21,"""2FA0D540D1EFD35A"""
+"""611B4C93BAF1C70A_211DF3A9D7A34754_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""3119B2CB98ECC948_12359C6850CDB1FC_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=C(C=C2)OC3CCOC3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""6D757880E2D8FCC4_D9D4781C88BA450F_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C)CBr""",21,"""2FA0D540D1EFD35A"""
+"""0CE9A67F96C0E8DA_01BB5C10DC7E5487_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=CC(=C2)COCCOC)CBr""",21,"""2FA0D540D1EFD35A"""
+"""6C62015AF194169D_88D6D111D2C25FEB_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""D0458EBD86DFA3B5_97CDC5F2E588B88E_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=CC(=C2)OC(COC)C)CBr""",21,"""2FA0D540D1EFD35A"""
+"""DED7D9FB5421EB65_C58C3DC66E3D18A2_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F)CBr""",21,"""2FA0D540D1EFD35A"""
+"""0290CEA9C439C78B_D075DBF2F540B9E0_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)CBr""",21,"""2FA0D540D1EFD35A"""
+"""40C885A50499503F_A9CEB4DE027A859D_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=CC=C2)CN3CCCC3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""E615923D66C0F022_B0EA90DC6A166A1D_6005_UN""","""ClC1=CC(=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""BAC2832DDF077D1B_CD1ECF3EED00DB74_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=CC(=C2)OCCN(C)C)CBr""",21,"""2FA0D540D1EFD35A"""
+"""8710EBC1C2C171C8_3AC303FC7C62784F_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)CBr""",21,"""2FA0D540D1EFD35A"""
+"""7D314CAFB4775EBF_0DE43B788B087BFB_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""8EDE7EDB391CC51F_DF28C5FCA1075148_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F)CBr""",21,"""2FA0D540D1EFD35A"""
+"""3A131CF55B3EA002_0FFD0B74545D655B_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)CBr""",21,"""2FA0D540D1EFD35A"""
+"""29FA402B536DAEA9_20683F3B477A079E_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)CBr""",21,"""2FA0D540D1EFD35A"""
+"""B2E1CA3A8843D3F9_2553C19E9B4AD5B7_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O)CBr""",21,"""2FA0D540D1EFD35A"""
+"""3E5B40F194FEA343_E0A86769FBCA4983_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)CBr""",21,"""2FA0D540D1EFD35A"""
+"""27CBB14D518621BC_F084F7382424FD77_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)CBr""",21,"""2FA0D540D1EFD35A"""
+"""8AEB6064FEFA2B7F_2D97AE018A87090D_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""CA3E6694D99443D2_BDE44A7B137A83D8_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)CBr""",21,"""2FA0D540D1EFD35A"""
+"""8CA6B473C1F97543_98C5FAC8F3754D03_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)CBr""",21,"""2FA0D540D1EFD35A"""
+"""41784B98CF543246_FE384A89DAFCFC63_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=C(OCCC(C)C)C=C2)CBr""",21,"""2FA0D540D1EFD35A"""
+"""5C8E321D5FCA0BEE_0355299F24B66C33_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=C(C=C2)OC3CCCC3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""A4918B0F44CABDBA_8263F061934D04E7_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C)CBr""",21,"""2FA0D540D1EFD35A"""
+"""A26EEBB5884275B5_F71C9253E961A050_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)CBr""",21,"""2FA0D540D1EFD35A"""
+"""A0B3494437978A19_08FB55DF3E605EBD_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""31A5D589A3C36285_FF7CBC2A151973A3_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)CBr""",21,"""2FA0D540D1EFD35A"""
+"""9CEFEC25374EA6E4_89779236DD7574C8_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2)CBr""",21,"""2FA0D540D1EFD35A"""
+"""FC7C282656EC5838_4C47030C44911DB7_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""0C8AEE08EB79292B_2623362ABBA716D7_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)CBr""",21,"""2FA0D540D1EFD35A"""
+"""0C8B2CF58FDCF6AB_5718845FAAAC9824_6005_UN""","""ClC1=CC(=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""5AB8CBE76B8608BD_E5D3682A68E59166_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)CBr""",21,"""2FA0D540D1EFD35A"""
+"""FB7B8A33A5C6DA67_901DFAA252490154_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""233433DD4E142F58_C3E1A2FB6C3BA045_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(C=CC=C2)CN3CCCC3)CBr""",21,"""2FA0D540D1EFD35A"""
+"""893540A14752E2C0_5B35F27AD08943FF_6005_UN""","""ClC1=CC(=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C)CBr""",21,"""2FA0D540D1EFD35A"""
+"""07572E32AC41E3EB_5132D87989F4A702_6005_UN""","""ClC1=CC(=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)CBr""",21,"""2FA0D540D1EFD35A"""
+"""A7243F4F0B652F3C_31CFC9AEB06AA8BD_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""303F98FA41F15161"""
+"""810FE31E978B10CB_9EB831824B7A0441_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""303F98FA41F15161"""
+"""4C2EB28E112F1AA5_62B84645D491F36B_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""303F98FA41F15161"""
+"""2649118F72311B7E_3E82BE1347BDC56F_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""303F98FA41F15161"""
+"""6DAB484F12A23420_0DAAD1D2C0D333C7_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""303F98FA41F15161"""
+"""8617B291C62D2CB4_C64B35A618A4C734_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""303F98FA41F15161"""
+"""8B10399FBFBC94BD_1E2411AA4C60D6BC_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=CC(=C2)COCCOC)N""",21,"""303F98FA41F15161"""
+"""716A692743676074_97499CAB42DCDDD0_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""303F98FA41F15161"""
+"""48606CA4FB579972_8852884875963AB5_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=CC(=C2)OC(COC)C)N""",21,"""303F98FA41F15161"""
+"""F59D6506DAF68238_DA13707CFE239A99_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""303F98FA41F15161"""
+"""D32350E206B1D9CF_CFEA9648655E3BDB_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""303F98FA41F15161"""
+"""17C388C214BA09A6_B651F964926407A6_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""303F98FA41F15161"""
+"""1430733C66C08A3D_AF75DD66FA08E826_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""303F98FA41F15161"""
+"""625CB436DF1978D1_D28182847D1E594F_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""303F98FA41F15161"""
+"""950574A216835B33_255C4E46EC7CFA74_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""303F98FA41F15161"""
+"""D781C6ED55622859_127B76C21B16F9C0_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""303F98FA41F15161"""
+"""D221956642B5550B_C0B788463119D373_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""303F98FA41F15161"""
+"""2029222CC8070A29_106246CEC443E760_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""303F98FA41F15161"""
+"""4F92F9E02F2629E7_3FF77281D76485A5_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""303F98FA41F15161"""
+"""7D4B3DC768A24749_3ACC8C240B54578C_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""303F98FA41F15161"""
+"""824178DCAA25D247_FF372AD36BD4CBB8_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""303F98FA41F15161"""
+"""C491E1DCF726D829_EF1BBA82B43A7F4C_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""303F98FA41F15161"""
+"""A8E690DCC4BB1645_3208E3BB1A998B36_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""303F98FA41F15161"""
+"""F255271E1671475E_A27B07C1836401E3_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""303F98FA41F15161"""
+"""2F37FC954F5C81A7_875AB772636BCF38_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""303F98FA41F15161"""
+"""DF2853F9207A7F47_E1A707334AE27E58_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=C(OCCC(C)C)C=C2)N""",21,"""303F98FA41F15161"""
+"""3F1FC24EC144CEBF_1CCA6425B4A8EE08_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=C(C=C2)OC3CCCC3)N""",21,"""303F98FA41F15161"""
+"""91491918C9CF6ACD_9DFCBDDB035386DC_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C)N""",21,"""303F98FA41F15161"""
+"""6661B5D8F22910EC_E883DFE9797F226B_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC)N""",21,"""303F98FA41F15161"""
+"""A722E6851D9ADEB5_17641865AE7EDC86_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(C)C=C(C=C2)OCC3CC3)N""",21,"""303F98FA41F15161"""
+"""273A48DA2A3626C6_E0E3F1908507F198_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F)N""",21,"""303F98FA41F15161"""
+"""06EDE5C4D6D5CAA4_96E8DF8C4D6BF6F3_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(OCC(C)(C)C)N=CC=C2)N""",21,"""303F98FA41F15161"""
+"""D0B7EB740C4C877E_53D84EB6D48F9F8C_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3)N""",21,"""303F98FA41F15161"""
+"""4FF137418D33EA8F_39BC7B902BB994EC_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O)N""",21,"""303F98FA41F15161"""
+"""5B535508B687A76B_4887C9E53AB21A1F_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3)N""",21,"""303F98FA41F15161"""
+"""A2DFF58BF4BC39AC_FA4C2590F8FB135D_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC)N""",21,"""303F98FA41F15161"""
+"""EACAB78D32C0C394_8F82B718C257836F_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3)N""",21,"""303F98FA41F15161"""
+"""C3B869DE74A5F16C_DC7EEF41FC25227E_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(C=CC=C2)CN3CCCC3)N""",21,"""303F98FA41F15161"""
+"""283AFA09F86BFE7D_44AABFC04097C1C4_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=CC(=N[N]2C3CCCCO3)C)N""",21,"""303F98FA41F15161"""
+"""66DAA813B0A274B1_4EAD95C319EA2539_6005_UN""","""CC1=C(C(=NC(=C1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F)N""",21,"""303F98FA41F15161"""
+"""A6325738F86BB8E6_311E210DCDEE03D8_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""30EE70593C75FA04"""
+"""83268AACDB9C0719_9E69D92136FEAF24_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""30EE70593C75FA04"""
+"""3D2DD03296311905_6269AEE6A915580E_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""30EE70593C75FA04"""
+"""7D0D736233495009_3E5356B03A396E0A_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""30EE70593C75FA04"""
+"""6F1A56DF355D7CF6_0D7B3971BD5798A2_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""30EE70593C75FA04"""
+"""1F92CDBF8381A99B_C69ADD0565206C51_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""30EE70593C75FA04"""
+"""4A1771B4A5A97740_1EF5F90931E47DD9_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=CC(=C2)COCCOC""",21,"""30EE70593C75FA04"""
+"""9F6EE5E5CF851C73_979874083F5876B5_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""30EE70593C75FA04"""
+"""6CD0C9270BBD2462_888360EB081291D0_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""30EE70593C75FA04"""
+"""4BFDD410F23D326B_DAC298DF83A731FC_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""30EE70593C75FA04"""
+"""73697136B10E1E19_CF3B7EEB18DA90BE_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""30EE70593C75FA04"""
+"""D2CD7FB55FD14288_B68011C7EFE0ACC3_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""30EE70593C75FA04"""
+"""F7D7B065F8256DA9_AFA435C5878C4343_6005_UN""","""COC(=O)C1=NSC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""30EE70593C75FA04"""
+"""90607456176960DF_D2506A27009AF22A_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""30EE70593C75FA04"""
+"""DA2BD0802ABEF3C9_258DA6E591F85111_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""30EE70593C75FA04"""
+"""800BB1B1BADBC4E2_12AA9E61669252A5_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""30EE70593C75FA04"""
+"""4085451BF94CCF09_C06660E54C9D7816_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""30EE70593C75FA04"""
+"""7C30725D5D710A50_10B3AE6DB9C74C05_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""30EE70593C75FA04"""
+"""E31DF71C7434371D_3F269A22AAE02EC0_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""30EE70593C75FA04"""
+"""A9B89E6C4C0A1D22_3A1D648776D0FCE9_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""30EE70593C75FA04"""
+"""0E9F876380A16175_FFE6C270165060DD_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""30EE70593C75FA04"""
+"""4401BAFAE4A0267E_EFCA5221C9BED429_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""30EE70593C75FA04"""
+"""A2268BAC5081903F_32D90B18671D2053_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""30EE70593C75FA04"""
+"""B42F7DE82E1CBD7E_A2AAEF62FEE0AA86_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""30EE70593C75FA04"""
+"""9FD7DDA3359680EF_878B5FD11EEF645D_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""30EE70593C75FA04"""
+"""BA90C39EC75191F2_E176EF903766D53D_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""30EE70593C75FA04"""
+"""2D43DAA15C915461_1C1B8C86C92C456D_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""30EE70593C75FA04"""
+"""E2F9844E0ACA0887_9D2D55787ED72DB9_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""30EE70593C75FA04"""
+"""36A17429B6CFEBD9_E852374A04FB890E_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""30EE70593C75FA04"""
+"""41236CD8E3B7554C_17B5F0C6D3FA77E3_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""30EE70593C75FA04"""
+"""1372436E3866A6C4_E0321933F8835AFD_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""30EE70593C75FA04"""
+"""1EECF565ABCA35F6_9639372F30EF5D96_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""30EE70593C75FA04"""
+"""63554E6DF0FD08D2_5309A615A90B34E9_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""30EE70593C75FA04"""
+"""D53A8EC9A0D9B49E_396D9333563D3F89_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""30EE70593C75FA04"""
+"""50B46B187C94BCD6_485621464736B17A_6005_UN""","""COC(=O)C1=NSC(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""30EE70593C75FA04"""
+"""2E61170777CADC5C_FA9DCD33857FB838_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""30EE70593C75FA04"""
+"""513D89CCCE31A3B7_8F535FBBBFD3280A_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""30EE70593C75FA04"""
+"""AA794F4F291C086A_DCAF07E281A1891B_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""30EE70593C75FA04"""
+"""CC1AC59083C5CD40_447B57633D136AA1_6005_UN""","""COC(=O)C1=NSC(=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""30EE70593C75FA04"""
+"""A09450547F074F5E_4E7C7D60646E8E5C_6005_UN""","""COC(=O)C1=NSC(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""30EE70593C75FA04"""
+"""4AE11FE191E558AC_310CBCDB22CF3C1F_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=CC=C2)OC3CCCC3""",21,"""30FCED8FD354C5C3"""
+"""2D3ED47BE9B6E444_9E7B44F7D9DF90E3_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=C(OCC)C=C2)OCC""",21,"""30FCED8FD354C5C3"""
+"""FDBD32502A0860BA_627B3330463467C9_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=CC(=C2)OCCC(C)C""",21,"""30FCED8FD354C5C3"""
+"""DF38D544F7CD4DFB_3E41CB66D51851CD_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""30FCED8FD354C5C3"""
+"""C2A995B62D5BB26E_0D69A4A75276A765_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=C(C=C2)OC3CCOC3""",21,"""30FCED8FD354C5C3"""
+"""498303DDA53E1AA6_C68840D38A015396_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""30FCED8FD354C5C3"""
+"""89C75062154B158D_1EE764DFDEC5421E_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=CC(=C2)COCCOC""",21,"""30FCED8FD354C5C3"""
+"""CF40655AF712D9C8_978AE9DED0794972_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""30FCED8FD354C5C3"""
+"""79C8A1F4D45D4D10_8891FD3DE733AE17_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=CC(=C2)OC(COC)C""",21,"""30FCED8FD354C5C3"""
+"""F612EAEEBC5CF402_DAD005096C860E3B_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""30FCED8FD354C5C3"""
+"""1AC75AAD225F4EC0_CF29E33DF7FBAF79_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""30FCED8FD354C5C3"""
+"""309D2A4022849DC9_B6928C1100C19304_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=CC=C2)CN3CCCC3""",21,"""30FCED8FD354C5C3"""
+"""D458D24169AEB8F6_AFB6A81368AD7C84_6005_UN""","""COC(=O)C1=C(C=CS1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""30FCED8FD354C5C3"""
+"""4A0525525E18A6B4_D242F7F1EFBBCDED_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=CC(=C2)OCCN(C)C""",21,"""30FCED8FD354C5C3"""
+"""F43677A855467EFB_259F3B337ED96ED6_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""30FCED8FD354C5C3"""
+"""C36B58EC64DABFAD_12B803B789B36D62_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""30FCED8FD354C5C3"""
+"""A38D00651F0E4CCC_C074FD33A3BC47D1_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""30FCED8FD354C5C3"""
+"""B278D4BD07A0CD00_10A133BB56E673C2_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""30FCED8FD354C5C3"""
+"""626F052ABEAF499C_3F3407F445C11107_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""30FCED8FD354C5C3"""
+"""3C671E0EBD5F5E1B_3A0FF95199F1C32E_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""30FCED8FD354C5C3"""
+"""E48556655FED0EFA_FFF45FA6F9715F1A_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""30FCED8FD354C5C3"""
+"""720AFF7A7A1CA523_EFD8CFF7269FEBEE_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""30FCED8FD354C5C3"""
+"""3CE517F5825F7E46_32CB96CE883C1F94_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""30FCED8FD354C5C3"""
+"""8EC8F0D531C7A345_A2B872B411C19541_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""30FCED8FD354C5C3"""
+"""7B1636E5470E1332_8799C207F1CE5B9A_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""30FCED8FD354C5C3"""
+"""FBD6E157C64CF4AF_E1647246D847EAFA_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=C(OCCC(C)C)C=C2""",21,"""30FCED8FD354C5C3"""
+"""EBCD6C7FF6FF149D_1C091150260D7AAA_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=C(C=C2)OC3CCCC3""",21,"""30FCED8FD354C5C3"""
+"""6874AA3D6490ACA5_9D3FC8AE91F6127E_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""30FCED8FD354C5C3"""
+"""7D655B558B628F0E_E840AA9CEBDAB6C9_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""30FCED8FD354C5C3"""
+"""1ACFCF296F746800_17A76D103CDB4824_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""30FCED8FD354C5C3"""
+"""38F3306C64A756BB_E02084E517A2653A_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""30FCED8FD354C5C3"""
+"""EB861DB38A576FFB_962BAAF9DFCE6251_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""30FCED8FD354C5C3"""
+"""A853B6189E7708E6_531B3BC3462A0B2E_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""30FCED8FD354C5C3"""
+"""8C7DC22B045E4F92_397F0EE5B91C004E_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""30FCED8FD354C5C3"""
+"""D07A30B7E5769951_4844BC90A8178EBD_6005_UN""","""COC(=O)C1=C(C=CS1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""30FCED8FD354C5C3"""
+"""5E27C8BED493D791_FA8F50E56A5E87FF_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""30FCED8FD354C5C3"""
+"""1411A4064A1AFBD2_8F41C26D50F217CD_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""30FCED8FD354C5C3"""
+"""1D952578043FF22C_DCBD9A346E80B6DC_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(C=CC=C2)CN3CCCC3""",21,"""30FCED8FD354C5C3"""
+"""2DBF3564EA549E8F_4469CAB5D2325566_6005_UN""","""COC(=O)C1=C(C=CS1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""30FCED8FD354C5C3"""
+"""1664E2D179FDDFF2_4E6EE0B68B4FB19B_6005_UN""","""COC(=O)C1=C(C=CS1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""30FCED8FD354C5C3"""
+"""F423AB8726109817_CFD5B94B87142A8D_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](CCN)(=O)=O)C2CC2""",21,"""311DC7A459EF4795"""
+"""27C68CE522867939_54AC69C12AB72523_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""311DC7A459EF4795"""
+"""027951B531C5DECC_03238574C4F7067F_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""311DC7A459EF4795"""
+"""B076EB183DFFF1BD_1E3584CC8A5F7FB7_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](CC)(=O)=O)CCCN""",21,"""311DC7A459EF4795"""
+"""E9B9A1EDC4F12494_94EA21217C8B4A96_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](C)(=O)=O)C2CC(C2)N""",21,"""311DC7A459EF4795"""
+"""9C511CBEA4B68E70_D23029264CBEC817_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""311DC7A459EF4795"""
+"""7D17CB34814022B7_27D1A5609E2C5D56_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C)[S](=O)(=O)C2CNCC2""",21,"""311DC7A459EF4795"""
+"""C3C41C1D2A77B394_9989AE7721C3F892_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](CC)(=O)=O)CCCBr""",21,"""311DC7A459EF4795"""
+"""3AA5C293EC4FD6E9_2D532F7784CD7B1C_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(CCCNC)[S](=O)(=O)C""",21,"""311DC7A459EF4795"""
+"""7623348614604A7F_C83E27110D046144_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""311DC7A459EF4795"""
+"""F6B45D5C8DD6D17C_9A754D0A513BB28C_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](=O)(=O)CC#N)C2CC2""",21,"""311DC7A459EF4795"""
+"""540CB3515A62F2DA_19A1267CB99DF09B_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""311DC7A459EF4795"""
+"""0CD3AD5421706909_DFA7718C5DC34468_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""311DC7A459EF4795"""
+"""9C90CA87708E9040_7D012C154D8C5629_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""311DC7A459EF4795"""
+"""F688A07E669EA92B_B066775C92C27676_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""311DC7A459EF4795"""
+"""751309F3FC1555BC_441BD8EB5DC226DF_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""311DC7A459EF4795"""
+"""900A8C6082C11D0C_4EEF3FEBC1B91ED9_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""311DC7A459EF4795"""
+"""DB3C373E11F5B1AA_4CC16ACAC3B2AEF2_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""311DC7A459EF4795"""
+"""11761830C5859079_DF037586194A7516_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""311DC7A459EF4795"""
+"""491D4E0D84EBF135_0FB242201F377132_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""311DC7A459EF4795"""
+"""A1F6CC0F104B44DD_45BD259188F9F6BF_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""311DC7A459EF4795"""
+"""062F7B64CC039DF8_A980BBF382D352B0_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""311DC7A459EF4795"""
+"""C6000FF39EBEA3E8_A06D0F9729867F0A_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](=O)(=O)C2CC2)CC#C""",21,"""311DC7A459EF4795"""
+"""34456DF6AABA5478_F46D151CCE88BACC_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""311DC7A459EF4795"""
+"""FFE456C0735AD430_DC065AE1EB8CF624_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N2CCCC(C)(C)[S]2(=O)=O""",21,"""311DC7A459EF4795"""
+"""D8B88F2761385C07_172FA1B5624A3D37_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N2CCCC(CC)[S]2(=O)=O""",21,"""311DC7A459EF4795"""
+"""59C3113D1BD4C49A_2646D16F07F38B98_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""311DC7A459EF4795"""
+"""940FF93026AC6255_F958B6C17DFBB2B6_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""311DC7A459EF4795"""
+"""7C03CBFD8D5A0EEC_52607858A96B2F9A_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""311DC7A459EF4795"""
+"""2B8BD533DA90485D_120CC808AC51F624_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""311DC7A459EF4795"""
+"""C71B77CAC7931959_BA4352DC574CE94C_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N2[S](CCN(C)CC2)(=O)=O""",21,"""311DC7A459EF4795"""
+"""A896547503BE1898_36D474513FE502AF_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N2CC(=O)NCC[S]2(=O)=O""",21,"""311DC7A459EF4795"""
+"""35B614DBECEDC325_632F69589240C53B_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N2[S](CCCCC2C)(=O)=O""",21,"""311DC7A459EF4795"""
+"""2715567DF44F33C3_19872C943CA02AC5_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(CCN)[S](=O)(=O)C2CC2""",21,"""311DC7A459EF4795"""
+"""9EBEDBCF10309F65_7F7D0A55988CB832_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""311DC7A459EF4795"""
+"""90B35FCB0D591928_DF789630A68746D0_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N([S](CC)(=O)=O)C2CNC2""",21,"""311DC7A459EF4795"""
+"""AB866214A33E1847_EDE1420C316E12AD_6036_DP""","""CC(CC1=CC(=CC(=C1)F)Br)N3CC2(CNC2)C[S]3(=O)=O""",21,"""311DC7A459EF4795"""
+"""32496385EA3D59FB_57943B9EE8AD56C7_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""311DC7A459EF4795"""
+"""48357AD175518A93_AB7FA3CEE1CF4677_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""311DC7A459EF4795"""
+"""6F9224324583DB69_951EC4792CF18EEC_6036_UN""","""CC(CC1=CC(=CC(=C1)F)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""311DC7A459EF4795"""
+"""10988642315D5194_CF3D13DFFBF7BD31_6036_UN""","""CNCC2CCN(CCN([S](CCN)(=O)=O)C1CC1)CC2""",21,"""31F56D30250CD029"""
+"""B48C90E7F08F39AE_5444C3555654B29F_6036_UN""","""CNCC1CCN(CCN(C(C)C)[S](=O)(=O)CCN)CC1""",21,"""31F56D30250CD029"""
+"""7DBFE5BA4987263C_03CB2FE0B81491C3_6036_UN""","""CNCC1CCN(CCN([S](C)(=O)=O)CCN=C=S)CC1""",21,"""31F56D30250CD029"""
+"""7B507BC58514E246_1EDD2E58F6BCE80B_6036_UN""","""CNCC1CCN(CCN([S](CC)(=O)=O)CCCN)CC1""",21,"""31F56D30250CD029"""
+"""0CD69FBCF7B509EF_94028BB50068DD2A_6036_UN""","""CNCC2CCN(CCN([S](C)(=O)=O)C1CC(C1)N)CC2""",21,"""31F56D30250CD029"""
+"""F78F1D3976FB7B8E_D2D883B2305D5FAB_6036_UN""","""CNCC1CCN(CCN(CCCN)[S](=O)(=O)CCl)CC1""",21,"""31F56D30250CD029"""
+"""CB2514966796E9F3_27390FF4E2CFCAEA_6036_UN""","""CNCC2CCN(CCN(C)[S](=O)(=O)C1CNCC1)CC2""",21,"""31F56D30250CD029"""
+"""D72DDB18FB261CD1_996104E35D206F2E_6036_UN""","""CNCC1CCN(CCN([S](CC)(=O)=O)CCCBr)CC1""",21,"""31F56D30250CD029"""
+"""F5A6772E70100454_2DBB85E3F82EECA0_6036_UN""","""CNCC1CCN(CCN(CCCNC)[S](=O)(=O)C)CC1""",21,"""31F56D30250CD029"""
+"""A02875A6A2B2610E_C8D68D8571E7F6F8_6036_UN""","""CNCC1CCN(CCN(C(C)(C)C#N)[S](=O)(=O)C)CC1""",21,"""31F56D30250CD029"""
+"""B00C778E215C53CD_9A9DE79E2DD82530_6036_UN""","""CNCC2CCN(CCN([S](=O)(=O)CC#N)C1CC1)CC2""",21,"""31F56D30250CD029"""
+"""9F2A977D3E9ADEEC_19498CE8C57E6727_6036_UN""","""CNCC1CCN(CCN([S](C)(=O)=O)C(=O)CCN)CC1""",21,"""31F56D30250CD029"""
+"""B1048B599C4C29C4_DF4FDB182120D3D4_6036_UN""","""CNCC2CCN(CCN(C)[S](=O)(=O)C1=CC=CS1)CC2""",21,"""31F56D30250CD029"""
+"""4413C4B302EC1E8A_7DE98681316FC195_6036_UN""","""CNCC1CCN(CCN(C(C)(C)C)[S](=O)(=O)CCl)CC1""",21,"""31F56D30250CD029"""
+"""B998058C18F2A144_B08EDDC8EE21E1CA_6036_UN""","""CNCC1CCN(CCN(C(C)(C)C)[S](=O)(=O)CBr)CC1""",21,"""31F56D30250CD029"""
+"""C85CC90DDBAEA791_44F3727F2121B163_6036_UN""","""CNCC1CCN(CCN(C(C)(C)C#C)[S](=O)(=O)C)CC1""",21,"""31F56D30250CD029"""
+"""B601FAD749207928_4E07957FBD5A8965_6036_UN""","""CNCC1CCN(CCN(CC(CC)N)[S](=O)(=O)C)CC1""",21,"""31F56D30250CD029"""
+"""B3750F631C65171A_4C29C05EBF51394E_6036_UN""","""CNCC2CCN(CCN(C)[S](=O)(=O)C1=C[NH]C=N1)CC2""",21,"""31F56D30250CD029"""
+"""5643EA6D36BDED1D_DFEBDF1265A9E2AA_6036_UN""","""CNCC1CCN(CCN([S](C)(=O)=O)CCN=[N]#N)CC1""",21,"""31F56D30250CD029"""
+"""8B9F17FA073F2F2B_0F5AE8B463D4E68E_6036_UN""","""CNCC1CCN(CCN(CC(C)(C)N)[S](=O)(=O)C)CC1""",21,"""31F56D30250CD029"""
+"""7AABD0799F7CEB82_45558F05F41A6103_6036_UN""","""CNCC2CCN(CCN1[S](CC(C)(C)C1=O)(=O)=O)CC2""",21,"""31F56D30250CD029"""
+"""C1C88297ECC3E7AD_A9681167FE30C50C_6036_UN""","""CNCC3CCN(CCN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)CC3""",21,"""31F56D30250CD029"""
+"""7A7E27FE2201B6AB_A085A5035565E8B6_6036_UN""","""CNCC2CCN(CCN([S](=O)(=O)C1CC1)CC#C)CC2""",21,"""31F56D30250CD029"""
+"""28624B1C232C4F17_F485BF88B26B2D70_6036_UN""","""CNCC3CCN(CCN1[S](=O)(=O)C2(CCC1)CC2)CC3""",21,"""31F56D30250CD029"""
+"""75ED29CB645EF253_DCEEF075976F6198_6036_UN""","""CNCC2CCN(CCN1CCCC(C)(C)[S]1(=O)=O)CC2""",21,"""31F56D30250CD029"""
+"""5750C7C668D73D66_17C70B211EA9AA8B_6036_UN""","""CNCC2CCN(CCN1CCCC(CC)[S]1(=O)=O)CC2""",21,"""31F56D30250CD029"""
+"""E9CFF94767647067_26AE7BFB7B101C24_6036_UN""","""CNCC2CCN(CCN1C(C(N)CC[S]1(=O)=O)=O)CC2""",21,"""31F56D30250CD029"""
+"""25F37DDA853D3DA2_F9B01C550118250A_6036_UN""","""CNCC2CCN(CCN([S](C)(=O)=O)[C@@H]1CNCC1)CC2""",21,"""31F56D30250CD029"""
+"""650371706A49D25C_5288D2CCD588B826_6036_UN""","""CNCC2CCN(CCN1CCCC(Cl)(Cl)[S]1(=O)=O)CC2""",21,"""31F56D30250CD029"""
+"""44A5D224ACB0D955_12E4629CD0B26198_6036_UN""","""CNCC2CCN(CCN([S](C)(=O)=O)[C@H]1CNCC1)CC2""",21,"""31F56D30250CD029"""
+"""C8E38EF1C4DFD105_BAABF8482BAF7EF0_6036_UN""","""CNCC2CCN(CCN1[S](CCN(C)CC1)(=O)=O)CC2""",21,"""31F56D30250CD029"""
+"""2AE3559E23639AAA_363CDEC543069513_6036_UN""","""CNCC2CCN(CCN1CC(=O)NCC[S]1(=O)=O)CC2""",21,"""31F56D30250CD029"""
+"""868F7B9534AC0BE3_63C7C3CCEEA35287_6036_UN""","""CNCC2CCN(CCN1[S](CCCCC1C)(=O)=O)CC2""",21,"""31F56D30250CD029"""
+"""9F6CD225BAF80274_196F86004043BD79_6036_UN""","""CNCC2CCN(CCN(CCN)[S](=O)(=O)C1CC1)CC2""",21,"""31F56D30250CD029"""
+"""6E2F945478A30388_7F95A0C1E46F2F8E_6036_UN""","""CNCC1CCN(CCN(CCN)[S](=O)(=O)C(F)F)CC1""",21,"""31F56D30250CD029"""
+"""2ABED2430A201A30_DF903CA4DA64D16C_6036_UN""","""CNCC2CCN(CCN([S](CC)(=O)=O)C1CNC1)CC2""",21,"""31F56D30250CD029"""
+"""24794D8E6BE027C0_ED09E8984D8D8511_6036_DP""","""CNCC3CCN(CCN2CC1(CNC1)C[S]2(=O)=O)CC3""",21,"""31F56D30250CD029"""
+"""9730CB9F9B0597A4_577C910A944EC17B_6036_UN""","""CNCC2CCN(CCN(C)[S](=O)(=O)C1=N[NH]C=N1)CC2""",21,"""31F56D30250CD029"""
+"""B19C894B3CC728D6_AB97095A9D2CD1CB_6036_UN""","""CNCC2CCN(CCN(C)[S](=O)(=O)C1=C[NH]N=C1)CC2""",21,"""31F56D30250CD029"""
+"""419FCF361AE4AECC_95F66EED50121950_6036_UN""","""CNCC1CCN(CCN(C(C)(C)CN)[S](=O)(=O)C)CC1""",21,"""31F56D30250CD029"""
+"""FD2FB9635D1FA5A5_33ECC5D8DE17C135_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=CC=C2)OC3CCCC3""",21,"""321C948C2F8C38E9"""
+"""C9AD20D11BDA08E2_9C9B3DF425076DC9_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=C(OCC)C=C2)OCC""",21,"""321C948C2F8C38E9"""
+"""E0F430198687FAF0_609B4A33BAEC9AE3_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=CC(=C2)OCCC(C)C""",21,"""321C948C2F8C38E9"""
+"""5D6D595D53A7CC58_3CA1B26529C0ACE7_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""321C948C2F8C38E9"""
+"""829A6E87B082921A_0F89DDA4AEAE5A4F_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=C(C=C2)OC3CCOC3""",21,"""321C948C2F8C38E9"""
+"""4EB371D314AFE42F_C46839D076D9AEBC_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""321C948C2F8C38E9"""
+"""0912670CEF7EA736_1C071DDC221DBF34_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=CC(=C2)COCCOC""",21,"""321C948C2F8C38E9"""
+"""A85DC8A2D0CAC780_956A90DD2CA1B458_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""321C948C2F8C38E9"""
+"""2C9E2AE80F65F94F_8A71843E1BEB533D_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=CC(=C2)OC(COC)C""",21,"""321C948C2F8C38E9"""
+"""48CB25378A444F72_D8307C0A905EF311_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""321C948C2F8C38E9"""
+"""46A2DB724B1F61A6_CDC99A3E0B235253_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""321C948C2F8C38E9"""
+"""1DFC37AD0A617835_B472F512FC196E2E_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=CC=C2)CN3CCCC3""",21,"""321C948C2F8C38E9"""
+"""17435963F5A644A7_AD56D110947581AE_6005_UN""","""COC1=C(C=CC(=C1)Br)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""321C948C2F8C38E9"""
+"""E4DF99DA0331C8F5_D0A28EF2136330C7_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=CC(=C2)OCCN(C)C""",21,"""321C948C2F8C38E9"""
+"""4A629CC0EC3C6E64_277F4230820193FC_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""321C948C2F8C38E9"""
+"""0C0FABBE8E1CF825_10587AB4756B9048_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""321C948C2F8C38E9"""
+"""2383F9F8120F21CF_C29484305F64BAFB_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""321C948C2F8C38E9"""
+"""3F27B300FA5A7924_12414AB8AA3E8EE8_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""321C948C2F8C38E9"""
+"""C6D07DFAB7317E7E_3DD47EF7B919EC2D_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""321C948C2F8C38E9"""
+"""19D12CDDA8415A24_38EF805265293E04_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""321C948C2F8C38E9"""
+"""E34754727090A13A_FD1426A505A9A230_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""321C948C2F8C38E9"""
+"""ECD587AFE5E0A0B9_ED38B6F4DA4716C4_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""321C948C2F8C38E9"""
+"""CA1DF0447B44AD82_302BEFCD74E4E2BE_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""321C948C2F8C38E9"""
+"""BB6D2F343F671D5E_A0580BB7ED19686B_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""321C948C2F8C38E9"""
+"""F59764084F1482C3_8579BB040D16A6B0_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""321C948C2F8C38E9"""
+"""F87BE084881610CD_E3840B45249F17D0_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=C(OCCC(C)C)C=C2""",21,"""321C948C2F8C38E9"""
+"""6EBE1CD2B93558A7_1EE96853DAD58780_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=C(C=C2)OC3CCCC3""",21,"""321C948C2F8C38E9"""
+"""8339B674F593FB30_9FDFB1AD6D2EEF54_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""321C948C2F8C38E9"""
+"""E7CAA80487A812F8_EAA0D39F17024BE3_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""321C948C2F8C38E9"""
+"""C00352D050EE9AAC_15471413C003B50E_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""321C948C2F8C38E9"""
+"""E08E4FF360383A08_E2C0FDE6EB7A9810_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""321C948C2F8C38E9"""
+"""36DCF9140911CA26_94CBD3FA23169F7B_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""321C948C2F8C38E9"""
+"""0E51B89C84C0221A_51FB42C0BAF2F604_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""321C948C2F8C38E9"""
+"""94E9CFA703C22B1A_3B9F77E645C4FD64_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""321C948C2F8C38E9"""
+"""3D65FE05803F2BDD_4AA4C59354CF7397_6005_UN""","""COC1=C(C=CC(=C1)Br)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""321C948C2F8C38E9"""
+"""D567B0048A993A8C_F86F29E696867AD5_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""321C948C2F8C38E9"""
+"""475B78D977B37B63_8DA1BB6EAC2AEAE7_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""321C948C2F8C38E9"""
+"""5593A5539C516C56_DE5DE33792584BF6_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(C=CC=C2)CN3CCCC3""",21,"""321C948C2F8C38E9"""
+"""4D4672D99EEB806D_4689B3B62EEAA84C_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=CC(=N[N]2C3CCCCO3)C""",21,"""321C948C2F8C38E9"""
+"""CC9F5E983F9DCC80_4C8E99B577974CB1_6005_UN""","""COC1=C(C=CC(=C1)Br)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""321C948C2F8C38E9"""
+"""BD6D9B6C1F9D28B9_CDF4F1D52AE84FF8_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](CCN)(=O)=O)C2CC2""",21,"""333C8F3AF41322E0"""
+"""BBA2AC6F89FEE813_568D215F874B4056_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C(C)C)[S](=O)(=O)CCN""",21,"""333C8F3AF41322E0"""
+"""1B6734B907DFD6B7_0102CDEA690B630A_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](C)(=O)=O)CCN=C=S""",21,"""333C8F3AF41322E0"""
+"""C77694B0ED56589B_1C14CC5227A31AC2_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](CC)(=O)=O)CCCN""",21,"""333C8F3AF41322E0"""
+"""8B29F3E0B8454C28_96CB69BFD1772FE3_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](C)(=O)=O)C2CC(C2)N""",21,"""333C8F3AF41322E0"""
+"""626EA293EADFD2E1_D01161B8E142AD62_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(CCCN)[S](=O)(=O)CCl""",21,"""333C8F3AF41322E0"""
+"""54FB9E7B523D64C3_25F0EDFE33D03823_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C)[S](=O)(=O)C2CNCC2""",21,"""333C8F3AF41322E0"""
+"""E920490A748CFBC3_9BA8E6E98C3F9DE7_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](CC)(=O)=O)CCCBr""",21,"""333C8F3AF41322E0"""
+"""AC02B1B40D492455_2F7267E929311E69_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(CCCNC)[S](=O)(=O)C""",21,"""333C8F3AF41322E0"""
+"""4BA13BA6EB585BE4_CA1F6F8FA0F80431_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""333C8F3AF41322E0"""
+"""1919842282BF7F95_98540594FCC7D7F9_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](=O)(=O)CC#N)C2CC2""",21,"""333C8F3AF41322E0"""
+"""89AC14F79648949F_1B806EE2146195EE_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](C)(=O)=O)C(=O)CCN""",21,"""333C8F3AF41322E0"""
+"""BA5A6073FC2A38B8_DD863912F03F211D_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""333C8F3AF41322E0"""
+"""6363C436BF133AA9_7F20648BE070335C_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""333C8F3AF41322E0"""
+"""6303F5409E7BB0AD_B2473FC23F3E1303_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""333C8F3AF41322E0"""
+"""FC0B9B27584D46D6_463A9075F03E43AA_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""333C8F3AF41322E0"""
+"""D3F74A919B513EE6_4CCE77756C457BAC_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(CC(CC)N)[S](=O)(=O)C""",21,"""333C8F3AF41322E0"""
+"""168C038C7FE5570A_4EE022546E4ECB87_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""333C8F3AF41322E0"""
+"""CA71DA25697C6509_DD223D18B4B61063_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](C)(=O)=O)CCN=[N]#N""",21,"""333C8F3AF41322E0"""
+"""85F31D0B578661ED_0D930ABEB2CB1447_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""333C8F3AF41322E0"""
+"""86ABA2BDC43E9396_479C6D0F250593CA_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""333C8F3AF41322E0"""
+"""182393830DEF7850_ABA1F36D2F2F37C5_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""333C8F3AF41322E0"""
+"""992FAAD9ACC22245_A24C4709847A1A7F_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](=O)(=O)C2CC2)CC#C""",21,"""333C8F3AF41322E0"""
+"""393E3BD6E08E1382_F64C5D826374DFB9_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""333C8F3AF41322E0"""
+"""77CE23E0BD4E0901_DE27127F46709351_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N2CCCC(C)(C)[S]2(=O)=O""",21,"""333C8F3AF41322E0"""
+"""22BC4BBB998A2AEE_150EE92BCFB65842_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N2CCCC(CC)[S]2(=O)=O""",21,"""333C8F3AF41322E0"""
+"""370F8EABA1A326F8_246799F1AA0FEEED_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""333C8F3AF41322E0"""
+"""75D92D5C94EC5916_FB79FE5FD007D7C3_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""333C8F3AF41322E0"""
+"""31CAB7AC8CECDBAE_504130C604974AEF_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""333C8F3AF41322E0"""
+"""BF6694E9B8469544_102D809601AD9351_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""333C8F3AF41322E0"""
+"""C33177318CBC0A5A_B8621A42FAB08C39_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N2[S](CCN(C)CC2)(=O)=O""",21,"""333C8F3AF41322E0"""
+"""02653E4B1B249708_34F53CCF921967DA_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N2CC(=O)NCC[S]2(=O)=O""",21,"""333C8F3AF41322E0"""
+"""8F906BE00114A7EC_610E21C63FBCA04E_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N2[S](CCCCC2C)(=O)=O""",21,"""333C8F3AF41322E0"""
+"""711A027AEE880A0D_1BA6640A915C4FB0_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(CCN)[S](=O)(=O)C2CC2""",21,"""333C8F3AF41322E0"""
+"""5C28C92CD6A47460_7D5C42CB3570DD47_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(CCN)[S](=O)(=O)C(F)F""",21,"""333C8F3AF41322E0"""
+"""8E4296BE78135CBA_DD59DEAE0B7B23A5_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N([S](CC)(=O)=O)C2CNC2""",21,"""333C8F3AF41322E0"""
+"""8CF873F97094DB99_EFC00A929C9277D8_6036_DP""","""CC(C1=C(N=C(C=C1)CN)C)N3CC2(CNC2)C[S]3(=O)=O""",21,"""333C8F3AF41322E0"""
+"""E11E5F1E00CB9898_55B57300455133B2_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""333C8F3AF41322E0"""
+"""CB8B49F507E2FFC3_A95EEB504C332302_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""333C8F3AF41322E0"""
+"""4DAAB253C0BF250F_973F8CE7810DEB99_6036_UN""","""CC(C1=C(N=C(C=C1)CN)C)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""333C8F3AF41322E0"""
+"""BBFB8B86A59F34C9_CD7C1F4678698913_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](CCN)(=O)=O)C2CC2""",21,"""33B461A9A692E40B"""
+"""4DC446060CB95BC0_5605CFCCD5CA86BD_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C(C)C)[S](=O)(=O)CCN""",21,"""33B461A9A692E40B"""
+"""10BC73444659A9A6_018A23793B8AA5E1_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](C)(=O)=O)CCN=C=S""",21,"""33B461A9A692E40B"""
+"""F47749150751404C_1C9C22C17522DC29_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](CC)(=O)=O)CCCN""",21,"""33B461A9A692E40B"""
+"""5CCA0278CB56256C_9643872C83F6E908_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](C)(=O)=O)C2CC(C2)N""",21,"""33B461A9A692E40B"""
+"""920C44B1E6A6E9BD_D0998F2BB3C36B89_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(CCCN)[S](=O)(=O)CCl""",21,"""33B461A9A692E40B"""
+"""0E3F628A25C2A1C1_2578036D6151FEC8_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C)[S](=O)(=O)C2CNCC2""",21,"""33B461A9A692E40B"""
+"""9FECCB6832A3DEB8_9B20087ADEBE5B0C_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](CC)(=O)=O)CCCBr""",21,"""33B461A9A692E40B"""
+"""051311437968C184_2FFA897A7BB0D882_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(CCCNC)[S](=O)(=O)C""",21,"""33B461A9A692E40B"""
+"""6FF5B21C75178DCC_CA97811CF279C2DA_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""33B461A9A692E40B"""
+"""0A69FA9B1BA08473_98DCEB07AE461112_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](=O)(=O)CC#N)C2CC2""",21,"""33B461A9A692E40B"""
+"""47BC733CDDFA99C4_1B08807146E05305_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""33B461A9A692E40B"""
+"""49A139C61E838551_DD0ED781A2BEE7F6_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""33B461A9A692E40B"""
+"""DF4D96B8D4ECA395_7FA88A18B2F1F5B7_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""33B461A9A692E40B"""
+"""8A72FC89E0FEA80C_B2CFD1516DBFD5E8_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""33B461A9A692E40B"""
+"""2F5DEB837BEAC495_46B27EE6A2BF8541_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""33B461A9A692E40B"""
+"""EFA8BFF720FE73AE_4C4699E63EC4BD47_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""33B461A9A692E40B"""
+"""C10435D54CE11F6E_4E68CCC73CCF0D6C_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""33B461A9A692E40B"""
+"""5118CB2A7CA56264_DDAAD38BE637D688_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""33B461A9A692E40B"""
+"""5E7E7F7F05A0CEE0_0D1BE42DE04AD2AC_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""33B461A9A692E40B"""
+"""D307C89C0C9A4014_4714839C77845521_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""33B461A9A692E40B"""
+"""A927A2866B45EAEB_AB291DFE7DAEF12E_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""33B461A9A692E40B"""
+"""3DE54DF3FB6D7843_A2C4A99AD6FBDC94_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](=O)(=O)C2CC2)CC#C""",21,"""33B461A9A692E40B"""
+"""5D84576749CEBACC_F6C4B31131F51952_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""33B461A9A692E40B"""
+"""EEAFB5BA113C73B5_DEAFFCEC14F155BA_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N2CCCC(C)(C)[S]2(=O)=O""",21,"""33B461A9A692E40B"""
+"""6285CA0F313D6936_158607B89D379EA9_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N2CCCC(CC)[S]2(=O)=O""",21,"""33B461A9A692E40B"""
+"""BE7A9DE73AB65840_24EF7762F88E2806_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""33B461A9A692E40B"""
+"""0CFB034FA217755E_FBF110CC82861128_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""33B461A9A692E40B"""
+"""69AD974D54E1A227_50C9DE5556168C04_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""33B461A9A692E40B"""
+"""09F7524150CAF09D_10A56E05532C55BA_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""33B461A9A692E40B"""
+"""467B54CF80EE9686_B8EAF4D1A8314AD2_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N2[S](CCN(C)CC2)(=O)=O""",21,"""33B461A9A692E40B"""
+"""2F38E59C0581FCAF_347DD25CC098A131_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N2CC(=O)NCC[S]2(=O)=O""",21,"""33B461A9A692E40B"""
+"""4F9ED987F5B0DD31_6186CF556D3D66A5_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N2[S](CCCCC2C)(=O)=O""",21,"""33B461A9A692E40B"""
+"""593BB63A3C469331_1B2E8A99C3DD895B_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(CCN)[S](=O)(=O)C2CC2""",21,"""33B461A9A692E40B"""
+"""892D1B41D175B731_7DD4AC5867F11BAC_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(CCN)[S](=O)(=O)C(F)F""",21,"""33B461A9A692E40B"""
+"""B524CEC2DA521C56_DDD1303D59FAE54E_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N([S](CC)(=O)=O)C2CNC2""",21,"""33B461A9A692E40B"""
+"""7D182FF939DC87E9_EF48E401CE13B133_6036_DP""","""C(C1C(CCNC1)C(F)(F)F)N3CC2(CNC2)C[S]3(=O)=O""",21,"""33B461A9A692E40B"""
+"""D89658EFE54839BB_553D9D9317D0F559_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""33B461A9A692E40B"""
+"""06C7821994419E07_A9D605C31EB2E5E9_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""33B461A9A692E40B"""
+"""2463780577826ED7_97B76274D38C2D72_6036_UN""","""C(C1C(CCNC1)C(F)(F)F)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""33B461A9A692E40B"""
+"""E599DCF7FF08FD11_359C2F1F1A99783F_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=CC=C2)OC3CCCC3""",21,"""346C7E4BEB0281E3"""
+"""09FB9E40C26AA6D9_9AEBD733E189D4C3_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=C(OCC)C=C2)OCC""",21,"""346C7E4BEB0281E3"""
+"""347EBB9E029CAD6F_66EBA0F47E6223E9_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=CC(=C2)OCCC(C)C""",21,"""346C7E4BEB0281E3"""
+"""4902C5A1CD5C6BA7_3AD158A2ED4E15ED_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""346C7E4BEB0281E3"""
+"""E24F0F509717662E_09F937636A20E345_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=C(C=C2)OC3CCOC3""",21,"""346C7E4BEB0281E3"""
+"""D85174BBB5832BD7_C218D317B25717B6_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""346C7E4BEB0281E3"""
+"""D9B6B38454045936_1A77F71BE693063E_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=CC(=C2)COCCOC""",21,"""346C7E4BEB0281E3"""
+"""62BA1852934AE8DC_931A7A1AE82F0D52_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""346C7E4BEB0281E3"""
+"""68892ADD3C2DB6AE_8C016EF9DF65EA37_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=CC(=C2)OC(COC)C""",21,"""346C7E4BEB0281E3"""
+"""575354497062105C_DE4096CD54D04A1B_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""346C7E4BEB0281E3"""
+"""983A2B1DE0EE0AAA_CBB970F9CFADEB59_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""346C7E4BEB0281E3"""
+"""8880F6C098865194_B2021FD53897D724_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=CC=C2)CN3CCCC3""",21,"""346C7E4BEB0281E3"""
+"""8522A4F9F336F5DD_AB263BD750FB38A4_6004_UN""","""CC1=C(C(=C(S1)C)CN)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""346C7E4BEB0281E3"""
+"""986D037027F6ED64_D6D26435D7ED89CD_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=CC(=C2)OCCN(C)C""",21,"""346C7E4BEB0281E3"""
+"""6EA34FF6FDAFD855_210FA8F7468F2AF6_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""346C7E4BEB0281E3"""
+"""556F85D5D00C6FC3_16289073B1E52942_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""346C7E4BEB0281E3"""
+"""4FAAE482411931C0_C4E46EF79BEA03F1_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""346C7E4BEB0281E3"""
+"""3C95D3E17A81ABB4_1431A07F6EB037E2_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""346C7E4BEB0281E3"""
+"""BA18C81D0E1706B9_3BA494307D975527_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""346C7E4BEB0281E3"""
+"""621D4B0510A52942_3E9F6A95A1A7870E_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""346C7E4BEB0281E3"""
+"""B231B36B2E7D8486_FB64CC62C1271B3A_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""346C7E4BEB0281E3"""
+"""7B79C8A453304839_EB485C331EC9AFCE_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""346C7E4BEB0281E3"""
+"""117FB8429302103D_365B050AB06A5BB4_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""346C7E4BEB0281E3"""
+"""7E0810763C4725D2_A628E1702997D161_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""346C7E4BEB0281E3"""
+"""35B67A765A4E3ADA_830951C3C9981FBA_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""346C7E4BEB0281E3"""
+"""4BE77A861DFE8334_E5F4E182E011AEDA_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=C(OCCC(C)C)C=C2""",21,"""346C7E4BEB0281E3"""
+"""C1B892884B46F605_189982941E5B3E8A_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=C(C=C2)OC3CCCC3""",21,"""346C7E4BEB0281E3"""
+"""7DEF9C474718F0EB_99AF5B6AA9A0565E_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""346C7E4BEB0281E3"""
+"""896A6390AF4EECFF_ECD03958D38CF2E9_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""346C7E4BEB0281E3"""
+"""B53FCA92D324F0C9_1337FED4048D0C04_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""346C7E4BEB0281E3"""
+"""6805D183E07CF7A5_E4B017212FF4211A_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""346C7E4BEB0281E3"""
+"""8982F8AD8EA11B8F_92BB393DE7982671_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""346C7E4BEB0281E3"""
+"""47A382172768D6C6_578BA8077E7C4F0E_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""346C7E4BEB0281E3"""
+"""39471A1F071AB636_3DEF9D21814A446E_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""346C7E4BEB0281E3"""
+"""C3FB50DCD8024393_4CD42F549041CA9D_6004_UN""","""CC1=C(C(=C(S1)C)CN)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""346C7E4BEB0281E3"""
+"""67BA36FA88A107C6_FE1FC3215208C3DF_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""346C7E4BEB0281E3"""
+"""7653A30D81D13F7F_8BD151A968A453ED_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""346C7E4BEB0281E3"""
+"""FC7C942F6BD4212A_D82D09F056D6F2FC_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(C=CC=C2)CN3CCCC3""",21,"""346C7E4BEB0281E3"""
+"""23367E3D94ED66F8_40F95971EA641146_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=CC(=N[N]2C3CCCCO3)C""",21,"""346C7E4BEB0281E3"""
+"""25ACA06F5FB00A36_4AFE7372B319F5BB_6004_UN""","""CC1=C(C(=C(S1)C)CN)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""346C7E4BEB0281E3"""
+"""48AE8E530F1165E2_CBE3678815CD3349_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](CCN)(=O)=O)C2CC2""",21,"""352B1967CB365E51"""
+"""CF1B5E610550B15B_509AB702B86E3CE7_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C(C)C)[S](=O)(=O)CCN""",21,"""352B1967CB365E51"""
+"""9234006296721E82_07155BB7562E1FBB_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](C)(=O)=O)CCN=C=S""",21,"""352B1967CB365E51"""
+"""424017AB5E5902D3_1A035A0F18866673_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](CC)(=O)=O)CCCN""",21,"""352B1967CB365E51"""
+"""66C8103416E8748E_90DCFFE2EE525352_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](C)(=O)=O)C2CC(C2)N""",21,"""352B1967CB365E51"""
+"""4CA0D336AD0D3B2A_D606F7E5DE67D1D3_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(CCCN)[S](=O)(=O)CCl""",21,"""352B1967CB365E51"""
+"""30BCA6077124D332_23E77BA30CF54492_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C)[S](=O)(=O)C2CNCC2""",21,"""352B1967CB365E51"""
+"""3401BEC45A1468E0_9DBF70B4B31AE156_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](CC)(=O)=O)CCCBr""",21,"""352B1967CB365E51"""
+"""36ED3E21E053E869_2965F1B4161462D8_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(CCCNC)[S](=O)(=O)C""",21,"""352B1967CB365E51"""
+"""DF8018895532F8C1_CC08F9D29FDD7880_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""352B1967CB365E51"""
+"""65046EBE178A2311_9E4393C9C3E2AB48_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](=O)(=O)CC#N)C2CC2""",21,"""352B1967CB365E51"""
+"""A4F6C0F88C6825BD_1D97F8BF2B44E95F_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""352B1967CB365E51"""
+"""FD114B9658831120_DB91AF4FCF1A5DAC_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""352B1967CB365E51"""
+"""34CCC258E854B859_7937F2D6DF554FED_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""352B1967CB365E51"""
+"""F84B22B2820454A3_B450A99F001B6FB2_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""352B1967CB365E51"""
+"""2F3270DB2826BFA4_402D0628CF1B3F1B_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""352B1967CB365E51"""
+"""E86FBADF186A9078_4AD9E1285360071D_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""352B1967CB365E51"""
+"""991FB60A29554BE0_48F7B409516BB736_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""352B1967CB365E51"""
+"""A2F08961AAC1D985_DB35AB458B936CD2_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""352B1967CB365E51"""
+"""003C9A3D5243D718_0B849CE38DEE68F6_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""352B1967CB365E51"""
+"""A8ECC266BC3DEE65_418BFB521A20EF7B_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""352B1967CB365E51"""
+"""F56ADB6C3D190284_ADB66530100A4B74_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""352B1967CB365E51"""
+"""FA29AC9FCB0577FD_A45BD154BB5F66CE_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](=O)(=O)C2CC2)CC#C""",21,"""352B1967CB365E51"""
+"""A1BD62476614B0F7_F05BCBDF5C51A308_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""352B1967CB365E51"""
+"""1D0F384899F6E67D_D83084227955EFE0_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N2CCCC(C)(C)[S]2(=O)=O""",21,"""352B1967CB365E51"""
+"""63EE4CBAA472A4CA_13197F76F09324F3_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N2CCCC(CC)[S]2(=O)=O""",21,"""352B1967CB365E51"""
+"""7A95FECB96D6DCFE_22700FAC952A925C_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""352B1967CB365E51"""
+"""1FDB60BAA90DDA07_FD6E6802EF22AB72_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""352B1967CB365E51"""
+"""E24D1BF61064C7EE_5656A69B3BB2365E_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""352B1967CB365E51"""
+"""5109D954F38BB0F4_163A16CB3E88EFE0_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""352B1967CB365E51"""
+"""15DBFAC56DAC842E_BE758C1FC595F088_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N2[S](CCN(C)CC2)(=O)=O""",21,"""352B1967CB365E51"""
+"""053CA18E9E872681_32E2AA92AD3C1B6B_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N2CC(=O)NCC[S]2(=O)=O""",21,"""352B1967CB365E51"""
+"""405173E89812F845_6719B79B0099DCFF_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N2[S](CCCCC2C)(=O)=O""",21,"""352B1967CB365E51"""
+"""4E4A6AA19246533E_1DB1F257AE793301_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(CCN)[S](=O)(=O)C2CC2""",21,"""352B1967CB365E51"""
+"""355A37A773F68BAF_7B4BD4960A55A1F6_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(CCN)[S](=O)(=O)C(F)F""",21,"""352B1967CB365E51"""
+"""A8A0C57919A5A0DA_DB4E48F3345E5F14_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N([S](CC)(=O)=O)C2CNC2""",21,"""352B1967CB365E51"""
+"""F5678B097238500B_E9D79CCFA3B70B69_6036_DP""","""CC(N)C(C1=CC=C(C=C1)F)N3CC2(CNC2)C[S]3(=O)=O""",21,"""352B1967CB365E51"""
+"""AF0804BB2D000E52_53A2E55D7A744F03_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""352B1967CB365E51"""
+"""8678340B1DBDB78D_AF497D0D73165FB3_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""352B1967CB365E51"""
+"""F71952B63D79C309_91281ABABE289728_6036_UN""","""CC(N)C(C1=CC=C(C=C1)F)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""352B1967CB365E51"""
+"""2972128190FAA3A4_346ABAC3A09459F6_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=CC=C2)OC3CCCC3)F""",21,"""359AEB97510FA02A"""
+"""515165ED531D7507_9B1D42EF5B84F50A_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=C(OCC)C=C2)OCC)F""",21,"""359AEB97510FA02A"""
+"""AB5F8624A66470CE_671D3528C46F0220_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=CC(=C2)OCCC(C)C)F""",21,"""359AEB97510FA02A"""
+"""EA0B8C42843F7D36_3B27CD7E57433424_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3)F""",21,"""359AEB97510FA02A"""
+"""C4D9B13B07BD7912_080FA2BFD02DC28C_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=C(C=C2)OC3CCOC3)F""",21,"""359AEB97510FA02A"""
+"""235AFC9B29B89B24_C3EE46CB085A367F_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C)F""",21,"""359AEB97510FA02A"""
+"""BC0F46801381495F_1B8162C75C9E27F7_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=CC(=C2)COCCOC)F""",21,"""359AEB97510FA02A"""
+"""CD492161E0EB57A8_92ECEFC652222C9B_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3)F""",21,"""359AEB97510FA02A"""
+"""4DCB80A9DF29F177_8DF7FB256568CBFE_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=CC(=C2)OC(COC)C)F""",21,"""359AEB97510FA02A"""
+"""5BD4E583A2FD1360_DFB60311EEDD6BD2_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F)F""",21,"""359AEB97510FA02A"""
+"""5D6BAF8FB4F3EEE8_CA4FE52575A0CA90_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F)F""",21,"""359AEB97510FA02A"""
+"""47C43F92449E8C76_B3F48A09829AF6ED_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=CC=C2)CN3CCCC3)F""",21,"""359AEB97510FA02A"""
+"""DF88A1C4114696CF_AAD0AE0BEAF6196D_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3)F""",21,"""359AEB97510FA02A"""
+"""8BB24EBFDDA7002B_D724F1E96DE0A804_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=CC(=C2)OCCN(C)C)F""",21,"""359AEB97510FA02A"""
+"""3537D904FBD51CF6_20F93D2BFC820B3F_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C)F""",21,"""359AEB97510FA02A"""
+"""9E622912BC5981CD_17DE05AF0BE8088B_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3)F""",21,"""359AEB97510FA02A"""
+"""09DE614FBEC1DA43_C512FB2B21E72238_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F)F""",21,"""359AEB97510FA02A"""
+"""37EF2F98B736931E_15C735A3D4BD162B_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F)F""",21,"""359AEB97510FA02A"""
+"""760E4773F46BBAAB_3A5201ECC79A74EE_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F)F""",21,"""359AEB97510FA02A"""
+"""9561693DB7EC8B69_3F69FF491BAAA6C7_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O)F""",21,"""359AEB97510FA02A"""
+"""CC49964936B689D8_FA9259BE7B2A3AF3_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F)F""",21,"""359AEB97510FA02A"""
+"""0B6BC75B678594CE_EABEC9EFA4C48E07_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)F""",21,"""359AEB97510FA02A"""
+"""330A2F58E47E974F_37AD90D60A677A7D_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3)F""",21,"""359AEB97510FA02A"""
+"""E45D0D3F2381C70E_A7DE74AC939AF0A8_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F)F""",21,"""359AEB97510FA02A"""
+"""79FF879BAAC7A0E3_82FFC41F73953E73_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F)F""",21,"""359AEB97510FA02A"""
+"""0725AF54CC005851_E402745E5A1C8F13_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=C(OCCC(C)C)C=C2)F""",21,"""359AEB97510FA02A"""
+"""7F570987A9861FD8_196F1748A4561F43_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=C(C=C2)OC3CCCC3)F""",21,"""359AEB97510FA02A"""
+"""6E7A52F128C25E22_9859CEB613AD7797_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C)F""",21,"""359AEB97510FA02A"""
+"""750D6F68D4B35EA1_ED26AC846981D320_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC)F""",21,"""359AEB97510FA02A"""
+"""297D4CC8D46A3817_12C16B08BE802DCD_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(C)C=C(C=C2)OCC3CC3)F""",21,"""359AEB97510FA02A"""
+"""2CCA78C222F10251_E54682FD95F900D3_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F)F""",21,"""359AEB97510FA02A"""
+"""F3EC5D3D7978F335_934DACE15D9507B8_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(OCC(C)(C)C)N=CC=C2)F""",21,"""359AEB97510FA02A"""
+"""F57F68BEE6C6460B_567D3DDBC4716EC7_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3)F""",21,"""359AEB97510FA02A"""
+"""5F2BFE2C3C853585_3C1908FD3B4765A7_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O)F""",21,"""359AEB97510FA02A"""
+"""4C98AA38B9A83A6A_4D22BA882A4CEB54_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3)F""",21,"""359AEB97510FA02A"""
+"""18E88FBA52D3E3DE_FFE956FDE805E216_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC)F""",21,"""359AEB97510FA02A"""
+"""3CB546C18E727F1D_8A27C475D2A97224_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3)F""",21,"""359AEB97510FA02A"""
+"""2CCBCF5C85A490FF_D9DB9C2CECDBD335_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(C=CC=C2)CN3CCCC3)F""",21,"""359AEB97510FA02A"""
+"""F2A24C0C43ED9AAE_410FCCAD5069308F_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=CC(=N[N]2C3CCCCO3)C)F""",21,"""359AEB97510FA02A"""
+"""921E6AF9D9DDB689_4B08E6AE0914D472_6005_UN""","""FC1=C(C(=C(C=C1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F)F""",21,"""359AEB97510FA02A"""
+"""56659E1E9BEC8C37_36FE5BB2614C46A7_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=CC=C3)OC4CCCC4""",21,"""370E0AE690D7BF7B"""
+"""131AF0983F0B4B29_9989A39E9A5CEA5B_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=C(OCC)C=C3)OCC""",21,"""370E0AE690D7BF7B"""
+"""6A2A9E156D3A90B5_6589D45905B71D71_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=CC(=C3)OCCC(C)C""",21,"""370E0AE690D7BF7B"""
+"""6778898709BC6B34_39B32C0F969B2B75_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""370E0AE690D7BF7B"""
+"""D66AD737078D0E87_0A9B43CE11F5DDDD_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=C(C=C3)OC4CCOC4""",21,"""370E0AE690D7BF7B"""
+"""A513DC840F1C6BA5_C17AA7BAC982292E_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""370E0AE690D7BF7B"""
+"""424870E1EA34DC4C_191583B69D4638A6_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=CC(=C3)COCCOC""",21,"""370E0AE690D7BF7B"""
+"""9AAC0C0C7D92E91A_90780EB793FA33CA_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""370E0AE690D7BF7B"""
+"""9388CC423A891704_8F631A54A4B0D4AF_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=CC(=C3)OC(COC)C""",21,"""370E0AE690D7BF7B"""
+"""B102AE27209400E2_DD22E2602F057483_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""370E0AE690D7BF7B"""
+"""0AD4D0F745438C71_C8DB0454B478D5C1_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""370E0AE690D7BF7B"""
+"""58869CEFD0BC0193_B1606B784342E9BC_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=CC=C3)CN4CCCC4""",21,"""370E0AE690D7BF7B"""
+"""B97FE2CE2034CE1B_A8444F7A2B2E063C_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""370E0AE690D7BF7B"""
+"""F5FCB5FA20B9C2DA_D5B01098AC38B755_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=CC(=C3)OCCN(C)C""",21,"""370E0AE690D7BF7B"""
+"""2330F9DE460A4492_226DDC5A3D5A146E_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""370E0AE690D7BF7B"""
+"""FC2B417B60658040_154AE4DECA3017DA_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""370E0AE690D7BF7B"""
+"""45F8B17FE6E780E0_C7861A5AE03F3D69_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""370E0AE690D7BF7B"""
+"""963F0CAFCC8CE1A9_1753D4D21565097A_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""370E0AE690D7BF7B"""
+"""F0D72C8A018FBEFB_38C6E09D06426BBF_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""370E0AE690D7BF7B"""
+"""27667A98CC187188_3DFD1E38DA72B996_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""370E0AE690D7BF7B"""
+"""5306039C0B198DAB_F806B8CFBAF225A2_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""370E0AE690D7BF7B"""
+"""687F6477E3FD79BC_E82A289E651C9156_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""370E0AE690D7BF7B"""
+"""14BBD5699268ED77_353971A7CBBF652C_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""370E0AE690D7BF7B"""
+"""586DA09B3C315805_A54A95DD5242EFF9_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""370E0AE690D7BF7B"""
+"""042DFA4C29E14A65_806B256EB24D2122_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""370E0AE690D7BF7B"""
+"""92BC93B686AE2A03_E696952F9BC49042_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=C(OCCC(C)C)C=C3""",21,"""370E0AE690D7BF7B"""
+"""2254B8AFF21D1AE3_1BFBF639658E0012_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=C(C=C3)OC4CCCC4""",21,"""370E0AE690D7BF7B"""
+"""AF30D6CCFF3ECA6E_9ACD2FC7D27568C6_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""370E0AE690D7BF7B"""
+"""AFD864AD6F32180B_EFB24DF5A859CC71_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""370E0AE690D7BF7B"""
+"""562F713531222201_10558A797F58329C_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""370E0AE690D7BF7B"""
+"""E23C860D29C8F2AD_E7D2638C54211F82_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""370E0AE690D7BF7B"""
+"""DCF4C54A6C8D902E_91D94D909C4D18E9_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""370E0AE690D7BF7B"""
+"""41252A2B927291D7_54E9DCAA05A97196_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""370E0AE690D7BF7B"""
+"""05533E9A77074135_3E8DE98CFA9F7AF6_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""370E0AE690D7BF7B"""
+"""979AE5D6C9C6371D_4FB65BF9EB94F405_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""370E0AE690D7BF7B"""
+"""629F2A659A67DE27_FD7DB78C29DDFD47_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""370E0AE690D7BF7B"""
+"""A7B06CC2CDBE9BC7_88B3250413716D75_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""370E0AE690D7BF7B"""
+"""C07DFA551AA5B177_DB4F7D5D2D03CC64_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(C=CC=C3)CN4CCCC4""",21,"""370E0AE690D7BF7B"""
+"""32231198553330E3_439B2DDC91B12FDE_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""370E0AE690D7BF7B"""
+"""24F718C388CFD605_499C07DFC8CCCB23_6005_UN""","""C1(=NC2=C(C=C1)C=C[NH]2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""370E0AE690D7BF7B"""
+"""D97490F0FE40FDEB_9D21AD37B3C10A51_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N3CCC[S]3(=O)=O""",21,"""373A6A0089D43456"""
+"""1AAB4A6B919EDA6C_B248E37F3701A373_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N([S](CC)(=O)=O)C""",21,"""373A6A0089D43456"""
+"""388D5A6E8A844E74_B8369F618BC73A70_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N[S](=O)(=O)C3CC3""",21,"""373A6A0089D43456"""
+"""6854882E412A7400_A47046D73F4BD85A_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N(CC)[S](=O)(=O)C""",21,"""373A6A0089D43456"""
+"""E9ABE11B92FE5A62_D82B7D93C4E1DC77_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N[S](=O)(=O)CC=C""",21,"""373A6A0089D43456"""
+"""7F5E73E0F4979038_ADDBB66420AB6F28_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N[S](=O)(=O)CC#N""",21,"""373A6A0089D43456"""
+"""1605557C39285120_4730CCD3E1A91824_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N[S](C(C)=C)(=O)=O""",21,"""373A6A0089D43456"""
+"""45E18FB97B38E4D4_E87E1331E0C48B6C_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N(C)[S](=O)(=O)C=C""",21,"""373A6A0089D43456"""
+"""355EF970EC5874B7_2534343874D9EA29_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N[S](=O)(=O)CCO""",21,"""373A6A0089D43456"""
+"""085D2D3026D550F4_03DFAA8388555FB1_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N3[S](=O)(=O)C=CC3""",21,"""373A6A0089D43456"""
+"""355EF970EC5874B7_48CA228A99A7ADEC_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N[S](CCO)(=O)=O""",21,"""373A6A0089D43456"""
+"""57ABC820DEA35E9C_F1B2C6BF55470FDF_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N[S](CCC)(=O)=O""",21,"""373A6A0089D43456"""
+"""B15129BEC2002512_79982405CA900CA2_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N[S](C(C)C)(=O)=O""",21,"""373A6A0089D43456"""
+"""7BDB0DDBF5A57AA6_F31F1D297CCC50D0_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N[S](=O)(=O)CCCl""",21,"""373A6A0089D43456"""
+"""286A0AF496EA4072_7E8E7085E9319946_6043_DP""","""N1CCC(CC1)C(O)C2=CC(=CC=C2)N3CC(C)[S]3(=O)=O""",21,"""373A6A0089D43456"""
+"""1E52392820B7F1B1_3049BB83C8DEF43A_6035_DP""","""N1CCC(CC1)C(OC2=NOC(=C2)C)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""6521FD8D36860D83_DDE1BD35806B3BE7_6035_DP""","""N1CCC(CC1)C(OC2=NC=NC=C2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""ED4CF5EA3921FBB0_98D5761B68B24E22_6035_DP""","""N1CCC(CC1)C(OC2=NSN=C2Cl)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""3AFA431F1CD2F2AE_2D4761DA6EA5EA47_6035_DP""","""N1CCC(CC1)C(OC2=C[N](C)N=C2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""AFC9CBD8D8306A36_DE7BFB14F49B9A7A_6035_DP""","""N1CCC(CC1)C(OC2=CN=CC=C2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""17DB1D5A09AD002E_D793BE555D6AE2EB_6035_DP""","""N1CCC(CC1)C(OC2=NC=C(C)S2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""9071267B91D00F5D_FD01200E7F9AC19F_6035_DP""","""N1CCC(CC1)C(OC2=CC=NC=C2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""A8B77C80720726ED_1A7114C49FDC3032_6035_DP""","""N1CCC(CC1)C(OC2=NN=C(S)[NH]2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""EC86C90713AD408F_ADBB5AD3F272B28A_6035_DP""","""N1CCC(CC1)C(OC2=NN=C(Cl)[NH]2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""CCEE22E6634820C5_08EC1AC502388376_6035_DP""","""N1CCC(CC1)C(OC2=NC=CN=C2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""061DC836015B9C47_5ABD561023834E22_6035_DP""","""N1CCC(CC1)C(OC2=NC(=N[NH]2)Br)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""124058344D0E55F6_234B8DA1B14ED857_6035_DP""","""N1CCC(CC1)C(OC2=N[NH]C(=N2)C)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""52BDBAF6DDAB52C2_6CDCEC1BE2080E5D_6035_DP""","""N1CCC(CC1)C(OC2=NN=C(C)S2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""7307957C463A611D_E7D65167E4FDA45C_6035_DP""","""N1CCC(CC1)C(OC2=CN=NC=C2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""577FBBA51D2EAB03_B6C558A64EF14B9B_6035_DP""","""N1CCC(CC1)C(OC2=CC(=NO2)C)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""470033B78AE5BC05_B62DED52C909093E_6035_DP""","""N1CCC(CC1)C(OC2=NOC=C2Br)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""F9A6981333442F03_E032F9D40710FE32_6035_DP""","""N1CCC(CC1)C(OC2=NC=CC=C2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""98C38A42A78803AC_45B798BED2EB0276_6035_DP""","""N1CCC(CC1)C(OC2=NN=N[N]2C)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""598A093F266C9362_88E99CDE9897F911_6035_DP""","""N1CCC(CC1)C(OC2=CC=CC=C2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""50A82D7EDF8470CA_32660A767E9BCB56_6035_DP""","""N1CCC(CC1)C(OC2=CN=C(C)O2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""F7F4CB410A2A7F47_4E01746ECE2F0653_6035_DP""","""N1CCC(CC1)C(OC2=N[N](C)C=C2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""D7B101B64FC5298B_0AF216E493D89B4B_6035_DP""","""N1CCC(CC1)C(OC2=NC(=NO2)N)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""6BD69F1CE801C346_B492A09120366EC5_6035_DP""","""N1CCC(CC1)C(OC2=NSC=C2Br)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""1F3FE1E6048F1AAE_6B617A6F86E32CAF_6035_DP""","""N1CCC(CC1)C(OC2=CC=N[N]2C)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""09CE1C3BF012A369_51543BD1869B4ED3_6035_DP""","""N1CCC(CC1)C(OC2=CN=CN=C2)C3=CC(=CC=C3)Br""",21,"""373A6A0089D43456"""
+"""32D7A432855ABF23_36CC6AE3660156C9_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""373C3BB7979AAF15"""
+"""7C1A347DD6C92B3D_99BB92CF9D11FA35_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""373C3BB7979AAF15"""
+"""AF0320997A48103C_65BBE50802FA0D1F_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""373C3BB7979AAF15"""
+"""D7951D895CF7088F_39811D5E91D63B1B_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""373C3BB7979AAF15"""
+"""15F706B42B9F6882_0AA9729F16B8CDB3_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""373C3BB7979AAF15"""
+"""8B57D6F554BFDF04_C14896EBCECF3940_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""373C3BB7979AAF15"""
+"""2BFE1E825A84DFCD_1927B2E79A0B28C8_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC=CC(=C2)COCCOC""",21,"""373C3BB7979AAF15"""
+"""9E864CDD630485F1_904A3FE694B723A4_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""373C3BB7979AAF15"""
+"""8083FBCF7F4BF68D_8F512B05A3FDC4C1_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""373C3BB7979AAF15"""
+"""6A9C467BF4DA31E2_DD10D331284864ED_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""373C3BB7979AAF15"""
+"""50DA00124F50AFD9_C8E93505B335C5AF_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""373C3BB7979AAF15"""
+"""EB8D838DBC04F327_B1525A29440FF9D2_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""373C3BB7979AAF15"""
+"""1FA8CA1A7DAE9596_A8767E2B2C631652_6005_UN""","""COC1=C(N=CC(=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""373C3BB7979AAF15"""
+"""52FDEF82728D8E7C_D58221C9AB75A73B_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""373C3BB7979AAF15"""
+"""97D8BC6620CCE995_225FED0B3A170400_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""373C3BB7979AAF15"""
+"""DBDD0D9610EE8287_1578D58FCD7D07B4_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""373C3BB7979AAF15"""
+"""6507A2BC409ACE21_C7B42B0BE7722D07_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""373C3BB7979AAF15"""
+"""BE407BDA262CF759_1761E58312281914_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""373C3BB7979AAF15"""
+"""47483917A6E1BC38_38F4D1CC010F7BD1_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""373C3BB7979AAF15"""
+"""C3D36A77067892FE_3DCF2F69DD3FA9F8_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""373C3BB7979AAF15"""
+"""CA01AD75D5F5AD18_F834899EBDBF35CC_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""373C3BB7979AAF15"""
+"""EC56ED1AFE2DEB18_E81819CF62518138_6005_UN""","""COC1=C(N=CC(=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""373C3BB7979AAF15"""
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+"""37BEF3DF3191ACCE_C7C786E6EB89DCBD_6005_UN""","""CC1=CSC(=C1C2=C(C=CC=C2F)OC(F)(F)F)C(=O)O""",21,"""374F965A9B615EAF"""
+"""C33C69656E8200D0_1712486E1ED3E8AE_6005_UN""","""CC1=CSC(=C1C2=CC(=C(C=C2)Cl)OC(F)(F)F)C(=O)O""",21,"""374F965A9B615EAF"""
+"""114059B8A2F58200_38877C210DF48A6B_6005_UN""","""CC1=CSC(=C1C2=C(C=C(OC)C=C2)C(F)(F)F)C(=O)O""",21,"""374F965A9B615EAF"""
+"""725EA0F9124C3844_3DBC8284D1C45842_6005_UN""","""CC1=CSC(=C1C2=CC=CC(=C2F)C(N(C)C)=O)C(=O)O""",21,"""374F965A9B615EAF"""
+"""451B779B06986750_F8472473B144C476_6005_UN""","""CC1=CSC(=C1C2=CC(=C(OC)C=C2)C(F)(F)F)C(=O)O""",21,"""374F965A9B615EAF"""
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+"""E7C44EF6C4B85502_A50B096159F40E2D_6005_UN""","""CC1=CSC(=C1C2=C(OC)C=C(C=C2)C(F)(F)F)C(=O)O""",21,"""374F965A9B615EAF"""
+"""9AF649831BE1940F_802AB9D2B9FBC0F6_6005_UN""","""CC1=CSC(=C1C2=C(C)C=C(C=C2)OC(F)(F)F)C(=O)O""",21,"""374F965A9B615EAF"""
+"""A693CE9A06505EEF_E6D7099390727196_6005_UN""","""CC1=CSC(=C1C2=CC=C(OCCC(C)C)C=C2)C(=O)O""",21,"""374F965A9B615EAF"""
+"""9D9A99B55E6A8614_1BBA6A856E38E1C6_6005_UN""","""CC1=CSC(=C1C2=CC=C(C=C2)OC3CCCC3)C(=O)O""",21,"""374F965A9B615EAF"""
+"""3F1E30067E0D12F6_9A8CB37BD9C38912_6005_UN""","""CC1=CSC(=C1C2=C(C=C(OC)C=C2)CN(C)C)C(=O)O""",21,"""374F965A9B615EAF"""
+"""DFD181FC6B71799C_EFF3D149A3EF2DA5_6005_UN""","""CC1=CSC(=C1C2=CC(=C(N=C2)C(F)(F)F)OC)C(=O)O""",21,"""374F965A9B615EAF"""
+"""837FDE15CDBC7EFF_101416C574EED348_6005_UN""","""CC1=CSC(=C1C2=C(C)C=C(C=C2)OCC3CC3)C(=O)O""",21,"""374F965A9B615EAF"""
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+"""73E14D07980406AC_9198D12C97FBF93D_6005_UN""","""CC1=CSC(=C1C2=C(OCC(C)(C)C)N=CC=C2)C(=O)O""",21,"""374F965A9B615EAF"""
+"""1EEA7E37EF91CEB6_54A840160E1F9042_6005_UN""","""CC1=CSC(=C1C2=CC=C(C=C2)C[N]3C=NC=N3)C(=O)O""",21,"""374F965A9B615EAF"""
+"""999680B20F6B5173_3ECC7530F1299B22_6005_UN""","""CC1=CSC(=C1C2=C(OCC)C=CC(=C2)[N](=O)=O)C(=O)O""",21,"""374F965A9B615EAF"""
+"""7452B61C28D62C2C_4FF7C745E02215D1_6005_UN""","""CC1=CSC(=C1C3=CC2=C(C=C(OC)C=C2)C=C3)C(=O)O""",21,"""374F965A9B615EAF"""
+"""9FD5A1B44800B4DC_FD3C2B30226B1C93_6005_UN""","""CC1=CSC(=C1C2=CC(=C(C=C2C3CC3)Cl)OC)C(=O)O""",21,"""374F965A9B615EAF"""
+"""4BB9ED111DE18FF4_88F2B9B818C78CA1_6005_UN""","""CC1=CSC(=C1C2=CC(=CC=C2)C3=CC=NC=C3)C(=O)O""",21,"""374F965A9B615EAF"""
+"""42EE16EC4EA465E8_DB0EE1E126B52DB0_6005_UN""","""CC1=CSC(=C1C2=C(C=CC=C2)CN3CCCC3)C(=O)O""",21,"""374F965A9B615EAF"""
+"""1E19A83378E58549_43DAB1609A07CE0A_6005_UN""","""CC1=CSC(=C1C2=CC(=N[N]2C3CCCCO3)C)C(=O)O""",21,"""374F965A9B615EAF"""
+"""293CA0AEF86F594B_49DD9B63C37A2AF7_6005_UN""","""CC1=CSC(=C1C2=C(C=C(C=C2)OC(F)(F)F)F)C(=O)O""",21,"""374F965A9B615EAF"""
+"""065ABC602DF1EF16_3605620FBE57680B_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)OC3CCCC3)F""",21,"""37F5335B4FCC91D7"""
+"""3EBB1C99428F7BCF_99729A234547C4F7_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(OCC)C=C2)OCC)F""",21,"""37F5335B4FCC91D7"""
+"""79D522FC0F2B4935_6572EDE4DAAC33DD_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)OCCC(C)C)F""",21,"""37F5335B4FCC91D7"""
+"""1D611FEF4B053C0A_394815B2498005D9_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)C[N]3C=CN=C3)F""",21,"""37F5335B4FCC91D7"""
+"""62B93B699DF8FBEE_0A607A73CEEEF371_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)OC3CCOC3)F""",21,"""37F5335B4FCC91D7"""
+"""AC039CCA914B486D_C1819E0716990782_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(OC)C=C2)CN(C)C)F""",21,"""37F5335B4FCC91D7"""
+"""7B68867010290A98_19EEBA0B425D160A_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)COCCOC)F""",21,"""37F5335B4FCC91D7"""
+"""3355A19DCEC93CB5_9083370A4CE11D66_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)CN(C)C3CC3)F""",21,"""37F5335B4FCC91D7"""
+"""ABBD1EE63AB0D142_8F9823E97BABFA03_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)OC(COC)C)F""",21,"""37F5335B4FCC91D7"""
+"""4BF7C2247F76F9A2_DDD9DBDDF01E5A2F_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(C(NOC)=O)C=C2)F)F""",21,"""37F5335B4FCC91D7"""
+"""DD0D02FBA0266ED5_C8203DE96B63FB6D_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(OC)N=C(C=C2)C(F)(F)F)F""",21,"""37F5335B4FCC91D7"""
+"""D2097E0D22C8CB20_B19B52C59C59C710_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)CN3CCCC3)F""",21,"""37F5335B4FCC91D7"""
+"""CD11E2831C72E654_A8BF76C7F4352890_6005_UN""","""CC1=C(C=C(C(=C1)F)C3=CC=C([N]2C=C(C)C=N2)C=C3)F""",21,"""37F5335B4FCC91D7"""
+"""74386E8D8F9F1006_D54B2925732399F9_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2)OCCN(C)C)F""",21,"""37F5335B4FCC91D7"""
+"""100F1C8DBB4006E1_2296E5E7E2413AC2_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=C(C(C)C)C=C2)C(C)C)F""",21,"""37F5335B4FCC91D7"""
+"""E91D37D1134C12E4_15B1DD63152B3976_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)C3=CC=CC=C3)F""",21,"""37F5335B4FCC91D7"""
+"""3434B02583F3653A_C77D23E73F2413C5_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=CC=C2F)OC(F)(F)F)F""",21,"""37F5335B4FCC91D7"""
+"""E9BFC0D0A1AAF88D_17A8ED6FCA7E27D6_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F)F""",21,"""37F5335B4FCC91D7"""
+"""DA74F84F09D1DB9B_383DD920D9594513_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=C(OC)C=C2)C(F)(F)F)F""",21,"""37F5335B4FCC91D7"""
+"""91469744E81A3FEE_3D0627850569973A_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=CC(=C2F)C(N(C)C)=O)F""",21,"""37F5335B4FCC91D7"""
+"""C43A6DB761C4444C_F8FD817265E90B0E_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(OC)C=C2)C(F)(F)F)F""",21,"""37F5335B4FCC91D7"""
+"""E340F30F2FDB799E_E8D11123BA07BFFA_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)F""",21,"""37F5335B4FCC91D7"""
+"""F89148F953758104_35C2481A14A44B80_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)C3=CC=CC=C3)F""",21,"""37F5335B4FCC91D7"""
+"""671EE0AC16688495_A5B1AC608D59C155_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(OC)C=C(C=C2)C(F)(F)F)F""",21,"""37F5335B4FCC91D7"""
+"""4F14D02FFAD13634_80901CD36D560F8E_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C)C=C(C=C2)OC(F)(F)F)F""",21,"""37F5335B4FCC91D7"""
+"""4126AAB75428A404_E66DAC9244DFBEEE_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(OCCC(C)C)C=C2)F""",21,"""37F5335B4FCC91D7"""
+"""E2DB6A25DFB6735B_1B00CF84BA952EBE_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)OC3CCCC3)F""",21,"""37F5335B4FCC91D7"""
+"""049F477D5AAAFBBF_9A36167A0D6E466A_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=C(OC)C=C2)CN(C)C)F""",21,"""37F5335B4FCC91D7"""
+"""6B0EB1BA7F08765F_EF4974487742E2DD_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(N=C2)C(F)(F)F)OC)F""",21,"""37F5335B4FCC91D7"""
+"""BAFE317EC7CA5F52_10AEB3C4A0431C30_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C)C=C(C=C2)OCC3CC3)F""",21,"""37F5335B4FCC91D7"""
+"""9D6C44DD8BC456B2_E7295A318B3A312E_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=CC(=C2)C3(CC3)C#N)F)F""",21,"""37F5335B4FCC91D7"""
+"""7393121DA777812E_9122742D43563645_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(OCC(C)(C)C)N=CC=C2)F""",21,"""37F5335B4FCC91D7"""
+"""36CA1BB655063FC8_5412E517DAB25F3A_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC=C(C=C2)C[N]3C=NC=N3)F""",21,"""37F5335B4FCC91D7"""
+"""CD6FF4D08BAE2208_3E76D0312584545A_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(OCC)C=CC(=C2)[N](=O)=O)F""",21,"""37F5335B4FCC91D7"""
+"""3A4C3588139BC279_4F4D6244348FDAA9_6005_UN""","""CC1=C(C=C(C(=C1)F)C3=CC2=C(C=C(OC)C=C2)C=C3)F""",21,"""37F5335B4FCC91D7"""
+"""0FECD42D2CA559FE_FD868E31F6C6D3EB_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=C(C=C2C3CC3)Cl)OC)F""",21,"""37F5335B4FCC91D7"""
+"""2D2504E99DA65C9F_88481CB9CC6A43D9_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=CC=C2)C3=CC=NC=C3)F""",21,"""37F5335B4FCC91D7"""
+"""B45E0DBCA66259B7_DBB444E0F218E2C8_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=CC=C2)CN3CCCC3)F""",21,"""37F5335B4FCC91D7"""
+"""2462DCA6C8418832_436014614EAA0172_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=CC(=N[N]2C3CCCCO3)C)F""",21,"""37F5335B4FCC91D7"""
+"""F660EBE9DAF8FDD2_49673E6217D7E58F_6005_UN""","""CC1=C(C=C(C(=C1)F)C2=C(C=C(C=C2)OC(F)(F)F)F)F""",21,"""37F5335B4FCC91D7"""
+"""4BA59EE9F8462C74_39BFEE4005479F4C_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""384FBF14F4DC6690"""
+"""B62A4ADA1EE4BC3A_96C8166CFE5733B0_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""384FBF14F4DC6690"""
+"""1CC324428C7C6F4B_6AC861AB61BCC49A_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""384FBF14F4DC6690"""
+"""F9CEDBF7BF8835E2_36F299FDF290F29E_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""384FBF14F4DC6690"""
+"""A588E38CC5F1E421_05DAF63C75FE0436_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""384FBF14F4DC6690"""
+"""24936373636A06EE_CE3B1248AD89F0C5_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""384FBF14F4DC6690"""
+"""B5AB97441CB674FB_16543644F94DE14D_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=CC(=C2)COCCOC""",21,"""384FBF14F4DC6690"""
+"""4F91420316B87EFE_9F39BB45F7F1EA21_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""384FBF14F4DC6690"""
+"""6E0DF86A687F5247_8022AFA6C0BB0D44_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""384FBF14F4DC6690"""
+"""F29C5048470FD66C_D26357924B0EAD68_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""384FBF14F4DC6690"""
+"""55EDB3AB11ACAAF9_C79AB1A6D0730C2A_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""384FBF14F4DC6690"""
+"""C6871C3C4770184D_BE21DE8A27493057_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""384FBF14F4DC6690"""
+"""FFBBCEBD8468AA9A_A705FA884F25DFD7_6005_UN""","""COC1=C(C=C(N=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""384FBF14F4DC6690"""
+"""FE9030C422770D35_DAF1A56AC8336EBE_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""384FBF14F4DC6690"""
+"""D12C265BDFD5838B_2D2C69A85951CD85_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""384FBF14F4DC6690"""
+"""0E663919A48B2403_1A0B512CAE3BCE31_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""384FBF14F4DC6690"""
+"""2559C972C717960A_C8C7AFA88434E482_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""384FBF14F4DC6690"""
+"""524C0222E9510B1A_18126120716ED091_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""384FBF14F4DC6690"""
+"""92E7FDF5AAA26DB5_3787556F6249B254_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""384FBF14F4DC6690"""
+"""A2C5B6FD686BB79A_32BCABCABE79607D_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""384FBF14F4DC6690"""
+"""7370D8DF65486FD6_F7470D3DDEF9FC49_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""384FBF14F4DC6690"""
+"""9F2373FE36CFF15E_E76B9D6C011748BD_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""384FBF14F4DC6690"""
+"""4230E2D4F70F4942_3A78C455AFB4BCC7_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""384FBF14F4DC6690"""
+"""28C87298A561EC13_AA0B202F36493612_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""384FBF14F4DC6690"""
+"""312E3326B5599DBF_8F2A909CD646F8C9_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""384FBF14F4DC6690"""
+"""169A7043E877862E_E9D720DDFFCF49A9_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""384FBF14F4DC6690"""
+"""BB60C6A419279915_14BA43CB0185D9F9_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""384FBF14F4DC6690"""
+"""380397493729755F_958C9A35B67EB12D_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""384FBF14F4DC6690"""
+"""8179B25E8EA29E01_E0F3F807CC52159A_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""384FBF14F4DC6690"""
+"""B1CB7E16A63C4C3F_1F143F8B1B53EB77_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""384FBF14F4DC6690"""
+"""1316C7E33EA14B90_E893D67E302AC669_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""384FBF14F4DC6690"""
+"""19FE421655BC3546_9E98F862F846C102_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""384FBF14F4DC6690"""
+"""55DAD1D3CD41B96C_5BA8695861A2A87D_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""384FBF14F4DC6690"""
+"""ACD0E01CE068ED7E_31CC5C7E9E94A31D_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""384FBF14F4DC6690"""
+"""3DD856C1D700D4B7_40F7EE0B8F9F2DEE_6005_UN""","""COC1=C(C=C(N=C1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""384FBF14F4DC6690"""
+"""CBE8D84292D9D6DC_F23C027E4DD624AC_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""384FBF14F4DC6690"""
+"""D366F94656AF56FE_87F290F6777AB49E_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""384FBF14F4DC6690"""
+"""FF18387260C2FFC6_D40EC8AF4908158F_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(C=CC=C2)CN3CCCC3""",21,"""384FBF14F4DC6690"""
+"""E346381E835F5F8F_4CDA982EF5BAF635_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=CC(=N[N]2C3CCCCO3)C""",21,"""384FBF14F4DC6690"""
+"""CEA9B63B491CCB76_46DDB22DACC712C8_6005_UN""","""COC1=C(C=C(N=C1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""384FBF14F4DC6690"""
+"""5305F78702E4A2E8_C7BC5DD5D2AB7D5D_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](CCN)(=O)=O)C2CC2)Br""",21,"""3974233A0C501045"""
+"""CA1E090D23E95D14_5CC58D5F7F0872F3_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C(C)C)[S](=O)(=O)CCN)Br""",21,"""3974233A0C501045"""
+"""FC2EAE77494314B9_0B4A61EA914851AF_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](C)(=O)=O)CCN=C=S)Br""",21,"""3974233A0C501045"""
+"""FD482767D15298C8_165C6052DFE02867_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](CC)(=O)=O)CCCN)Br""",21,"""3974233A0C501045"""
+"""5922139B47EC1CF5_9C83C5BF29341D46_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](C)(=O)=O)C2CC(C2)N)Br""",21,"""3974233A0C501045"""
+"""0099EE451487A1A2_DA59CDB819019FC7_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(CCCN)[S](=O)(=O)CCl)Br""",21,"""3974233A0C501045"""
+"""EBC51211D6BEE13A_2FB841FECB930A86_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C)[S](=O)(=O)C2CNCC2)Br""",21,"""3974233A0C501045"""
+"""528448A4DE2A9CF0_91E04AE9747CAF42_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](CC)(=O)=O)CCCBr)Br""",21,"""3974233A0C501045"""
+"""6D200E80DF3C8397_253ACBE9D1722CCC_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(CCCNC)[S](=O)(=O)C)Br""",21,"""3974233A0C501045"""
+"""957A0824DF6DC959_C057C38F58BB3694_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C(C)(C)C#N)[S](=O)(=O)C)Br""",21,"""3974233A0C501045"""
+"""5B83B3F8EBDAAA65_921CA9940484E55C_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](=O)(=O)CC#N)C2CC2)Br""",21,"""3974233A0C501045"""
+"""43FF76CD9D446CBF_11C8C2E2EC22A74B_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](C)(=O)=O)C(=O)CCN)Br""",21,"""3974233A0C501045"""
+"""FDA0EF744DBCD4D2_D7CE9512087C13B8_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C)[S](=O)(=O)C2=CC=CS2)Br""",21,"""3974233A0C501045"""
+"""7FFB3820A5ADDAF1_7568C88B183301F9_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C(C)(C)C)[S](=O)(=O)CCl)Br""",21,"""3974233A0C501045"""
+"""E6A5F073404665EF_B80F93C2C77D21A6_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C(C)(C)C)[S](=O)(=O)CBr)Br""",21,"""3974233A0C501045"""
+"""A7CF9BAC6CE561D0_4C723C75087D710F_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C(C)(C)C#C)[S](=O)(=O)C)Br""",21,"""3974233A0C501045"""
+"""6F135B3A6FF37C77_4686DB7594064909_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(CC(CC)N)[S](=O)(=O)C)Br""",21,"""3974233A0C501045"""
+"""7CA60243308F30E4_44A88E54960DF922_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C)[S](=O)(=O)C2=C[NH]C=N2)Br""",21,"""3974233A0C501045"""
+"""7591384E49DA941E_D76A91184CF522C6_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](C)(=O)=O)CCN=[N]#N)Br""",21,"""3974233A0C501045"""
+"""D3B61A4848404965_07DBA6BE4A8826E2_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(CC(C)(C)N)[S](=O)(=O)C)Br""",21,"""3974233A0C501045"""
+"""BA1D955FACADFEB5_4DD4C10FDD46A16F_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N2[S](CC(C)(C)C2=O)(=O)=O)Br""",21,"""3974233A0C501045"""
+"""359295E0D5A007E0_A1E95F6DD76C0560_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3)Br""",21,"""3974233A0C501045"""
+"""E03197FF00C9690E_A804EB097C3928DA_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](=O)(=O)C2CC2)CC#C)Br""",21,"""3974233A0C501045"""
+"""AF07A0B52C607451_FC04F1829B37ED1C_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N2[S](=O)(=O)C3(CCC2)CC3)Br""",21,"""3974233A0C501045"""
+"""DC14BC4DAE0E4CDE_D46FBE7FBE33A1F4_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N2CCCC(C)(C)[S]2(=O)=O)Br""",21,"""3974233A0C501045"""
+"""6B926CCB0DDF86B9_1F46452B37F56AE7_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N2CCCC(CC)[S]2(=O)=O)Br""",21,"""3974233A0C501045"""
+"""18983BB6F05AACBE_2E2F35F1524CDC48_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N2C(C(N)CC[S]2(=O)=O)=O)Br""",21,"""3974233A0C501045"""
+"""C0EFC9890176289F_F131525F2844E566_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](C)(=O)=O)[C@@H]2CNCC2)Br""",21,"""3974233A0C501045"""
+"""9F6A2E7F6AABF395_5A099CC6FCD4784A_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N2CCCC(Cl)(Cl)[S]2(=O)=O)Br""",21,"""3974233A0C501045"""
+"""CE56089D5E475C82_1A652C96F9EEA1F4_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](C)(=O)=O)[C@H]2CNCC2)Br""",21,"""3974233A0C501045"""
+"""122CF5DE81E98AB1_B22AB64202F3BE9C_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N2[S](CCN(C)CC2)(=O)=O)Br""",21,"""3974233A0C501045"""
+"""C16D060217EE00BD_3EBD90CF6A5A557F_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N2CC(=O)NCC[S]2(=O)=O)Br""",21,"""3974233A0C501045"""
+"""28E1FD61C745CFB7_6B468DC6C7FF92EB_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N2[S](CCCCC2C)(=O)=O)Br""",21,"""3974233A0C501045"""
+"""EFA328BC45AF5448_11EEC80A691F7D15_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(CCN)[S](=O)(=O)C2CC2)Br""",21,"""3974233A0C501045"""
+"""C019F97DD0BA5A59_7714EECBCD33EFE2_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(CCN)[S](=O)(=O)C(F)F)Br""",21,"""3974233A0C501045"""
+"""76DB4314257E49CA_D71172AEF3381100_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N([S](CC)(=O)=O)C2CNC2)Br""",21,"""3974233A0C501045"""
+"""15C94CB4550C248D_E588A69264D1457D_6036_DP""","""COC1=CC(=C(C=C1)[C@H](C)N3CC2(CNC2)C[S]3(=O)=O)Br""",21,"""3974233A0C501045"""
+"""A39DBB5C729932D2_5FFDDF00BD120117_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C)[S](=O)(=O)C2=N[NH]C=N2)Br""",21,"""3974233A0C501045"""
+"""DB51649A7128A236_A3164750B47011A7_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C)[S](=O)(=O)C2=C[NH]N=C2)Br""",21,"""3974233A0C501045"""
+"""8B76E23A74EA0AC4_9D7720E7794ED93C_6036_UN""","""COC1=CC(=C(C=C1)[C@H](C)N(C(C)(C)CN)[S](=O)(=O)C)Br""",21,"""3974233A0C501045"""
+"""EADAC95300445F5B_C74E7CC28DC6C569_6036_UN""","""NCC(CN([S](CCN)(=O)=O)C1CC1)CC2CCCCC2""",21,"""3986022D533DA871"""
+"""5CE19C786E7F58B8_5C37AC482065CAC7_6036_UN""","""NCC(CN(C(C)C)[S](=O)(=O)CCN)CC1CCCCC1""",21,"""3986022D533DA871"""
+"""F5A825D4F273A689_0BB840FDCE25E99B_6036_UN""","""NCC(CN([S](C)(=O)=O)CCN=C=S)CC1CCCCC1""",21,"""3986022D533DA871"""
+"""1BCDD6E28128F5B5_16AE4145808D9053_6036_UN""","""NCC(CN([S](CC)(=O)=O)CCCN)CC1CCCCC1""",21,"""3986022D533DA871"""
+"""DE8375F2B5B8DF58_9C71E4A87659A572_6036_UN""","""NCC(CN([S](C)(=O)=O)C1CC(C1)N)CC2CCCCC2""",21,"""3986022D533DA871"""
+"""AF6EBF2916ACDAF3_DAABECAF466C27F3_6036_UN""","""NCC(CN(CCCN)[S](=O)(=O)CCl)CC1CCCCC1""",21,"""3986022D533DA871"""
+"""C8CB604BA7B71412_2F4A60E994FEB2B2_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1CNCC1)CC2CCCCC2""",21,"""3986022D533DA871"""
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+"""1D0F34DEF17AB653_A11B7E7A8801BD54_6036_UN""","""NCC(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)CC3CCCCC3""",21,"""3986022D533DA871"""
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+"""890D3A3059608C7F_D49D9F68E15E19C0_6036_UN""","""NCC(CN1CCCC(C)(C)[S]1(=O)=O)CC2CCCCC2""",21,"""3986022D533DA871"""
+"""25EA2EF303A4649E_1FB4643C6898D2D3_6036_UN""","""NCC(CN1CCCC(CC)[S]1(=O)=O)CC2CCCCC2""",21,"""3986022D533DA871"""
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+"""FF498D8E616D8BAF_5AFBBDD1A3B9C07E_6036_UN""","""NCC(CN1CCCC(Cl)(Cl)[S]1(=O)=O)CC2CCCCC2""",21,"""3986022D533DA871"""
+"""57C51162304816BD_1A970D81A68319C0_6036_UN""","""NCC(CN([S](C)(=O)=O)[C@H]1CNCC1)CC2CCCCC2""",21,"""3986022D533DA871"""
+"""96A43D2CEA5F36D0_B2D897555D9E06A8_6036_UN""","""NCC(CN1[S](CCN(C)CC1)(=O)=O)CC2CCCCC2""",21,"""3986022D533DA871"""
+"""39ACE36C1B476747_3E4FB1D83537ED4B_6036_UN""","""NCC(CN1CC(=O)NCC[S]1(=O)=O)CC2CCCCC2""",21,"""3986022D533DA871"""
+"""BFC4FE7FCA4B122A_6BB4ACD198922ADF_6036_UN""","""NCC(CN1[S](CCCCC1C)(=O)=O)CC2CCCCC2""",21,"""3986022D533DA871"""
+"""927DBF40A9EE9893_111CE91D3672C521_6036_UN""","""NCC(CN(CCN)[S](=O)(=O)C1CC1)CC2CCCCC2""",21,"""3986022D533DA871"""
+"""C986CF3C1E21C7AE_77E6CFDC925E57D6_6036_UN""","""NCC(CN(CCN)[S](=O)(=O)C(F)F)CC1CCCCC1""",21,"""3986022D533DA871"""
+"""391BC3E6B0948595_D7E353B9AC55A934_6036_UN""","""NCC(CN([S](CC)(=O)=O)C1CNC1)CC2CCCCC2""",21,"""3986022D533DA871"""
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+"""4BC76C112C19D305_A3E46647EB1DA993_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=C[NH]N=C1)CC2CCCCC2""",21,"""3986022D533DA871"""
+"""ED496C5AAE98406B_9D8501F026236108_6036_UN""","""NCC(CN(C(C)(C)CN)[S](=O)(=O)C)CC1CCCCC1""",21,"""3986022D533DA871"""
+"""321297FBAD455E9B_3B7729B78535A225_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=CC=C3)OC4CCCC4""",21,"""3A8778E374AE5BF9"""
+"""8B6A12E9E1D920FE_9400D19B7E250ED9_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=C(OCC)C=C3)OCC""",21,"""3A8778E374AE5BF9"""
+"""D86DE370F428B92C_6800A65CE1CEF9F3_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=CC(=C3)OCCC(C)C""",21,"""3A8778E374AE5BF9"""
+"""D90553DFFA91E05B_343A5E0A72E2CFF7_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""3A8778E374AE5BF9"""
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+"""5282EABC7E086654_CCF3D5BF2DFBCDAC_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""3A8778E374AE5BF9"""
+"""684A76C66FCA6003_149CF1B3793FDC24_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=CC(=C3)COCCOC""",21,"""3A8778E374AE5BF9"""
+"""F7196A03AD5669F1_9DF17CB27783D748_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""3A8778E374AE5BF9"""
+"""24449B0A6D8D85BA_82EA685140C9302D_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=CC(=C3)OC(COC)C""",21,"""3A8778E374AE5BF9"""
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+"""BD6D7EFED98D8CCA_C552765150013143_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""3A8778E374AE5BF9"""
+"""E6CFCA144926416C_BCE9197DA73B0D3E_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=CC=C3)CN4CCCC4""",21,"""3A8778E374AE5BF9"""
+"""D9200354F38AA074_A5CD3D7FCF57E2BE_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""3A8778E374AE5BF9"""
+"""46F16C82D5C7D9A5_D839629D484153D7_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=CC(=C3)OCCN(C)C""",21,"""3A8778E374AE5BF9"""
+"""991366D6CEB0814F_2FE4AE5FD923F0EC_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""3A8778E374AE5BF9"""
+"""B3F86477D80A3217_18C396DB2E49F358_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""3A8778E374AE5BF9"""
+"""336C02EB97A1D2CC_CA0F685F0446D9EB_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""3A8778E374AE5BF9"""
+"""FA50B718827A6133_1ADAA6D7F11CEDF8_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""3A8778E374AE5BF9"""
+"""9EFB79C3A2953D73_354F9298E23B8F3D_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""3A8778E374AE5BF9"""
+"""CDD5EC61CCE327A5_30746C3D3E0B5D14_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""3A8778E374AE5BF9"""
+"""37358EECF89046A9_F58FCACA5E8BC120_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""3A8778E374AE5BF9"""
+"""1E3BF8138C16429E_E5A35A9B816575D4_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""3A8778E374AE5BF9"""
+"""0F2CCFB4162B5F65_38B003A22FC681AE_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""3A8778E374AE5BF9"""
+"""44CCF634F6231FF9_A8C3E7D8B63B0B7B_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""3A8778E374AE5BF9"""
+"""87FF2ADE4ED7B0C5_8DE2576B5634C5A0_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""3A8778E374AE5BF9"""
+"""2227828E24C819FE_EB1FE72A7FBD74C0_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=C(OCCC(C)C)C=C3""",21,"""3A8778E374AE5BF9"""
+"""70C9F92B60E85894_1672843C81F7E490_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=C(C=C3)OC4CCCC4""",21,"""3A8778E374AE5BF9"""
+"""272260A516E77125_97445DC2360C8C44_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""3A8778E374AE5BF9"""
+"""8743021DD34C3B74_E23B3FF04C2028F3_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""3A8778E374AE5BF9"""
+"""BB3B2B080213A912_1DDCF87C9B21D61E_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""3A8778E374AE5BF9"""
+"""311AFA2F65A12D29_EA5B1189B058FB00_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""3A8778E374AE5BF9"""
+"""6908621AFF75119F_9C503F957834FC6B_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""3A8778E374AE5BF9"""
+"""0E2FEB27C7EA073D_5960AEAFE1D09514_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""3A8778E374AE5BF9"""
+"""A05635B01CF6493C_33049B891EE69E74_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""3A8778E374AE5BF9"""
+"""7C3A65A8427FDA84_423F29FC0FED1087_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""3A8778E374AE5BF9"""
+"""7A81147F0B79D1E1_F0F4C589CDA419C5_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""3A8778E374AE5BF9"""
+"""B26CD0224CF287C0_853A5701F70889F7_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""3A8778E374AE5BF9"""
+"""2CB89FDF1F1D4FB8_D6C60F58C97A28E6_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(C=CC=C3)CN4CCCC4""",21,"""3A8778E374AE5BF9"""
+"""D67BCBC98CD96D48_4E125FD975C8CB5C_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""3A8778E374AE5BF9"""
+"""BC87EFB071AF9DF3_441575DA2CB52FA1_6005_UN""","""C2(=NC1=C(C=CC=C1)S2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""3A8778E374AE5BF9"""
+"""470F7A839879FBE9_3B440F64BF9CD1B2_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=CC=C2)OC3CCCC3""",21,"""3AB45E304E07286E"""
+"""EC0C97DB1F8ABECB_9433F748448C7D4E_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=C(OCC)C=C2)OCC""",21,"""3AB45E304E07286E"""
+"""86AA08C541B1B11F_6833808FDB678A64_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=CC(=C2)OCCC(C)C""",21,"""3AB45E304E07286E"""
+"""A028DE4765C54AA9_340978D9484BBC60_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""3AB45E304E07286E"""
+"""D296E68F41ACEE15_07211718CF254AC8_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=C(C=C2)OC3CCOC3""",21,"""3AB45E304E07286E"""
+"""5AD6A59E5DFBECAF_CCC0F36C1752BE3B_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""3AB45E304E07286E"""
+"""E635BD65B00CF3FB_14AFD7604396AFB3_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=CC(=C2)COCCOC""",21,"""3AB45E304E07286E"""
+"""0EA2A87A3EE7762C_9DC25A614D2AA4DF_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""3AB45E304E07286E"""
+"""60C048D43D8DF1CB_82D94E827A6043BA_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=CC(=C2)OC(COC)C""",21,"""3AB45E304E07286E"""
+"""D5E5067B35AE2854_D098B6B6F1D5E396_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""3AB45E304E07286E"""
+"""D8667FCECD834225_C56150826AA842D4_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""3AB45E304E07286E"""
+"""0F1ADA8E744B8F0F_BCDA3FAE9D927EA9_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=CC=C2)CN3CCCC3""",21,"""3AB45E304E07286E"""
+"""08B503760F670CB7_A5FE1BACF5FE9129_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""3AB45E304E07286E"""
+"""1348411A42E3C698_D80A444E72E82040_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=CC(=C2)OCCN(C)C""",21,"""3AB45E304E07286E"""
+"""AFE4728EEB6222CA_2FD7888CE38A837B_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""3AB45E304E07286E"""
+"""09EE6C7401F2AAF0_18F0B00814E080CF_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""3AB45E304E07286E"""
+"""B003B86BE21B2B2C_CA3C4E8C3EEFAA7C_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""3AB45E304E07286E"""
+"""012EE53B94891D8B_1AE98004CBB59E6F_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""3AB45E304E07286E"""
+"""0D9E6D4BE029B2E2_A1663014113A76C1_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""3AB45E304E07286E"""
+"""004563F9F90601C3_357CB44BD892FCAA_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""3AB45E304E07286E"""
+"""F0083BED1EEB49A5_30474AEE04A22E83_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""3AB45E304E07286E"""
+"""5A89CF22280FCD22_F5BCEC196422B2B7_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""3AB45E304E07286E"""
+"""33E51C202A0B4499_E5907C48BBCC0643_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""3AB45E304E07286E"""
+"""91941AD54E4DF34C_38832571156FF239_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""3AB45E304E07286E"""
+"""5B05E16D21170190_A8F0C10B8C9278EC_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""3AB45E304E07286E"""
+"""1673578BA4873563_8DD171B86C9DB637_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""3AB45E304E07286E"""
+"""5203CDCC48B3AF2F_EB2CC1F945140757_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=C(OCCC(C)C)C=C2""",21,"""3AB45E304E07286E"""
+"""8588B96E150F4642_1641A2EFBB5E9707_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=C(C=C2)OC3CCCC3""",21,"""3AB45E304E07286E"""
+"""AA9C404BEDD50204_97777B110CA5FFD3_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""3AB45E304E07286E"""
+"""2771B0DCCD9BD132_E208192376895B64_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""3AB45E304E07286E"""
+"""64371A99D33BB052_1DEFDEAFA188A589_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""3AB45E304E07286E"""
+"""EE6A0A0339431CC0_EA68375A8AF18897_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""3AB45E304E07286E"""
+"""C9FB0C4944657BB3_9C631946429D8FFC_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""3AB45E304E07286E"""
+"""F8FF70F3FE6518BB_5953887CDB79E683_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""3AB45E304E07286E"""
+"""5E04A6A320616491_3337BD5A244FEDE3_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""3AB45E304E07286E"""
+"""64E24CAA1D7CD9A2_420C0F2F35446310_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""3AB45E304E07286E"""
+"""7980F1C808A795F5_F0C7E35AF70D6A52_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""3AB45E304E07286E"""
+"""7B946ECDC527EBDA_850971D2CDA1FA60_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""3AB45E304E07286E"""
+"""5DC9DEB3CD0AE13A_D6F5298BF3D35B71_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(C=CC=C2)CN3CCCC3""",21,"""3AB45E304E07286E"""
+"""841977D12C60D881_44265309161C5C36_6025_UN""","""C1(=C(C#N)C(=N[N]1C)C)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""3AB45E304E07286E"""
+"""DBA9DFAEC6EE1645_C5B69DF2BCEB0F6D_6036_UN""","""NC1(CCC(CC1)N([S](CCN)(=O)=O)C2CC2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""21ED31B0B0F09E32_5ECF4D78114800C3_6036_UN""","""NC1(CCC(CC1)N(C(C)C)[S](=O)(=O)CCN)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""4088A721B1CDBB45_0940A1CDFF08239F_6036_UN""","""NC1(CCC(CC1)N([S](C)(=O)=O)CCN=C=S)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""A7283965B8512D7C_1456A075B1A05A57_6036_UN""","""NC1(CCC(CC1)N([S](CC)(=O)=O)CCCN)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""59BFBFF8FE6DF668_9E89059847746F76_6036_UN""","""NC1(CCC(CC1)N([S](C)(=O)=O)C2CC(C2)N)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""E4D31E417B681E2D_D8530D9F7741EDF7_6036_UN""","""NC1(CCC(CC1)N(CCCN)[S](=O)(=O)CCl)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""4F8353997F61DBB7_2DB281D9A5D378B6_6036_UN""","""NC1(CCC(CC1)N(C)[S](=O)(=O)C2CNCC2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""531A499A5CDC52E8_93EA8ACE1A3CDD72_6036_UN""","""NC1(CCC(CC1)N([S](CC)(=O)=O)CCCBr)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""AE8CAE98608EAE9F_27300BCEBF325EFC_6036_UN""","""NC1(CCC(CC1)N(CCCNC)[S](=O)(=O)C)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""37940092F5C45651_C25D03A836FB44A4_6036_UN""","""NC1(CCC(CC1)N(C(C)(C)C#N)[S](=O)(=O)C)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""B3BEF4305940B160_901669B36AC4976C_6036_UN""","""NC1(CCC(CC1)N([S](=O)(=O)CC#N)C2CC2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""C0C15CE4D0D2C123_13C202C58262D57B_6036_UN""","""NC1(CCC(CC1)N([S](C)(=O)=O)C(=O)CCN)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""E57921BD52DC3D8D_D5C45535663C6188_6036_UN""","""NC1(CCC(CC1)N(C)[S](=O)(=O)C2=CC=CS2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""AC7481F4362598FB_776208AC767373C9_6036_UN""","""NC1(CCC(CC1)N(C(C)(C)C)[S](=O)(=O)CCl)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""3BF8300C2AC9CBCC_BA0553E5A93D5396_6036_UN""","""NC1(CCC(CC1)N(C(C)(C)C)[S](=O)(=O)CBr)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""69D494ED790A8A3F_4E78FC52663D033F_6036_UN""","""NC1(CCC(CC1)N(C(C)(C)C#C)[S](=O)(=O)C)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""7BFE2E9D642BC45D_448C1B52FA463B39_6036_UN""","""NC1(CCC(CC1)N(CC(CC)N)[S](=O)(=O)C)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""17AC5DF721A80F81_46A24E73F84D8B12_6036_UN""","""NC1(CCC(CC1)N(C)[S](=O)(=O)C2=C[NH]C=N2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""301593CE4E0EE296_D560513F22B550F6_6036_UN""","""NC1(CCC(CC1)N([S](C)(=O)=O)CCN=[N]#N)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""24B21388E691FB4F_05D1669924C854D2_6036_UN""","""NC1(CCC(CC1)N(CC(C)(C)N)[S](=O)(=O)C)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""9CF4E15BC2EFBB41_4FDE0128B306D35F_6036_UN""","""NC1(CCC(CC1)N2[S](CC(C)(C)C2=O)(=O)=O)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""5368EEADE390C609_A3E39F4AB92C7750_6036_UN""","""NC1(CCC(CC1)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""8879046258ED9471_AA0E2B2E12795AEA_6036_UN""","""NC1(CCC(CC1)N([S](=O)(=O)C2CC2)CC#C)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""A3E47626FF5E3842_FE0E31A5F5779F2C_6036_UN""","""NC1(CCC(CC1)N2[S](=O)(=O)C3(CCC2)CC3)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""F2DF1EAC76645FF5_D6657E58D073D3C4_6036_UN""","""NC1(CCC(CC1)N2CCCC(C)(C)[S]2(=O)=O)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""FA43312AF573C1A8_1D4C850C59B518D7_6036_UN""","""NC1(CCC(CC1)N2CCCC(CC)[S]2(=O)=O)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""F0C93601EA57408D_2C25F5D63C0CAE78_6036_UN""","""NC1(CCC(CC1)N2C(C(N)CC[S]2(=O)=O)=O)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""B84E1A2E9436BDB4_F33B927846049756_6036_UN""","""NC1(CCC(CC1)N([S](C)(=O)=O)[C@@H]2CNCC2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""7F17BC586795B555_58035CE192940A7A_6036_UN""","""NC1(CCC(CC1)N2CCCC(Cl)(Cl)[S]2(=O)=O)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""FCED9A553461C709_186FECB197AED3C4_6036_UN""","""NC1(CCC(CC1)N([S](C)(=O)=O)[C@H]2CNCC2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""E12D1B77B5EB2410_B02076656CB3CCAC_6036_UN""","""NC1(CCC(CC1)N2[S](CCN(C)CC2)(=O)=O)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""9288B381160D0D4F_3CB750E8041A274F_6036_UN""","""NC1(CCC(CC1)N2CC(=O)NCC[S]2(=O)=O)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""8BCC2F6C1FED3D86_694C4DE1A9BFE0DB_6036_UN""","""NC1(CCC(CC1)N2[S](CCCCC2C)(=O)=O)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""A1FA705A5DD6940F_13E4082D075F0F25_6036_UN""","""NC1(CCC(CC1)N(CCN)[S](=O)(=O)C2CC2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""2077991F90276A1D_751E2EECA3739DD2_6036_UN""","""NC1(CCC(CC1)N(CCN)[S](=O)(=O)C(F)F)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""DD9EF5D2A8E13FE9_D51BB2899D786330_6036_UN""","""NC1(CCC(CC1)N([S](CC)(=O)=O)C2CNC2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""54A15EED719A7E23_E78266B50A91374D_6036_DP""","""NC1(CCC(CC1)N3CC2(CNC2)C[S]3(=O)=O)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""8B9AD75A96C38549_5DF71F27D3527327_6036_UN""","""NC1(CCC(CC1)N(C)[S](=O)(=O)C2=N[NH]C=N2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""DDB977F1335EBA9B_A11C8777DA306397_6036_UN""","""NC1(CCC(CC1)N(C)[S](=O)(=O)C2=C[NH]N=C2)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""667A49F4F6AA8D8A_9F7DE0C0170EAB0C_6036_UN""","""NC1(CCC(CC1)N(C(C)(C)CN)[S](=O)(=O)C)C(F)(F)F""",21,"""3B7EE31D62106275"""
+"""469CC965CE2F3B08_3A1ABA814E475616_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=CC=C2)OC3CCCC3""",21,"""3BEAEBD5BFDCAFCA"""
+"""CF7B6CE794A3B741_956D42ADB557FAEA_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=C(OCC)C=C2)OCC""",21,"""3BEAEBD5BFDCAFCA"""
+"""0755A9507AE75CCB_696D356A2ABC0DC0_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=CC(=C2)OCCC(C)C""",21,"""3BEAEBD5BFDCAFCA"""
+"""7DE8F29F70F86B48_3557CD3CB9903BC4_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""3BEAEBD5BFDCAFCA"""
+"""925D7E4397FD21FF_067FA2FD3EFECD6C_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=C(C=C2)OC3CCOC3""",21,"""3BEAEBD5BFDCAFCA"""
+"""9C2A653D9B0FA1C2_CD9E4689E689399F_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""3BEAEBD5BFDCAFCA"""
+"""C7176594EC4E3BBC_15F16285B24D2817_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=CC(=C2)COCCOC""",21,"""3BEAEBD5BFDCAFCA"""
+"""C4203518EF4D1C1F_9C9CEF84BCF1237B_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""3BEAEBD5BFDCAFCA"""
+"""83F5A720221423E5_8387FB678BBBC41E_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=CC(=C2)OC(COC)C""",21,"""3BEAEBD5BFDCAFCA"""
+"""6BCB0FEB14A169D7_D1C60353000E6432_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""3BEAEBD5BFDCAFCA"""
+"""71CE9439F08E12FF_C43FE5679B73C570_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""3BEAEBD5BFDCAFCA"""
+"""348D549F16B16084_BD848A4B6C49F90D_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=CC=C2)CN3CCCC3""",21,"""3BEAEBD5BFDCAFCA"""
+"""B08C53098883E9BD_A4A0AE490425168D_6004_UN""","""NC1=C(C=NC(=N1)C#N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""3BEAEBD5BFDCAFCA"""
+"""952AB915AEE08F67_D954F1AB8333A7E4_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=CC(=C2)OCCN(C)C""",21,"""3BEAEBD5BFDCAFCA"""
+"""FAA2996AE681C2E8_2E893D69125104DF_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""3BEAEBD5BFDCAFCA"""
+"""4F6AB5818C767E3A_19AE05EDE53B076B_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""3BEAEBD5BFDCAFCA"""
+"""411B9B5A33FA7DFA_CB62FB69CF342DD8_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""3BEAEBD5BFDCAFCA"""
+"""158B1A3BA088B174_1BB735E13A6E19CB_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""3BEAEBD5BFDCAFCA"""
+"""75A634580541967C_342201AE29497B0E_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""3BEAEBD5BFDCAFCA"""
+"""165397C7BD0B239F_3119FF0BF579A927_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""3BEAEBD5BFDCAFCA"""
+"""ACCE309CF07AEBEB_F4E259FC95F93513_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""3BEAEBD5BFDCAFCA"""
+"""CAAF0CE143554C1E_E4CEC9AD4A1781E7_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""3BEAEBD5BFDCAFCA"""
+"""D08E3F8640BD6A5C_39DD9094E4B4759D_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""3BEAEBD5BFDCAFCA"""
+"""86EE5BD646C967F1_A9AE74EE7D49FF48_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""3BEAEBD5BFDCAFCA"""
+"""68BE7BDAD8AC5ADC_8C8FC45D9D463193_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""3BEAEBD5BFDCAFCA"""
+"""CA9254646953B4C4_EA72741CB4CF80F3_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=C(OCCC(C)C)C=C2""",21,"""3BEAEBD5BFDCAFCA"""
+"""6B9E2DE3AB6F2ED6_171F170A4A8510A3_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=C(C=C2)OC3CCCC3""",21,"""3BEAEBD5BFDCAFCA"""
+"""99A43401C641B896_9629CEF4FD7E7877_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""3BEAEBD5BFDCAFCA"""
+"""E374247B63382A58_E356ACC68752DCC0_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""3BEAEBD5BFDCAFCA"""
+"""4B87EBB3CF5FBA82_1CB16B4A5053222D_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""3BEAEBD5BFDCAFCA"""
+"""9E19A4BB15F907CA_EB3682BF7B2A0F33_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""3BEAEBD5BFDCAFCA"""
+"""BFACC7C57D49BC3A_9D3DACA3B3460858_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""3BEAEBD5BFDCAFCA"""
+"""76BDD5AFA843E6BF_580D3D992AA26127_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""3BEAEBD5BFDCAFCA"""
+"""7AD7339DC7B68033_326908BFD5946A47_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""3BEAEBD5BFDCAFCA"""
+"""3EFF11F7235CEF02_4352BACAC49FE4B4_6004_UN""","""NC1=C(C=NC(=N1)C#N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""3BEAEBD5BFDCAFCA"""
+"""37E924550CA95949_F19956BF06D6EDF6_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""3BEAEBD5BFDCAFCA"""
+"""F8FAE26498EFD86F_8457C4373C7A7DC4_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""3BEAEBD5BFDCAFCA"""
+"""6FFC219C21219BAE_D7AB9C6E0208DCD5_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(C=CC=C2)CN3CCCC3""",21,"""3BEAEBD5BFDCAFCA"""
+"""A916977A16514E52_4F7FCCEFBEBA3F6F_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""3BEAEBD5BFDCAFCA"""
+"""2D6237094652CC04_4578E6ECE7C7DB92_6004_UN""","""NC1=C(C=NC(=N1)C#N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""3BEAEBD5BFDCAFCA"""
+"""058ED77057F56062_3CF78D6A7C5750F3_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""3D07DC3E8DCCA92F"""
+"""D61DFF259841F49C_938075468747FC0F_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""3D07DC3E8DCCA92F"""
+"""F4BBBD4FD6C8C83B_6F80028118AC0B25_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""3D07DC3E8DCCA92F"""
+"""46C18C384E8B2546_33BAFAD78B803D21_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""3D07DC3E8DCCA92F"""
+"""28B2EB3CBB0448B8_009295160CEECB89_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""3D07DC3E8DCCA92F"""
+"""FE3496C9F0013ADD_CB737162D4993F7A_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""3D07DC3E8DCCA92F"""
+"""100AE5B5A13F3F8C_131C556E805D2EF2_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)COCCOC""",21,"""3D07DC3E8DCCA92F"""
+"""EE6972BD5891EF3E_9A71D86F8EE1259E_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""3D07DC3E8DCCA92F"""
+"""CF7E2ADC6F9CDA28_856ACC8CB9ABC2FB_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""3D07DC3E8DCCA92F"""
+"""06D664EF13AB5610_D72B34B8321E62D7_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""3D07DC3E8DCCA92F"""
+"""A48BBE383D7C280C_C2D2D28CA963C395_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""3D07DC3E8DCCA92F"""
+"""814549BB86D3A109_BB69BDA05E59FFE8_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""3D07DC3E8DCCA92F"""
+"""4FD4EA8570F39DD2_A24D99A236351068_6005_UN""","""OC(=O)C1=CC=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""3D07DC3E8DCCA92F"""
+"""790D9810EA6244AA_DFB9C640B123A101_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""3D07DC3E8DCCA92F"""
+"""0EB260CB0637C2E1_28640A822041023A_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""3D07DC3E8DCCA92F"""
+"""F3513E892EEC60A6_1F433206D72B018E_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""3D07DC3E8DCCA92F"""
+"""FC45B083E0DC428B_CD8FCC82FD242B3D_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""3D07DC3E8DCCA92F"""
+"""C10D4FB0154C3DB2_1D5A020A087E1F2E_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""3D07DC3E8DCCA92F"""
+"""4C3E1A3BA6907E85_32CF36451B597DEB_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""3D07DC3E8DCCA92F"""
+"""EB822E4A68713260_37F4C8E0C769AFC2_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""3D07DC3E8DCCA92F"""
+"""99AFA89ECD116D2A_F20F6E17A7E933F6_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""3D07DC3E8DCCA92F"""
+"""574E9CDF1C2A1BEC_E223FE4678078702_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""3D07DC3E8DCCA92F"""
+"""D46B6D4D09EC33EA_3F30A77FD6A47378_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""3D07DC3E8DCCA92F"""
+"""BBF3DDDD8B5235D0_AF4343054F59F9AD_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""3D07DC3E8DCCA92F"""
+"""93BDEC106A42E78C_8A62F3B6AF563776_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""3D07DC3E8DCCA92F"""
+"""CBEFC0BAA8F78058_EC9F43F786DF8616_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""3D07DC3E8DCCA92F"""
+"""AFB24C6307428012_11F220E178951646_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""3D07DC3E8DCCA92F"""
+"""0AA4122D216C3127_90C4F91FCF6E7E92_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""3D07DC3E8DCCA92F"""
+"""04CFA30495519A8D_E5BB9B2DB542DA25_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""3D07DC3E8DCCA92F"""
+"""722C6878148844FA_1A5C5CA1624324C8_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""3D07DC3E8DCCA92F"""
+"""F2F427F41C1B5542_EDDBB554493A09D6_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""3D07DC3E8DCCA92F"""
+"""71AE03A095D2A282_9BD09B4881560EBD_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""3D07DC3E8DCCA92F"""
+"""9601DBB61675A4CB_5EE00A7218B267C2_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""3D07DC3E8DCCA92F"""
+"""32EFDCDEEC17EF6E_34843F54E7846CA2_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""3D07DC3E8DCCA92F"""
+"""8DE9905B7E6C6C88_45BF8D21F68FE251_6005_UN""","""OC(=O)C1=CC=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""3D07DC3E8DCCA92F"""
+"""326E985203BE29BA_F774615434C6EB13_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""3D07DC3E8DCCA92F"""
+"""4D7C7A22899F2D0B_82BAF3DC0E6A7B21_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""3D07DC3E8DCCA92F"""
+"""162077B5A6600FFF_D146AB853018DA30_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""3D07DC3E8DCCA92F"""
+"""FD2432F54FB3162B_4992FB048CAA398A_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""3D07DC3E8DCCA92F"""
+"""D96107C464CC8DEA_4395D107D5D7DD77_6005_UN""","""OC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""3D07DC3E8DCCA92F"""
+"""75045AA5BB325E23_C394DD4E4003A95D_6036_UN""","""NCC(CN([S](CCN)(=O)=O)C1CC1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""995972E944881C0A_58ED0DC4EDA0A6F3_6036_UN""","""NCC(CN(C(C)C)[S](=O)(=O)CCN)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""AA852C374B81F4A2_0F62E17103E085AF_6036_UN""","""NCC(CN([S](C)(=O)=O)CCN=C=S)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""E28944BA969AED54_1274E0C94D48FC67_6036_UN""","""NCC(CN([S](CC)(=O)=O)CCCN)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""E2DE13B16CE8D977_98AB4524BB9CC946_6036_UN""","""NCC(CN([S](C)(=O)=O)C1CC(C1)N)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""DDF930E38B7AEF79_DE714D238BA94BC7_6036_UN""","""NCC(CN(CCCN)[S](=O)(=O)CCl)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""CCE104F94269C08A_2B90C165593BDE86_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1CNCC1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""3092E67829CAE1D0_95C8CA72E6D47B42_6036_UN""","""NCC(CN([S](CC)(=O)=O)CCCBr)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""F46FCBD40713FF47_21124B7243DAF8CC_6036_UN""","""NCC(CN(CCCNC)[S](=O)(=O)C)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""716504A366FA50B8_C47F4314CA13E294_6036_UN""","""NCC(CN(C(C)(C)C#N)[S](=O)(=O)C)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""42DD70F7DCEE12E4_9634290F962C315C_6036_UN""","""NCC(CN([S](=O)(=O)CC#N)C1CC1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""2E69DC060D683390_15E042797E8A734B_6036_UN""","""NCC(CN([S](C)(=O)=O)C(=O)CCN)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""2B025116A771F646_D3E615899AD4C7B8_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=CC=CS1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""D76EBE25FAF5EA90_714048108A9BD5F9_6036_UN""","""NCC(CN(C(C)(C)C)[S](=O)(=O)CCl)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""A13BD1D173E5649F_BC27135955D5F5A6_6036_UN""","""NCC(CN(C(C)(C)C)[S](=O)(=O)CBr)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""73ABF82B3677DFA2_485ABCEE9AD5A50F_6036_UN""","""NCC(CN(C(C)(C)C#C)[S](=O)(=O)C)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""7C3E20219BF15D14_42AE5BEE06AE9D09_6036_UN""","""NCC(CN(CC(CC)N)[S](=O)(=O)C)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""64C0A3BB4F0B6CBA_40800ECF04A52D22_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=C[NH]C=N1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""40D7CF6ADFAA3717_D3421183DE5DF6C6_6036_UN""","""NCC(CN([S](C)(=O)=O)CCN=[N]#N)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""E1D5385B757BE5D8_03F32625D820F2E2_6036_UN""","""NCC(CN(CC(C)(C)N)[S](=O)(=O)C)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""D201A8AD901817F2_49FC41944FEE756F_6036_UN""","""NCC(CN1[S](CC(C)(C)C1=O)(=O)=O)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""809FC44043C5410A_A5C1DFF645C4D160_6036_UN""","""NCC(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)C3=CC=C(C=C3)Cl""",21,"""3D5CA3A19EF8C445"""
+"""5A63ECF9550E45C5_AC2C6B92EE91FCDA_6036_UN""","""NCC(CN([S](=O)(=O)C1CC1)CC#C)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""CE8125942584C581_F82C7119099F391C_6036_UN""","""NCC(CN1[S](=O)(=O)C2(CCC1)CC2)C3=CC=C(C=C3)Cl""",21,"""3D5CA3A19EF8C445"""
+"""D56D3A23CAEBE31C_D0473EE42C9B75F4_6036_UN""","""NCC(CN1CCCC(C)(C)[S]1(=O)=O)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""EF5F5E9808288CB4_1B6EC5B0A55DBEE7_6036_UN""","""NCC(CN1CCCC(CC)[S]1(=O)=O)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""EFBB49365B544865_2A07B56AC0E40848_6036_UN""","""NCC(CN1C(C(N)CC[S]1(=O)=O)=O)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""F4F3813E57741D96_F519D2C4BAEC3166_6036_UN""","""NCC(CN([S](C)(=O)=O)[C@@H]1CNCC1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""5833D1208A4442A5_5E211C5D6E7CAC4A_6036_UN""","""NCC(CN1CCCC(Cl)(Cl)[S]1(=O)=O)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""761AD454D9E69E70_1E4DAC0D6B4675F4_6036_UN""","""NCC(CN([S](C)(=O)=O)[C@H]1CNCC1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""173B79C1B6A8885B_B60236D9905B6A9C_6036_UN""","""NCC(CN1[S](CCN(C)CC1)(=O)=O)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""12BCF1B3F4208F24_3A951054F8F2817F_6036_UN""","""NCC(CN1CC(=O)NCC[S]1(=O)=O)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""73CD222CD6EA10EB_6F6E0D5D555746EB_6036_UN""","""NCC(CN1[S](CCCCC1C)(=O)=O)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""CF0ACD59F398170C_15C64891FBB7A915_6036_UN""","""NCC(CN(CCN)[S](=O)(=O)C1CC1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""89DFB55F6A08E976_733C6E505F9B3BE2_6036_UN""","""NCC(CN(CCN)[S](=O)(=O)C(F)F)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""573C9D8C1B1A7E80_D339F2356190C500_6036_UN""","""NCC(CN([S](CC)(=O)=O)C1CNC1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""20F15F0F3D9E2B02_E1A02609F679917D_6036_DP""","""NCC(CN2CC1(CNC1)C[S]2(=O)=O)C3=CC=C(C=C3)Cl""",21,"""3D5CA3A19EF8C445"""
+"""F5D39DF65FACBE3C_5BD55F9B2FBAD517_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=N[NH]C=N1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""2C65A36E3BAEECA9_A73EC7CB26D8C5A7_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=C[NH]N=C1)C2=CC=C(C=C2)Cl""",21,"""3D5CA3A19EF8C445"""
+"""0C8086713EB73D5A_995FA07CEBE60D3C_6036_UN""","""NCC(CN(C(C)(C)CN)[S](=O)(=O)C)C1=CC=C(C=C1)Cl""",21,"""3D5CA3A19EF8C445"""
+"""70E2B9904D5403BD_C0E2EC3C32B9D400_6036_UN""","""C(C1OC2=C(NC1)C=CC=C2)N([S](CCN)(=O)=O)C3CC3""",21,"""3E2A92D3EC42B918"""
+"""BD7C52A6EC96BC6B_5B9B3CB69F1ADBAE_6036_UN""","""C(C1OC2=C(NC1)C=CC=C2)N(C(C)C)[S](=O)(=O)CCN""",21,"""3E2A92D3EC42B918"""
+"""4C640DDEE8DA1F0A_0C14D003715AF8F2_6036_UN""","""C(C1OC2=C(NC1)C=CC=C2)N([S](C)(=O)=O)CCN=C=S""",21,"""3E2A92D3EC42B918"""
+"""689E365571DB4F7B_1102D1BB3FF2813A_6036_UN""","""C(C1OC2=C(NC1)C=CC=C2)N([S](CC)(=O)=O)CCCN""",21,"""3E2A92D3EC42B918"""
+"""C7767766927D6CA8_9BDD7456C926B41B_6036_UN""","""C(C1OC2=C(NC1)C=CC=C2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""3E2A92D3EC42B918"""
+"""2678028C5DB1F2FC_DD077C51F913369A_6036_UN""","""C(C1OC2=C(NC1)C=CC=C2)N(CCCN)[S](=O)(=O)CCl""",21,"""3E2A92D3EC42B918"""
+"""9C70D0E151BBB178_28E6F0172B81A3DB_6036_UN""","""C(C1OC2=C(NC1)C=CC=C2)N(C)[S](=O)(=O)C3CNCC3""",21,"""3E2A92D3EC42B918"""
+"""7A371FEB9270B615_96BEFB00946E061F_6036_UN""","""C(C1OC2=C(NC1)C=CC=C2)N([S](CC)(=O)=O)CCCBr""",21,"""3E2A92D3EC42B918"""
+"""FEB38FB404DED7BC_22647A0031608591_6036_UN""","""C(C1OC2=C(NC1)C=CC=C2)N(CCCNC)[S](=O)(=O)C""",21,"""3E2A92D3EC42B918"""
+"""2DF49086F19A12A3_C7097266B8A99FC9_6036_UN""","""C(C1OC2=C(NC1)C=CC=C2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""3E2A92D3EC42B918"""
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+"""C97A254B160B154B_9B710BC1731A814E_6036_UN""","""CNCC(CN1CCOCC1)N([S](C)(=O)=O)C2CC(C2)N""",21,"""3E86ED44567E8C4D"""
+"""0C8A1B7877FDA5EF_DDAB03C6432F03CF_6036_UN""","""CNCC(CN1CCOCC1)N(CCCN)[S](=O)(=O)CCl""",21,"""3E86ED44567E8C4D"""
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+"""F8E29D9E7FC62A00_C7A50DF10295AA9C_6036_UN""","""CNCC(CN1CCOCC1)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""3E86ED44567E8C4D"""
+"""2254F66902C83AFC_95EE67EA5EAA7954_6036_UN""","""CNCC(CN1CCOCC1)N([S](=O)(=O)CC#N)C2CC2""",21,"""3E86ED44567E8C4D"""
+"""A66267468913E39A_163A0C9CB60C3B43_6036_UN""","""CNCC(CN1CCOCC1)N([S](C)(=O)=O)C(=O)CCN""",21,"""3E86ED44567E8C4D"""
+"""8BDB76149DD9FEFA_D03C5B6C52528FB0_6036_UN""","""CNCC(CN1CCOCC1)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""3E86ED44567E8C4D"""
+"""5E132BA242C73AEC_729A06F5421D9DF1_6036_UN""","""CNCC(CN1CCOCC1)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""3E86ED44567E8C4D"""
+"""50DA1C245C43BFEC_BFFD5DBC9D53BDAE_6036_UN""","""CNCC(CN1CCOCC1)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""3E86ED44567E8C4D"""
+"""DFC1E484132DC229_4B80F20B5253ED07_6036_UN""","""CNCC(CN1CCOCC1)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""3E86ED44567E8C4D"""
+"""BCCD4F104C8DA647_4174150BCE28D501_6036_UN""","""CNCC(CN1CCOCC1)N(CC(CC)N)[S](=O)(=O)C""",21,"""3E86ED44567E8C4D"""
+"""C166E8C07A28DA62_435A402ACC23652A_6036_UN""","""CNCC(CN1CCOCC1)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""3E86ED44567E8C4D"""
+"""A8DA246C093C21CF_D0985F6616DBBECE_6036_UN""","""CNCC(CN1CCOCC1)N([S](C)(=O)=O)CCN=[N]#N""",21,"""3E86ED44567E8C4D"""
+"""FD59DE5602CB7D40_002968C010A6BAEA_6036_UN""","""CNCC(CN1CCOCC1)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""3E86ED44567E8C4D"""
+"""A3D6EBE744221CBE_4A260F7187683D67_6036_UN""","""CNCC(CN1CCOCC1)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""3E86ED44567E8C4D"""
+"""D4246F61B2E98FFC_A61B91138D429968_6036_UN""","""CNCC(CN1CCOCC1)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""3E86ED44567E8C4D"""
+"""F94F4FA592D6A32A_AFF625772617B4D2_6036_UN""","""CNCC(CN1CCOCC1)N([S](=O)(=O)C2CC2)CC#C""",21,"""3E86ED44567E8C4D"""
+"""244FBE34C469A364_FBF63FFCC1197114_6036_UN""","""CNCC(CN1CCOCC1)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""3E86ED44567E8C4D"""
+"""4C3A6FA175CA3EE5_D39D7001E41D3DFC_6036_UN""","""CNCC(CN1CCOCC1)N2CCCC(C)(C)[S]2(=O)=O""",21,"""3E86ED44567E8C4D"""
+"""19C76621DCD14339_18B48B556DDBF6EF_6036_UN""","""CNCC(CN1CCOCC1)N2CCCC(CC)[S]2(=O)=O""",21,"""3E86ED44567E8C4D"""
+"""3227ADF1132CA2B7_29DDFB8F08624040_6036_UN""","""CNCC(CN1CCOCC1)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""3E86ED44567E8C4D"""
+"""038581028F93C151_F6C39C21726A796E_6036_UN""","""CNCC(CN1CCOCC1)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""3E86ED44567E8C4D"""
+"""020CDD04BB307E55_5DFB52B8A6FAE442_6036_UN""","""CNCC(CN1CCOCC1)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""3E86ED44567E8C4D"""
+"""0B6499B2D15F1179_1D97E2E8A3C03DFC_6036_UN""","""CNCC(CN1CCOCC1)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""3E86ED44567E8C4D"""
+"""A10D84D4F483AE21_B5D8783C58DD2294_6036_UN""","""CNCC(CN1CCOCC1)N2[S](CCN(C)CC2)(=O)=O""",21,"""3E86ED44567E8C4D"""
+"""F74C0C6D577848A9_394F5EB13074C977_6036_UN""","""CNCC(CN1CCOCC1)N2CC(=O)NCC[S]2(=O)=O""",21,"""3E86ED44567E8C4D"""
+"""9322D0103FEB8531_6CB443B89DD10EE3_6036_UN""","""CNCC(CN1CCOCC1)N2[S](CCCCC2C)(=O)=O""",21,"""3E86ED44567E8C4D"""
+"""5114B8BB4A0E84D3_161C06743331E11D_6036_UN""","""CNCC(CN1CCOCC1)N(CCN)[S](=O)(=O)C2CC2""",21,"""3E86ED44567E8C4D"""
+"""6104B053AD51D1F1_70E620B5971D73EA_6036_UN""","""CNCC(CN1CCOCC1)N(CCN)[S](=O)(=O)C(F)F""",21,"""3E86ED44567E8C4D"""
+"""9D1C69A77F302D0F_D0E3BCD0A9168D08_6036_UN""","""CNCC(CN1CCOCC1)N([S](CC)(=O)=O)C2CNC2""",21,"""3E86ED44567E8C4D"""
+"""A542BCC5BD19BF4A_E27A68EC3EFFD975_6036_DP""","""CNCC(CN1CCOCC1)N3CC2(CNC2)C[S]3(=O)=O""",21,"""3E86ED44567E8C4D"""
+"""DA635CF827DFAF6C_580F117EE73C9D1F_6036_UN""","""CNCC(CN1CCOCC1)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""3E86ED44567E8C4D"""
+"""C956FD516D07013D_A4E4892EEE5E8DAF_6036_UN""","""CNCC(CN1CCOCC1)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""3E86ED44567E8C4D"""
+"""5E02ADA050C1854A_9A85EE9923604534_6036_UN""","""CNCC(CN1CCOCC1)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""3E86ED44567E8C4D"""
+"""2353D4E8511A4923_3E6B47477B7CD6AB_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""3F9B16138AE72F77"""
+"""D427F2FC8EC28857_911CBF6B806C7A57_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""3F9B16138AE72F77"""
+"""9D341A0462898FAB_6D1CC8AC1F878D7D_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""3F9B16138AE72F77"""
+"""DE49AFEF70081999_312630FA8CABBB79_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""3F9B16138AE72F77"""
+"""2DBAE2C5A4E05C8B_020E5F3B0BC54DD1_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""3F9B16138AE72F77"""
+"""C32CE6EA6F62F3A7_C9EFBB4FD3B2B922_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""3F9B16138AE72F77"""
+"""B5E3C5FDA83D9C4B_11809F438776A8AA_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=CC(=C2)COCCOC""",21,"""3F9B16138AE72F77"""
+"""B638542DCAA44190_98ED124289CAA3C6_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""3F9B16138AE72F77"""
+"""AADA2FF12707CA11_87F606A1BE8044A3_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""3F9B16138AE72F77"""
+"""11636B2B3FAC472E_D5B7FE953535E48F_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""3F9B16138AE72F77"""
+"""836A2C96D5CEB069_C04E18A1AE4845CD_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""3F9B16138AE72F77"""
+"""9775EE2FB4CEF731_B9F5778D597279B0_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""3F9B16138AE72F77"""
+"""1E8C0A9DDBD1B28C_A0D1538F311E9630_6005_UN""","""CC(=O)C1=C(C=CC=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""3F9B16138AE72F77"""
+"""5A696AAEF1643550_DD250C6DB6082759_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""3F9B16138AE72F77"""
+"""35BE647C8B2DB439_2AF8C0AF276A8462_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""3F9B16138AE72F77"""
+"""AAAFE8748691516D_1DDFF82BD00087D6_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""3F9B16138AE72F77"""
+"""29B16E01A708D8D2_CF1306AFFA0FAD65_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""3F9B16138AE72F77"""
+"""BC0F79CD1DC5EFFC_1FC6C8270F559976_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""3F9B16138AE72F77"""
+"""C872C8797F060810_3053FC681C72FBB3_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""3F9B16138AE72F77"""
+"""CC1FA01A87EA7B87_356802CDC042299A_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""3F9B16138AE72F77"""
+"""DA26AAB41FB092DA_F093A43AA0C2B5AE_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""3F9B16138AE72F77"""
+"""979949E2077646D4_E0BF346B7F2C015A_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""3F9B16138AE72F77"""
+"""754B0997777F817F_3DAC6D52D18FF520_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""3F9B16138AE72F77"""
+"""A4DCCDA4C2BAA294_ADDF892848727FF5_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""3F9B16138AE72F77"""
+"""D9D10F8D2BED6F32_88FE399BA87DB12E_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""3F9B16138AE72F77"""
+"""D8178D7DE0A55A1A_EE0389DA81F4004E_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""3F9B16138AE72F77"""
+"""00F46E965BF09CA1_136EEACC7FBE901E_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""3F9B16138AE72F77"""
+"""E2E0BD550B124064_92583332C845F8CA_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""3F9B16138AE72F77"""
+"""867699C13785A7A6_E7275100B2695C7D_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""3F9B16138AE72F77"""
+"""698DD8CF6EBAA8F3_18C0968C6568A290_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""3F9B16138AE72F77"""
+"""082EE2A5632540AD_EF477F794E118F8E_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""3F9B16138AE72F77"""
+"""959731BFC56F9F2C_994C5165867D88E5_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""3F9B16138AE72F77"""
+"""B0A84975B473BFFD_5C7CC05F1F99E19A_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""3F9B16138AE72F77"""
+"""E50BA8E15DCCB99C_3618F579E0AFEAFA_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""3F9B16138AE72F77"""
+"""AF33B254A9DEDDEB_4723470CF1A46409_6005_UN""","""CC(=O)C1=C(C=CC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""3F9B16138AE72F77"""
+"""FC6A0E0D30E285C7_F5E8AB7933ED6D4B_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""3F9B16138AE72F77"""
+"""D9E103F2A834B8CB_802639F10941FD79_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""3F9B16138AE72F77"""
+"""6C46571B1CE81CC9_D3DA61A837335C68_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""3F9B16138AE72F77"""
+"""10E152B594DD18D9_4B0E31298B81BFD2_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""3F9B16138AE72F77"""
+"""42A5A04873A177E8_41091B2AD2FC5B2F_6005_UN""","""CC(=O)C1=C(C=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""3F9B16138AE72F77"""
+"""7184604D425A58A2_BED464143846FF16_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](CCN)(=O)=O)C3CC3""",21,"""401C1AFBE6BD920E"""
+"""5C09A777369A9A0F_25ADB49E95E5F0B8_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C(C)C)[S](=O)(=O)CCN""",21,"""401C1AFBE6BD920E"""
+"""0B7A2F63B80ECAC6_7222582B7BA5D3E4_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](C)(=O)=O)CCN=C=S""",21,"""401C1AFBE6BD920E"""
+"""1BE98FC42F773293_6F345993350DAA2C_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](CC)(=O)=O)CCCN""",21,"""401C1AFBE6BD920E"""
+"""A6103C14A599040E_E5EBFC7EC3D99F0D_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""401C1AFBE6BD920E"""
+"""D5BF79756343325B_A331F479F3EC1D8C_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(CCCN)[S](=O)(=O)CCl""",21,"""401C1AFBE6BD920E"""
+"""FFC56462F96F14F2_56D0783F217E88CD_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C)[S](=O)(=O)C3CNCC3""",21,"""401C1AFBE6BD920E"""
+"""08DEBD4980C9E835_E88873289E912D09_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](CC)(=O)=O)CCCBr""",21,"""401C1AFBE6BD920E"""
+"""21FB567CB88448E5_5C52F2283B9FAE87_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(CCCNC)[S](=O)(=O)C""",21,"""401C1AFBE6BD920E"""
+"""FD3CD7A1B126DB06_B93FFA4EB256B4DF_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""401C1AFBE6BD920E"""
+"""FD83DF536E2DC9AD_EB749055EE696717_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](=O)(=O)CC#N)C3CC3""",21,"""401C1AFBE6BD920E"""
+"""540935D1EDDDA41B_68A0FB2306CF2500_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](C)(=O)=O)C(=O)CCN""",21,"""401C1AFBE6BD920E"""
+"""CBEEC835BDBF3CB0_AEA6ACD3E29191F3_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""401C1AFBE6BD920E"""
+"""7F5138A903C497CC_0C00F14AF2DE83B2_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""401C1AFBE6BD920E"""
+"""ABEB8041F0BC2D3C_C167AA032D90A3ED_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""401C1AFBE6BD920E"""
+"""91BB4736906A7548_351A05B4E290F344_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""401C1AFBE6BD920E"""
+"""2E9BA5783E48D313_3FEEE2B47EEBCB42_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(CC(CC)N)[S](=O)(=O)C""",21,"""401C1AFBE6BD920E"""
+"""BA443D7B20F47FA0_3DC0B7957CE07B69_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""401C1AFBE6BD920E"""
+"""76F8F467F3AD2161_AE02A8D9A618A08D_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""401C1AFBE6BD920E"""
+"""E7CCB8779049E69C_7EB39F7FA065A4A9_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""401C1AFBE6BD920E"""
+"""7162DACB63AFFDC6_34BCF8CE37AB2324_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""401C1AFBE6BD920E"""
+"""007EFD0282F704B1_D88166AC3D81872B_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""401C1AFBE6BD920E"""
+"""61D3B24CA35E0D13_D16CD2C896D4AA91_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](=O)(=O)C3CC3)CC#C""",21,"""401C1AFBE6BD920E"""
+"""C2A8C07D2D429744_856CC84371DA6F57_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""401C1AFBE6BD920E"""
+"""6EF9FE80F3BF7504_AD0787BE54DE23BF_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""401C1AFBE6BD920E"""
+"""0E15A4A1A56FEB1C_662E7CEADD18E8AC_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N3CCCC(CC)[S]3(=O)=O""",21,"""401C1AFBE6BD920E"""
+"""AE91792E015D7091_57470C30B8A15E03_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""401C1AFBE6BD920E"""
+"""474886FACACF1873_88596B9EC2A9672D_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""401C1AFBE6BD920E"""
+"""63298E8957AAC3ED_2361A5071639FA01_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""401C1AFBE6BD920E"""
+"""3C109075BE714E0A_630D1557130323BF_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""401C1AFBE6BD920E"""
+"""8A3AB94926BF2DCD_CB428F83E81E3CD7_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N3[S](CCN(C)CC3)(=O)=O""",21,"""401C1AFBE6BD920E"""
+"""2C6461EB1EF22D78_47D5A90E80B7D734_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N3CC(=O)NCC[S]3(=O)=O""",21,"""401C1AFBE6BD920E"""
+"""10414D3BAA20857A_122EB4072D1210A0_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N3[S](CCCCC3C)(=O)=O""",21,"""401C1AFBE6BD920E"""
+"""EAC8A50BBA54471F_6886F1CB83F2FF5E_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(CCN)[S](=O)(=O)C3CC3""",21,"""401C1AFBE6BD920E"""
+"""8E1A9D04CAFD46F1_0E7CD70A27DE6DA9_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(CCN)[S](=O)(=O)C(F)F""",21,"""401C1AFBE6BD920E"""
+"""84417CDAB59D4BEB_AE794B6F19D5934B_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N([S](CC)(=O)=O)C3CNC3""",21,"""401C1AFBE6BD920E"""
+"""DE50F911E988B887_9CE09F538E3CC736_6036_DP""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""401C1AFBE6BD920E"""
+"""E7EBFA15FB0A7E0A_2695E6C157FF835C_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""401C1AFBE6BD920E"""
+"""BA3B523EAEA79F34_DA7E7E915E9D93EC_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""401C1AFBE6BD920E"""
+"""62C776B222C38D32_E41F192693A35B77_6036_UN""","""C(C2=CC1=C(C=C(C=C1)Br)[NH]2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""401C1AFBE6BD920E"""
+"""22BA51A31C7C65C5_41BD7B053B59A170_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""404D2A51CAC258AC"""
+"""5B317DD5A3A0CFA0_EECA8329C0490D8C_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""404D2A51CAC258AC"""
+"""9040C1BA6247AF48_12CAF4EE5FA2FAA6_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""404D2A51CAC258AC"""
+"""A675A162B0BE43F0_4EF00CB8CC8ECCA2_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""404D2A51CAC258AC"""
+"""33F4CFA165233339_7DD863794BE03A0A_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""404D2A51CAC258AC"""
+"""ECC631B92F96F898_B639870D9397CEF9_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""404D2A51CAC258AC"""
+"""65E9720FEAAF49A1_6E56A301C753DF71_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)COCCOC""",21,"""404D2A51CAC258AC"""
+"""C0AF009D7621393A_E73B2E00C9EFD41D_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""404D2A51CAC258AC"""
+"""0CBC1551B03365C1_F8203AE3FEA53378_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""404D2A51CAC258AC"""
+"""5A5571A826957C46_AA61C2D775109354_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""404D2A51CAC258AC"""
+"""43D11B4723F31492_BF9824E3EE6D3216_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""404D2A51CAC258AC"""
+"""57906F77CF0C789C_C6234BCF19570E6B_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""404D2A51CAC258AC"""
+"""558727692B7085FA_DF076FCD713BE1EB_6005_UN""","""CC(=O)C1=CC=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""404D2A51CAC258AC"""
+"""36B125AE1E2B1638_A2F3302FF62D5082_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""404D2A51CAC258AC"""
+"""458CF5B65B3A0058_552EFCED674FF3B9_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""404D2A51CAC258AC"""
+"""F270E3C40A62292C_6209C4699025F00D_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""404D2A51CAC258AC"""
+"""977257856034B025_B0C53AEDBA2ADABE_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""404D2A51CAC258AC"""
+"""2570EEB151804E2C_6010F4654F70EEAD_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""404D2A51CAC258AC"""
+"""35E0445C4832BC73_4F85C02A5C578C68_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""404D2A51CAC258AC"""
+"""3BD7142C03C1B0BE_4ABE3E8F80675E41_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""404D2A51CAC258AC"""
+"""FFC65CA781F5A3D7_8F459878E0E7C275_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""404D2A51CAC258AC"""
+"""DA16620459B2CEB2_9F6908293F097681_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""404D2A51CAC258AC"""
+"""70D975C301E526C2_427A511091AA82FB_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""404D2A51CAC258AC"""
+"""9C163C5C22B2BE77_D209B56A0857082E_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""404D2A51CAC258AC"""
+"""8EF234319FE4C6F0_F72805D9E858C6F5_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""404D2A51CAC258AC"""
+"""1EFC640B5BDF1F61_91D5B598C1D17795_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""404D2A51CAC258AC"""
+"""29B594EBE0752265_6CB8D68E3F9BE7C5_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""404D2A51CAC258AC"""
+"""5846626127F0D448_ED8E0F7088608F11_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""404D2A51CAC258AC"""
+"""080DDAB6D404B525_98F16D42F24C2BA6_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""404D2A51CAC258AC"""
+"""B06DEC10AA0D7122_6716AACE254DD54B_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""404D2A51CAC258AC"""
+"""EFA927BBE4F0843B_9091433B0E34F855_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""404D2A51CAC258AC"""
+"""B3D67D03A83A3892_E69A6D27C658FF3E_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""404D2A51CAC258AC"""
+"""CE4D99939B7F2869_23AAFC1D5FBC9641_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""404D2A51CAC258AC"""
+"""098F8FB740EFD902_49CEC93BA08A9D21_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""404D2A51CAC258AC"""
+"""BB7533B39D66A7D8_38F57B4EB18113D2_6005_UN""","""CC(=O)C1=CC=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""404D2A51CAC258AC"""
+"""CDE32DE75022D400_8A3E973B73C81A90_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""404D2A51CAC258AC"""
+"""89D932D69CBBF1D6_FFF005B349648AA2_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""404D2A51CAC258AC"""
+"""FE10E50E12DFC07E_AC0C5DEA77162BB3_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""404D2A51CAC258AC"""
+"""FB9209FB2142E4CD_34D80D6BCBA4C809_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""404D2A51CAC258AC"""
+"""77360724BE800300_3EDF276892D92CF4_6005_UN""","""CC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""404D2A51CAC258AC"""
+"""E1D46BA51DA81DDD_BEB1A1A501BA27C5_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](CCN)(=O)=O)C2CC2""",21,"""4079DF4ADF414ADD"""
+"""9E17E8AB42113351_25C8712FAC19286B_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C(C)C)[S](=O)(=O)CCN""",21,"""4079DF4ADF414ADD"""
+"""AFFC972B78CAE497_72479D9A42590B37_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](C)(=O)=O)CCN=C=S""",21,"""4079DF4ADF414ADD"""
+"""41F4C1237C555D0A_6F519C220CF172FF_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](CC)(=O)=O)CCCN""",21,"""4079DF4ADF414ADD"""
+"""8A019797A0D2D154_E58E39CFFA2547DE_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](C)(=O)=O)C2CC(C2)N""",21,"""4079DF4ADF414ADD"""
+"""CA362D4160D77810_A35431C8CA10C55F_6036_UN""","""CC1=CC(=CC=C1)CNCCN(CCCN)[S](=O)(=O)CCl""",21,"""4079DF4ADF414ADD"""
+"""8E102998702DD9A5_56B5BD8E1882501E_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C)[S](=O)(=O)C2CNCC2""",21,"""4079DF4ADF414ADD"""
+"""6F0E70AEBDAF9368_E8EDB699A76DF5DA_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](CC)(=O)=O)CCCBr""",21,"""4079DF4ADF414ADD"""
+"""FE4E0805C0E6708A_5C37379902637654_6036_UN""","""CC1=CC(=CC=C1)CNCCN(CCCNC)[S](=O)(=O)C""",21,"""4079DF4ADF414ADD"""
+"""940AD3E0A84DAA88_B95A3FFF8BAA6C0C_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""4079DF4ADF414ADD"""
+"""EA504C7F589E1220_EB1155E4D795BFC4_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](=O)(=O)CC#N)C2CC2""",21,"""4079DF4ADF414ADD"""
+"""03F3DB7C9CF27557_68C53E923F33FDD3_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](C)(=O)=O)C(=O)CCN""",21,"""4079DF4ADF414ADD"""
+"""FADC1D696AC36878_AEC36962DB6D4920_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C)[S](=O)(=O)C2=CC=CS2""",21,"""4079DF4ADF414ADD"""
+"""641E3BEF5D62EBA7_0C6534FBCB225B61_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""4079DF4ADF414ADD"""
+"""3B712D18C34716BE_C1026FB2146C7B3E_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""4079DF4ADF414ADD"""
+"""E4C40D97D9BD1231_357FC005DB6C2B97_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""4079DF4ADF414ADD"""
+"""B5E10E09EBC15927_3F8B270547171391_6036_UN""","""CC1=CC(=CC=C1)CNCCN(CC(CC)N)[S](=O)(=O)C""",21,"""4079DF4ADF414ADD"""
+"""D36E6428FD807DB3_3DA57224451CA3BA_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""4079DF4ADF414ADD"""
+"""C1A9D706D7577264_AE676D689FE4785E_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](C)(=O)=O)CCN=[N]#N""",21,"""4079DF4ADF414ADD"""
+"""A01CA459D4C91D51_7ED65ACE99997C7A_6036_UN""","""CC1=CC(=CC=C1)CNCCN(CC(C)(C)N)[S](=O)(=O)C""",21,"""4079DF4ADF414ADD"""
+"""6706829117A848FE_34D93D7F0E57FBF7_6036_UN""","""CC1=CC(=CC=C1)CNCCN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""4079DF4ADF414ADD"""
+"""514705E62EDC6118_D8E4A31D047D5FF8_6036_UN""","""CC1=CC(=CC=C1)CNCCN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""4079DF4ADF414ADD"""
+"""EE6526C11DE0442E_D1091779AF287242_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](=O)(=O)C2CC2)CC#C""",21,"""4079DF4ADF414ADD"""
+"""3D728A447CC20FE9_85090DF24826B784_6036_UN""","""CC1=CC(=CC=C1)CNCCN2[S](=O)(=O)C3(CCC2)CC3""",21,"""4079DF4ADF414ADD"""
+"""9DF6507DE95BC0E0_AD62420F6D22FB6C_6036_UN""","""CC1=CC(=CC=C1)CNCCN2CCCC(C)(C)[S]2(=O)=O""",21,"""4079DF4ADF414ADD"""
+"""BF303F0C993EBB34_664BB95BE4E4307F_6036_UN""","""CC1=CC(=CC=C1)CNCCN2CCCC(CC)[S]2(=O)=O""",21,"""4079DF4ADF414ADD"""
+"""70338E766A72CEFF_5722C981815D86D0_6036_UN""","""CC1=CC(=CC=C1)CNCCN2C(C(N)CC[S]2(=O)=O)=O""",21,"""4079DF4ADF414ADD"""
+"""07EF28E20B2B039C_883CAE2FFB55BFFE_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""4079DF4ADF414ADD"""
+"""BB45552161A79FC1_230460B62FC522D2_6036_UN""","""CC1=CC(=CC=C1)CNCCN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""4079DF4ADF414ADD"""
+"""C0F934A57A83FAC5_6368D0E62AFFFB6C_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""4079DF4ADF414ADD"""
+"""147236CDC62F5B60_CB274A32D1E2E404_6036_UN""","""CC1=CC(=CC=C1)CNCCN2[S](CCN(C)CC2)(=O)=O""",21,"""4079DF4ADF414ADD"""
+"""4E2F75FD9FF32BEA_47B06CBFB94B0FE7_6036_UN""","""CC1=CC(=CC=C1)CNCCN2CC(=O)NCC[S]2(=O)=O""",21,"""4079DF4ADF414ADD"""
+"""9C0CEEB4428BF5BA_124B71B614EEC873_6036_UN""","""CC1=CC(=CC=C1)CNCCN2[S](CCCCC2C)(=O)=O""",21,"""4079DF4ADF414ADD"""
+"""D3678E187EAEC256_68E3347ABA0E278D_6036_UN""","""CC1=CC(=CC=C1)CNCCN(CCN)[S](=O)(=O)C2CC2""",21,"""4079DF4ADF414ADD"""
+"""893B053390A6AD38_0E1912BB1E22B57A_6036_UN""","""CC1=CC(=CC=C1)CNCCN(CCN)[S](=O)(=O)C(F)F""",21,"""4079DF4ADF414ADD"""
+"""619E648E7CE0CC2B_AE1C8EDE20294B98_6036_UN""","""CC1=CC(=CC=C1)CNCCN([S](CC)(=O)=O)C2CNC2""",21,"""4079DF4ADF414ADD"""
+"""38FB3889DCA66CF1_9C855AE2B7C01FE5_6036_DP""","""CC1=CC(=CC=C1)CNCCN3CC2(CNC2)C[S]3(=O)=O""",21,"""4079DF4ADF414ADD"""
+"""2AD322C04BCF4FB8_26F023706E035B8F_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""4079DF4ADF414ADD"""
+"""4F93092F0378D41F_DA1BBB2067614B3F_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""4079DF4ADF414ADD"""
+"""C55404C8CEB9C635_E47ADC97AA5F83A4_6036_UN""","""CC1=CC(=CC=C1)CNCCN(C(C)(C)CN)[S](=O)(=O)C""",21,"""4079DF4ADF414ADD"""
+"""FF1B083C880B1F76_411E08158BA59EBD_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC(=CC=C2)OC3CCCC3)F""",21,"""40EE59417A3E6761"""
+"""841A17E1C12EAE0D_EE69F03970B53241_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC(=C(OCC)C=C2)OCC)F""",21,"""40EE59417A3E6761"""
+"""E9E222087CB8D5B9_126987FEEF5EC56B_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC=CC(=C2)OCCC(C)C)F""",21,"""40EE59417A3E6761"""
+"""7A03428640C95311_4E537FA87C72F36F_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC=C(C=C2)C[N]3C=CN=C3)F""",21,"""40EE59417A3E6761"""
+"""183097E21CC7EBB8_7D7B1069FB1C05C7_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC=C(C=C2)OC3CCOC3)F""",21,"""40EE59417A3E6761"""
+"""D237EB6D1E7CD0DC_B69AF41D236BF134_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC(=C(OC)C=C2)CN(C)C)F""",21,"""40EE59417A3E6761"""
+"""0D578C31CA39D998_6EF5D01177AFE0BC_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC=CC(=C2)COCCOC)F""",21,"""40EE59417A3E6761"""
+"""E362B4B8A93F75D0_E7985D107913EBD0_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC=CC(=C2)CN(C)C3CC3)F""",21,"""40EE59417A3E6761"""
+"""CABC54AEC79D9A40_F88349F34E590CB5_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC=CC(=C2)OC(COC)C)F""",21,"""40EE59417A3E6761"""
+"""41EAA3DA5CCFD3C7_AAC2B1C7C5ECAC99_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC(=C(C(NOC)=O)C=C2)F)F""",21,"""40EE59417A3E6761"""
+"""1AC441BC50BC5302_BF3B57F35E910DDB_6005_UN""","""NC1=C(C=C(C=C1F)C2=C(OC)N=C(C=C2)C(F)(F)F)F""",21,"""40EE59417A3E6761"""
+"""95D53F6A0861EE31_C68038DFA9AB31A6_6005_UN""","""NC1=C(C=C(C=C1F)C2=CC(=CC=C2)CN3CCCC3)F""",21,"""40EE59417A3E6761"""
+"""758EFA7F3C2867E2_DFA41CDDC1C7DE26_6005_UN""","""NC1=C(C=C(C=C1F)C3=CC=C([N]2C=C(C)C=N2)C=C3)F""",21,"""40EE59417A3E6761"""
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+"""FCD89384FB0DA1C6_4BE98C540588CAAC_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""411A988A4F2DCC41"""
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+"""732ADE8D955D1984_D35E07B18DB89CC3_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""411A988A4F2DCC41"""
+"""B1557EC63B705445_F67FB7026DB75218_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""411A988A4F2DCC41"""
+"""95717719BDE158A4_90820743443EE378_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=CC=C(OCCC(C)C)C=C2""",21,"""411A988A4F2DCC41"""
+"""0F02B7240EC4AADF_6DEF6455BA747328_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=CC=C(C=C2)OC3CCCC3""",21,"""411A988A4F2DCC41"""
+"""F5E39912FB03D78A_ECD9BDAB0D8F1BFC_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""411A988A4F2DCC41"""
+"""D521B92E68DB9BF8_99A6DF9977A3BF4B_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""411A988A4F2DCC41"""
+"""3224159ECAB21162_66411815A0A241A6_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""411A988A4F2DCC41"""
+"""1A437B235353A5A2_91C6F1E08BDB6CB8_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""411A988A4F2DCC41"""
+"""4B7061FEE163C4DB_E7CDDFFC43B76BD3_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""411A988A4F2DCC41"""
+"""07F5EA07F4B6AB20_22FD4EC6DA5302AC_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""411A988A4F2DCC41"""
+"""278B74AD8BF3FC97_48997BE0256509CC_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""411A988A4F2DCC41"""
+"""6A73B53EDE169E3C_39A2C995346E873F_6005_UN""","""CC1=C(C=C(C=C1N)Br)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""411A988A4F2DCC41"""
+"""C8935FAFA71A1D72_8B6925E0F6278E7D_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""411A988A4F2DCC41"""
+"""96F698BED441BA59_FEA7B768CC8B1E4F_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""411A988A4F2DCC41"""
+"""E74161C1480DEFC8_AD5BEF31F2F9BF5E_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=C(C=CC=C2)CN3CCCC3""",21,"""411A988A4F2DCC41"""
+"""6F7F25F134E63488_358FBFB04E4B5CE4_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=CC(=N[N]2C3CCCCO3)C""",21,"""411A988A4F2DCC41"""
+"""1077DD8416DE7881_3F8895B31736B819_6005_UN""","""CC1=C(C=C(C=C1N)Br)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""411A988A4F2DCC41"""
+"""D2D5153E8CE7D5D3_40D88CD10310613A_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""4128DD85F28B98E6"""
+"""2B7823D55D04551E_EFAF74FDF800CDC6_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""4128DD85F28B98E6"""
+"""880E765315D06D57_13AF033A67EB3AEC_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""4128DD85F28B98E6"""
+"""CF847B435FB27D71_4F95FB6CF4C70CE8_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""4128DD85F28B98E6"""
+"""A2B0BCD6D1E4EC94_7CBD94AD73A9FA40_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""4128DD85F28B98E6"""
+"""4926F1C909DB252E_B75C70D9ABDE0EB3_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""4128DD85F28B98E6"""
+"""5E1179574ECE8E9A_6F3354D5FF1A1F3B_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=CC(=C2)COCCOC""",21,"""4128DD85F28B98E6"""
+"""DEFFA33D5EF4D4FE_E65ED9D4F1A61457_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""4128DD85F28B98E6"""
+"""CECA40B1F667A41A_F945CD37C6ECF332_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""4128DD85F28B98E6"""
+"""41B81CD748CEF05D_AB0435034D59531E_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""4128DD85F28B98E6"""
+"""CC4734FE95BA94D2_BEFDD337D624F25C_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""4128DD85F28B98E6"""
+"""BDD2C53E111FE9E9_C746BC1B211ECE21_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""4128DD85F28B98E6"""
+"""C75A682971AB181A_DE629819497221A1_6005_UN""","""NC(=O)C1=NC=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""4128DD85F28B98E6"""
+"""13FC5E6F98239982_A396C7FBCE6490C8_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""4128DD85F28B98E6"""
+"""676BD0366FD46C95_544B0B395F0633F3_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""4128DD85F28B98E6"""
+"""16B5180C34342F3D_636C33BDA86C3047_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""4128DD85F28B98E6"""
+"""CF246FAE0A6DD639_B1A0CD3982631AF4_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""4128DD85F28B98E6"""
+"""84C4803FF682F0B8_617503B177392EE7_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""4128DD85F28B98E6"""
+"""A75009C46384B7EF_4EE037FE641E4C22_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""4128DD85F28B98E6"""
+"""EBBA9707A919ECEA_4BDBC95BB82E9E0B_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""4128DD85F28B98E6"""
+"""B7F3DA83AE614B94_8E206FACD8AE023F_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""4128DD85F28B98E6"""
+"""D38D9D24B17C5A33_9E0CFFFD0740B6CB_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""4128DD85F28B98E6"""
+"""7AAFC5068ECAB69D_431FA6C4A9E342B1_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""4128DD85F28B98E6"""
+"""B880BE6BD28641AF_D36C42BE301EC864_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""4128DD85F28B98E6"""
+"""3ECB076794C5174A_F64DF20DD01106BF_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""4128DD85F28B98E6"""
+"""38088A4549540896_90B0424CF998B7DF_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""4128DD85F28B98E6"""
+"""0C54EEA6016FB59C_6DDD215A07D2278F_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""4128DD85F28B98E6"""
+"""1C61A4CE984A7144_ECEBF8A4B0294F5B_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""4128DD85F28B98E6"""
+"""40FA010DA38CA131_99949A96CA05EBEC_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""4128DD85F28B98E6"""
+"""DC0C5D17A3A5EB84_66735D1A1D041501_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""4128DD85F28B98E6"""
+"""EE32091D747A0599_91F4B4EF367D381F_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""4128DD85F28B98E6"""
+"""50584A033495DA45_E7FF9AF3FE113F74_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""4128DD85F28B98E6"""
+"""62990319326B2CD2_22CF0BC967F5560B_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""4128DD85F28B98E6"""
+"""C2D483FE3E4D2DF3_48AB3EEF98C35D6B_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""4128DD85F28B98E6"""
+"""18E4809EB1E19A50_39908C9A89C8D398_6005_UN""","""NC(=O)C1=NC=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""4128DD85F28B98E6"""
+"""761FEDB148444A59_8B5B60EF4B81DADA_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""4128DD85F28B98E6"""
+"""C6624F6CC87232C6_FE95F267712D4AE8_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""4128DD85F28B98E6"""
+"""0480A10329DA2515_AD69AA3E4F5FEBF9_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""4128DD85F28B98E6"""
+"""E0A34B95AED7DB3E_35BDFABFF3ED0843_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""4128DD85F28B98E6"""
+"""2C358109CB743223_3FBAD0BCAA90ECBE_6005_UN""","""NC(=O)C1=NC=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""4128DD85F28B98E6"""
+"""22323087741C7018_BC8C1BE5C70CABDF_6036_UN""","""CCCC(CN([S](CCN)(=O)=O)C1CC1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""35408B32F4D5CA85_27F5CB6F6AAFA471_6036_UN""","""CCCC(CN(C(C)C)[S](=O)(=O)CCN)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""948868BE85FA241A_707A27DA84EF872D_6036_UN""","""CCCC(CN([S](C)(=O)=O)CCN=C=S)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""BBE8CDD256AF0A46_6D6C2662CA47FEE5_6036_UN""","""CCCC(CN([S](CC)(=O)=O)CCCN)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""0956F3F57E5D2B18_E7B3838F3C93CBC4_6036_UN""","""CCCC(CN([S](C)(=O)=O)C1CC(C1)N)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""0DEFBB3A9BCE882F_A1698B880CA64945_6036_UN""","""CCCC(CN(CCCN)[S](=O)(=O)CCl)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""03DABCB3D52CED4D_548807CEDE34DC04_6036_UN""","""CCCC(CN(C)[S](=O)(=O)C1CNCC1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""CC9E1F9865E36B86_EAD00CD961DB79C0_6036_UN""","""CCCC(CN([S](CC)(=O)=O)CCCBr)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""DC58BEF8E3D477E3_5E0A8DD9C4D5FA4E_6036_UN""","""CCCC(CN(CCCNC)[S](=O)(=O)C)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""18AB4156748383A6_BB6785BF4D1CE016_6036_UN""","""CCCC(CN(C(C)(C)C#N)[S](=O)(=O)C)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""A583C5DA69D719E8_E92CEFA4112333DE_6036_UN""","""CCCC(CN([S](=O)(=O)CC#N)C1CC1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""28F99D69DDE950C1_6AF884D2F98571C9_6036_UN""","""CCCC(CN([S](C)(=O)=O)C(=O)CCN)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""85EBE0609D62B20D_ACFED3221DDBC53A_6036_UN""","""CCCC(CN(C)[S](=O)(=O)C1=CC=CS1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""25D27ABF034ACE7B_0E588EBB0D94D77B_6036_UN""","""CCCC(CN(C(C)(C)C)[S](=O)(=O)CCl)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""24DCDBBEFDEEF1E1_C33FD5F2D2DAF724_6036_UN""","""CCCC(CN(C(C)(C)C)[S](=O)(=O)CBr)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""3163CE1214A84929_37427A451DDAA78D_6036_UN""","""CCCC(CN(C(C)(C)C#C)[S](=O)(=O)C)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""3C722486F0366040_3DB69D4581A19F8B_6036_UN""","""CCCC(CN(CC(CC)N)[S](=O)(=O)C)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""75D87A5E23DD2D82_3F98C86483AA2FA0_6036_UN""","""CCCC(CN(C)[S](=O)(=O)C1=C[NH]C=N1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""E8A12886950D9B76_AC5AD7285952F444_6036_UN""","""CCCC(CN([S](C)(=O)=O)CCN=[N]#N)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""68659260656D396C_7CEBE08E5F2FF060_6036_UN""","""CCCC(CN(CC(C)(C)N)[S](=O)(=O)C)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""98F6B32878A902E2_36E4873FC8E177ED_6036_UN""","""CCCC(CN1[S](CC(C)(C)C1=O)(=O)=O)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""13199AE8B622CD0C_DAD9195DC2CBD3E2_6036_UN""","""CCCC(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)N3CCNCC3""",21,"""4244650A19F7C6C7"""
+"""101E536A0E10314B_D334AD39699EFE58_6036_UN""","""CCCC(CN([S](=O)(=O)C1CC1)CC#C)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""FC83C14081FC168D_8734B7B28E903B9E_6036_UN""","""CCCC(CN1[S](=O)(=O)C2(CCC1)CC2)N3CCNCC3""",21,"""4244650A19F7C6C7"""
+"""7242BDF0754CAC19_AF5FF84FAB947776_6036_UN""","""CCCC(CN1CCCC(C)(C)[S]1(=O)=O)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""F2C74EA8D0CF7552_6476031B2252BC65_6036_UN""","""CCCC(CN1CCCC(CC)[S]1(=O)=O)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""6DC4CCAA55530ABB_551F73C147EB0ACA_6036_UN""","""CCCC(CN1C(C(N)CC[S]1(=O)=O)=O)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""FEF181A001D68713_8A01146F3DE333E4_6036_UN""","""CCCC(CN([S](C)(=O)=O)[C@@H]1CNCC1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""FF950BB1189BA114_2139DAF6E973AEC8_6036_UN""","""CCCC(CN1CCCC(Cl)(Cl)[S]1(=O)=O)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""24680A28D7CFD976_61556AA6EC497776_6036_UN""","""CCCC(CN([S](C)(=O)=O)[C@H]1CNCC1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""E8212FA065B8BA00_C91AF0721754681E_6036_UN""","""CCCC(CN1[S](CCN(C)CC1)(=O)=O)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""9B5250B04282FBC0_458DD6FF7FFD83FD_6036_UN""","""CCCC(CN1CC(=O)NCC[S]1(=O)=O)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""973FD61EC23F71AB_1076CBF6D2584469_6036_UN""","""CCCC(CN1[S](CCCCC1C)(=O)=O)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""AF536618934C0DE1_6ADE8E3A7CB8AB97_6036_UN""","""CCCC(CN(CCN)[S](=O)(=O)C1CC1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""5B237902E6645998_0C24A8FBD8943960_6036_UN""","""CCCC(CN(CCN)[S](=O)(=O)C(F)F)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""AFEC7F3970AB491A_AC21349EE69FC782_6036_UN""","""CCCC(CN([S](CC)(=O)=O)C1CNC1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""2F8EC25D98F24F4E_9EB8E0A2717693FF_6036_DP""","""CCCC(CN2CC1(CNC1)C[S]2(=O)=O)N3CCNCC3""",21,"""4244650A19F7C6C7"""
+"""FEB8DDDA97D735F6_24CD9930A8B5D795_6036_UN""","""CCCC(CN(C)[S](=O)(=O)C1=N[NH]C=N1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""CDF6A7E7D3E8AD08_D8260160A1D7C725_6036_UN""","""CCCC(CN(C)[S](=O)(=O)C1=C[NH]N=C1)N2CCNCC2""",21,"""4244650A19F7C6C7"""
+"""01C15028BB71AD4C_E64766D76CE90FBE_6036_UN""","""CCCC(CN(C(C)(C)CN)[S](=O)(=O)C)N1CCNCC1""",21,"""4244650A19F7C6C7"""
+"""8D42480AD3585A10_4328990DD95CE515_6025_UN""","""C1(=NC(=CC(=N1)C)C#N)C2=CC(=CC=C2)OC3CCCC3""",21,"""42D8C85928C71CC9"""
+"""8956137063621731_EC5F6121224C49E9_6025_UN""","""C1(=NC(=CC(=N1)C)C#N)C2=CC(=C(OCC)C=C2)OCC""",21,"""42D8C85928C71CC9"""
+"""8B53FAEEBC5B47DB_105F16E6BDA7BEC3_6025_UN""","""C1(=NC(=CC(=N1)C)C#N)C2=CC=CC(=C2)OCCC(C)C""",21,"""42D8C85928C71CC9"""
+"""F1B1D7812D524F70_4C65EEB02E8B88C7_6025_UN""","""C1(=NC(=CC(=N1)C)C#N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""42D8C85928C71CC9"""
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+"""121CA35AF55BAE5F_DC052BB12E994397_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""449857E6F5A556B2"""
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+"""4D47C0708A3B0205_A983CAA347C6E703_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""449857E6F5A556B2"""
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+"""399EC3F3F8DA0C4A_8CDD2683D1B1A391_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""449857E6F5A556B2"""
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+"""1D62EBF50631944A_6789584A001BE703_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""449857E6F5A556B2"""
+"""C17EDC85CCB347C6_CFC6C29EFB06F86B_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N3[S](CCN(C)CC3)(=O)=O""",21,"""449857E6F5A556B2"""
+"""042A8F020CFA02C8_4351E41393AF1388_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N3CC(=O)NCC[S]3(=O)=O""",21,"""449857E6F5A556B2"""
+"""376E4B7350BCFD9E_16AAF91A3E0AD41C_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N3[S](CCCCC3C)(=O)=O""",21,"""449857E6F5A556B2"""
+"""CF8CA69D72698998_6C02BCD690EA3BE2_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N(CCN)[S](=O)(=O)C3CC3""",21,"""449857E6F5A556B2"""
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+"""F5C97C6CA3255A78_9864D24E9D24038A_6036_DP""","""CC(C1=C[N](N=N1)C2CNC2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""449857E6F5A556B2"""
+"""EC3B025A3235B957_2211ABDC44E747E0_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""449857E6F5A556B2"""
+"""95EF489115E489D2_DEFA338C4D855750_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""449857E6F5A556B2"""
+"""E1E620AB1413E750_E09B543B80BB9FCB_6036_UN""","""CC(C1=C[N](N=N1)C2CNC2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""449857E6F5A556B2"""
+"""AAEB276EC2D6B88C_455532FAD386996F_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=CC=C2)OC3CCCC3""",21,"""44A563AE221D60B3"""
+"""1B4DEC246CD0D1E2_EA22CAD628963593_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=C(OCC)C=C2)OCC""",21,"""44A563AE221D60B3"""
+"""45D4AEB88E30B0DF_1622BD11B77DC2B9_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=CC(=C2)OCCC(C)C""",21,"""44A563AE221D60B3"""
+"""ED07935CA9875E25_4A1845472451F4BD_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""44A563AE221D60B3"""
+"""A96055D02E5210DB_79302A86A33F0215_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=C(C=C2)OC3CCOC3""",21,"""44A563AE221D60B3"""
+"""A8D510D71D2BF8B3_B2D1CEF27B48F6E6_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""44A563AE221D60B3"""
+"""780B102D1816080C_6ABEEAFE2F8CE76E_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=CC(=C2)COCCOC""",21,"""44A563AE221D60B3"""
+"""DC0432D5F5562C03_E3D367FF2130EC02_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""44A563AE221D60B3"""
+"""4D90F2CFB88753A0_FCC8731C167A0B67_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=CC(=C2)OC(COC)C""",21,"""44A563AE221D60B3"""
+"""B0FF29BC1F3F50D8_AE898B289DCFAB4B_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""44A563AE221D60B3"""
+"""1FD617D6F2C8762C_BB706D1C06B20A09_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""44A563AE221D60B3"""
+"""3484DBC9D1758BDD_C2CB0230F1883674_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=CC=C2)CN3CCCC3""",21,"""44A563AE221D60B3"""
+"""6EF9A9341DFCB1C3_DBEF263299E4D9F4_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""44A563AE221D60B3"""
+"""FBAB1BFF45CBEE32_A61B79D01EF2689D_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=CC(=C2)OCCN(C)C""",21,"""44A563AE221D60B3"""
+"""1A975650B4D18E6B_51C6B5128F90CBA6_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""44A563AE221D60B3"""
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+"""059334FAC63B8DFD_B42D731252F5E2A1_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""44A563AE221D60B3"""
+"""B62E611DE8233275_64F8BD9AA7AFD6B2_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""44A563AE221D60B3"""
+"""22E0A70801A24BF5_DF770D8A7D203E1C_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""44A563AE221D60B3"""
+"""1A743D055FE32599_4B6D89D5B488B477_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""44A563AE221D60B3"""
+"""1FA85B004EB85CB6_4E56777068B8665E_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""44A563AE221D60B3"""
+"""60D1BB412ED69047_8BADD1870838FA6A_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""44A563AE221D60B3"""
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+"""58393BCE67593DF6_469218EF7975BAE4_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""44A563AE221D60B3"""
+"""3A20DAA98FD6B315_D6E1FC95E0883031_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""44A563AE221D60B3"""
+"""D3BDF6A202DA0F82_F3C04C260087FEEA_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""44A563AE221D60B3"""
+"""2F3EE8328EF3F444_953DFC67290E4F8A_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=C(OCCC(C)C)C=C2""",21,"""44A563AE221D60B3"""
+"""C7977E7AE42890CE_68509F71D744DFDA_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=C(C=C2)OC3CCCC3""",21,"""44A563AE221D60B3"""
+"""166631D89E48B116_E966468F60BFB70E_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""44A563AE221D60B3"""
+"""5A5F963856592510_9C1924BD1A9313B9_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""44A563AE221D60B3"""
+"""3B1CACDBCAF729BD_63FEE331CD92ED54_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""44A563AE221D60B3"""
+"""BA38E4AC9A6DB93A_94790AC4E6EBC04A_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""44A563AE221D60B3"""
+"""34719699C33EA64E_E27224D82E87C721_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""44A563AE221D60B3"""
+"""6229A780DF8C6B76_2742B5E2B763AE5E_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""44A563AE221D60B3"""
+"""7B21BED827FACB0F_4D2680C44855A53E_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""44A563AE221D60B3"""
+"""294A2B6296A10764_3C1D32B1595E2BCD_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""44A563AE221D60B3"""
+"""EA4ED46FC3E437AE_8ED6DEC49B17228F_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""44A563AE221D60B3"""
+"""684EFFEAAB834508_FB184C4CA1BBB2BD_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""44A563AE221D60B3"""
+"""BEF07E5A6FE6CBC5_A8E414159FC913AC_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(C=CC=C2)CN3CCCC3""",21,"""44A563AE221D60B3"""
+"""DFF9BEBD0DF97E90_3A376E977A0614EB_6025_UN""","""C1(=NN=C(O1)C(C)(C)C)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""44A563AE221D60B3"""
+"""6C18B502399A7E72_4556569646235527_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=CC=C2)OC3CCCC3""",21,"""44A607C2B7B8ACFB"""
+"""229BC4BCACD6ADBD_EA21AEBABD33F9DB_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=C(OCC)C=C2)OCC""",21,"""44A607C2B7B8ACFB"""
+"""48B7FC1D41EA3FB7_1621D97D22D80EF1_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=CC(=C2)OCCC(C)C""",21,"""44A607C2B7B8ACFB"""
+"""C9CBA8007C71F79E_4A1B212BB1F438F5_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""44A607C2B7B8ACFB"""
+"""FEF43CD5C8357AE4_79334EEA369ACE5D_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=C(C=C2)OC3CCOC3""",21,"""44A607C2B7B8ACFB"""
+"""1C83E45819A6C6DD_B2D2AA9EEEED3AAE_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""44A607C2B7B8ACFB"""
+"""2A01E155EACCB240_6ABD8E92BA292B26_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=CC(=C2)COCCOC""",21,"""44A607C2B7B8ACFB"""
+"""3625CB41AD9C01C1_E3D00393B495204A_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""44A607C2B7B8ACFB"""
+"""DB226DA6680307E7_FCCB177083DFC72F_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=CC(=C2)OC(COC)C""",21,"""44A607C2B7B8ACFB"""
+"""83456E07E590481F_AE8AEF44086A6703_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""44A607C2B7B8ACFB"""
+"""EF9B717FAF5CE75B_BB7309709317C641_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""44A607C2B7B8ACFB"""
+"""6429D05F6EE06BD3_C2C8665C642DFA3C_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=CC=C2)CN3CCCC3""",21,"""44A607C2B7B8ACFB"""
+"""E51BAF4CA3824913_DBEC425E0C4115BC_6005_UN""","""OCC1=CC(=CC(=C1)Br)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""44A607C2B7B8ACFB"""
+"""02C562ECCD1F0E35_A6181DBC8B57A4D5_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=CC(=C2)OCCN(C)C""",21,"""44A607C2B7B8ACFB"""
+"""9DF14861A15F2CCF_51C5D17E1A3507EE_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""44A607C2B7B8ACFB"""
+"""4CB5338D3247D33B_66E2E9FAED5F045A_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""44A607C2B7B8ACFB"""
+"""A66C8F956FBA7765_B42E177EC7502EE9_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""44A607C2B7B8ACFB"""
+"""A01DA6BE7E6F4CB3_64FBD9F6320A1AFA_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""44A607C2B7B8ACFB"""
+"""C12914A2F74D62F5_4B6EEDB9212D783F_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""44A607C2B7B8ACFB"""
+"""BBA25EF2E4E025EA_4E55131CFD1DAA16_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""44A607C2B7B8ACFB"""
+"""07F45AECFF218EE7_8BAEB5EB9D9D3622_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""44A607C2B7B8ACFB"""
+"""C81368F0D75C1408_9B8225BA427382D6_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""44A607C2B7B8ACFB"""
+"""00EABB36297B7BED_46917C83ECD076AC_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""44A607C2B7B8ACFB"""
+"""B872A689CC81FD02_D6E298F9752DFC79_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""44A607C2B7B8ACFB"""
+"""F8FB378A5376835F_F3C3284A952232A2_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""44A607C2B7B8ACFB"""
+"""555B03E2FA20016A_953E980BBCAB83C2_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=C(OCCC(C)C)C=C2""",21,"""44A607C2B7B8ACFB"""
+"""481DA940FA3DF38A_6853FB1D42E11392_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=C(C=C2)OC3CCCC3""",21,"""44A607C2B7B8ACFB"""
+"""9E8889662C1A3C3A_E96522E3F51A7B46_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""44A607C2B7B8ACFB"""
+"""FBD6ABE9C9AD3982_9C1A40D18F36DFF1_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""44A607C2B7B8ACFB"""
+"""2C9F3B2D8A3BA448_63FD875D5837211C_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""44A607C2B7B8ACFB"""
+"""A02386EF9F19903B_947A6EA8734E0C02_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""44A607C2B7B8ACFB"""
+"""81E7DF7F73C14B1B_E27140B4BB220B69_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""44A607C2B7B8ACFB"""
+"""21DA917D70890D1A_2741D18E22C66216_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""44A607C2B7B8ACFB"""
+"""A239035F181C4BE9_4D25E4A8DDF06976_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""44A607C2B7B8ACFB"""
+"""FE587B3681E3F139_3C1E56DDCCFBE785_6005_UN""","""OCC1=CC(=CC(=C1)Br)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""44A607C2B7B8ACFB"""
+"""71881C99B07116C3_8ED5BAA80EB2EEC7_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""44A607C2B7B8ACFB"""
+"""CA210C4D219D6281_FB1B2820341E7EF5_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""44A607C2B7B8ACFB"""
+"""0506B95EDE243997_A8E770790A6CDFE4_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(C=CC=C2)CN3CCCC3""",21,"""44A607C2B7B8ACFB"""
+"""C2069730ADB00D15_303320F8B6DE3C5E_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=CC(=N[N]2C3CCCCO3)C""",21,"""44A607C2B7B8ACFB"""
+"""66ED063D15A5BD8D_3A340AFBEFA3D8A3_6005_UN""","""OCC1=CC(=CC(=C1)Br)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""44A607C2B7B8ACFB"""
+"""8E821559F843A441_B8876E05B718B536_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](CCN)(=O)=O)C2CC2""",21,"""464F10EA69E3D82E"""
+"""EFC5175FB5633BEA_23FEBE8F1ABBBA98_6036_UN""","""CC(CNCC1=CC=CC=C1)N(C(C)C)[S](=O)(=O)CCN""",21,"""464F10EA69E3D82E"""
+"""799539661F37A33A_7471523AF4FB99C4_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](C)(=O)=O)CCN=C=S""",21,"""464F10EA69E3D82E"""
+"""8F498A635D6783E1_69675382BA53E00C_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](CC)(=O)=O)CCCN""",21,"""464F10EA69E3D82E"""
+"""B58237AF80CA7E9C_E3B8F66F4C87D52D_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](C)(=O)=O)C2CC(C2)N""",21,"""464F10EA69E3D82E"""
+"""F761ADAA98152431_A562FE687CB257AC_6036_UN""","""CC(CNCC1=CC=CC=C1)N(CCCN)[S](=O)(=O)CCl""",21,"""464F10EA69E3D82E"""
+"""589AA0E2D3588562_5083722EAE20C2ED_6036_UN""","""CC(CNCC1=CC=CC=C1)N(C)[S](=O)(=O)C2CNCC2""",21,"""464F10EA69E3D82E"""
+"""6EDD03E076C76E02_EEDB793911CF6729_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](CC)(=O)=O)CCCBr""",21,"""464F10EA69E3D82E"""
+"""DDB2E4239EC47EBE_5A01F839B4C1E4A7_6036_UN""","""CC(CNCC1=CC=CC=C1)N(CCCNC)[S](=O)(=O)C""",21,"""464F10EA69E3D82E"""
+"""A939DA5DF8591F98_BF6CF05F3D08FEFF_6036_UN""","""CC(CNCC1=CC=CC=C1)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""464F10EA69E3D82E"""
+"""44E1B84E355AFE08_ED279A4461372D37_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](=O)(=O)CC#N)C2CC2""",21,"""464F10EA69E3D82E"""
+"""A781D8F7BEBCBF8F_6EF3F13289916F20_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](C)(=O)=O)C(=O)CCN""",21,"""464F10EA69E3D82E"""
+"""C0CCC7F210E8A2C4_A8F5A6C26DCFDBD3_6036_UN""","""CC(CNCC1=CC=CC=C1)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""464F10EA69E3D82E"""
+"""D39A5C0795CA0A69_0A53FB5B7D80C992_6036_UN""","""CC(CNCC1=CC=CC=C1)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""464F10EA69E3D82E"""
+"""23FD59AA9147C6A6_C734A012A2CEE9CD_6036_UN""","""CC(CNCC1=CC=CC=C1)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""464F10EA69E3D82E"""
+"""67D0881BFFA0336F_33490FA56DCEB964_6036_UN""","""CC(CNCC1=CC=CC=C1)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""464F10EA69E3D82E"""
+"""3DC9B9C93AF19930_39BDE8A5F1B58162_6036_UN""","""CC(CNCC1=CC=CC=C1)N(CC(CC)N)[S](=O)(=O)C""",21,"""464F10EA69E3D82E"""
+"""AC5EEFA60F7E5CFC_3B93BD84F3BE3149_6036_UN""","""CC(CNCC1=CC=CC=C1)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""464F10EA69E3D82E"""
+"""3CD06438001E0FB9_A851A2C82946EAAD_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](C)(=O)=O)CCN=[N]#N""",21,"""464F10EA69E3D82E"""
+"""933A9F0C5765B08A_78E0956E2F3BEE89_6036_UN""","""CC(CNCC1=CC=CC=C1)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""464F10EA69E3D82E"""
+"""4AD258F0A087F87C_32EFF2DFB8F56904_6036_UN""","""CC(CNCC1=CC=CC=C1)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""464F10EA69E3D82E"""
+"""0E12E25B10C9C3B9_DED26CBDB2DFCD0B_6036_UN""","""CC(CNCC1=CC=CC=C1)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""464F10EA69E3D82E"""
+"""FDD3EF065FF249C9_D73FD8D9198AE0B1_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](=O)(=O)C2CC2)CC#C""",21,"""464F10EA69E3D82E"""
+"""3956907F58B4FA25_833FC252FE842577_6036_UN""","""CC(CNCC1=CC=CC=C1)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""464F10EA69E3D82E"""
+"""230864750F224ECB_AB548DAFDB80699F_6036_UN""","""CC(CNCC1=CC=CC=C1)N2CCCC(C)(C)[S]2(=O)=O""",21,"""464F10EA69E3D82E"""
+"""EC502C76A281233F_607D76FB5246A28C_6036_UN""","""CC(CNCC1=CC=CC=C1)N2CCCC(CC)[S]2(=O)=O""",21,"""464F10EA69E3D82E"""
+"""F835FDF4DB0E210A_5114062137FF1423_6036_UN""","""CC(CNCC1=CC=CC=C1)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""464F10EA69E3D82E"""
+"""0EF636A08968B14E_8E0A618F4DF72D0D_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""464F10EA69E3D82E"""
+"""5E05BE714982F3E8_2532AF169967B021_6036_UN""","""CC(CNCC1=CC=CC=C1)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""464F10EA69E3D82E"""
+"""C3F514581CA63C28_655E1F469C5D699F_6036_UN""","""CC(CNCC1=CC=CC=C1)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""464F10EA69E3D82E"""
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+"""339D799A880ABFC5_5428FA701DB04C9D_6036_UN""","""C(CNCC1=CC=C(C=C1)Cl)N(CCCNC)[S](=O)(=O)C""",21,"""486612A3C0927014"""
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+"""380D7DCCAB583236_E30E980DC846850D_6036_UN""","""C(CNCC1=CC=C(C=C1)Cl)N([S](=O)(=O)CC#N)C2CC2""",21,"""486612A3C0927014"""
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+"""D4917DC1FFF1CD0B_802363C6E4868537_6036_UN""","""C(CNCC1=CC=C(C=C1)Cl)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""486612A3C0927014"""
+"""CBF84470C1EDF884_2B1BAD5F3016181B_6036_UN""","""C(CNCC1=CC=C(C=C1)Cl)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""486612A3C0927014"""
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+"""64505FC725F3C8D9_C33887DBCE31DECD_6036_UN""","""C(CNCC1=CC=C(C=C1)Cl)N2[S](CCN(C)CC2)(=O)=O""",21,"""486612A3C0927014"""
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+"""EFA4AA5FA49987D6_60FCF993A5DD1D44_6036_UN""","""C(CNCC1=CC=C(C=C1)Cl)N(CCN)[S](=O)(=O)C2CC2""",21,"""486612A3C0927014"""
+"""176BDA47F01C1021_0606DF5201F18FB3_6036_UN""","""C(CNCC1=CC=C(C=C1)Cl)N(CCN)[S](=O)(=O)C(F)F""",21,"""486612A3C0927014"""
+"""B18557AF51757A1A_A60343373FFA7151_6036_UN""","""C(CNCC1=CC=C(C=C1)Cl)N([S](CC)(=O)=O)C2CNC2""",21,"""486612A3C0927014"""
+"""CED3AEBDA8AACC3D_949A970BA813252C_6036_DP""","""C(CNCC1=CC=C(C=C1)Cl)N3CC2(CNC2)C[S]3(=O)=O""",21,"""486612A3C0927014"""
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+"""17AAA173510E8E30_D20476C978B271F6_6036_UN""","""C(CNCC1=CC=C(C=C1)Cl)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""486612A3C0927014"""
+"""4C901078BE274338_EC65117EB58CB96D_6036_UN""","""C(CNCC1=CC=C(C=C1)Cl)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""486612A3C0927014"""
+"""A8A893384029E444_48C74D6631210577_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC(=CC=C2)OC3CCCC3""",21,"""49371C32C0BAFCAB"""
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+"""F9E3228A32CE6FBE_1BB0C28D55DA5EA1_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC=CC(=C2)OCCC(C)C""",21,"""49371C32C0BAFCAB"""
+"""408931D2E77A0CCF_478A3ADBC6F668A5_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""49371C32C0BAFCAB"""
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+"""AF78F73F31430757_CF597DAC132FAA6C_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC(=CC=C2)CN3CCCC3""",21,"""49371C32C0BAFCAB"""
+"""7BC849B14855C209_D67D59AE7B4345EC_6005_UN""","""OC1=C(C=C(C=C1)C#N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""49371C32C0BAFCAB"""
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+"""F2B74F77387EF66C_6B73F20A9A5D540A_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""49371C32C0BAFCAB"""
+"""64E009EEBDCC4768_B9BF0C8EB0527EB9_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""49371C32C0BAFCAB"""
+"""8DB6A9BDA9B1A5DA_696AC20645084AAA_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""49371C32C0BAFCAB"""
+"""46111F95CF435FF5_46FFF649562F286F_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""49371C32C0BAFCAB"""
+"""CA282F1476718A5B_43C408EC8A1FFA46_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""49371C32C0BAFCAB"""
+"""D7E0897B00E4990F_863FAE1BEA9F6672_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""49371C32C0BAFCAB"""
+"""8A99DA86682FBE56_96133E4A3571D286_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""49371C32C0BAFCAB"""
+"""4EDAF21FC5E3DEF6_4B0067739BD226FC_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""49371C32C0BAFCAB"""
+"""9408AED606C5BAB6_DB738309022FAC29_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""49371C32C0BAFCAB"""
+"""B685ADF7622C3ABE_FE5233BAE22062F2_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""49371C32C0BAFCAB"""
+"""6524635CE6305A40_98AF83FBCBA9D392_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC=C(OCCC(C)C)C=C2""",21,"""49371C32C0BAFCAB"""
+"""3D2FF772B6A479B2_65C2E0ED35E343C2_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC=C(C=C2)OC3CCCC3""",21,"""49371C32C0BAFCAB"""
+"""25A2A41646344E50_E4F4391382182B16_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""49371C32C0BAFCAB"""
+"""E625123A7CC71EC2_918B5B21F8348FA1_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""49371C32C0BAFCAB"""
+"""BE2D9C9D286EEAE5_6E6C9CAD2F35714C_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""49371C32C0BAFCAB"""
+"""E92607A9AFEFD3B4_99EB7558044C5C52_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""49371C32C0BAFCAB"""
+"""65F3FC303E94D53B_EFE05B44CC205B39_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""49371C32C0BAFCAB"""
+"""60D1CA5059FB68A1_2AD0CA7E55C43246_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""49371C32C0BAFCAB"""
+"""3B7329092418D8B2_40B4FF58AAF23926_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""49371C32C0BAFCAB"""
+"""06AAFFC6C43A8159_318F4D2DBBF9B7D5_6005_UN""","""OC1=C(C=C(C=C1)C#N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""49371C32C0BAFCAB"""
+"""F4B295369704E0BA_8344A15879B0BE97_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""49371C32C0BAFCAB"""
+"""790AD2D55E93B2F0_F68A33D0431C2EA5_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""49371C32C0BAFCAB"""
+"""B59E7A005EB67698_A5766B897D6E8FB4_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(C=CC=C2)CN3CCCC3""",21,"""49371C32C0BAFCAB"""
+"""EA78FF0E7662A4BB_3DA23B08C1DC6C0E_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""49371C32C0BAFCAB"""
+"""5022DA4E0C8BD779_37A5110B98A188F3_6005_UN""","""OC1=C(C=C(C=C1)C#N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""49371C32C0BAFCAB"""
+"""4742331816FF2D6C_48470F1C64F3B9C3_6004_DP""","""COC1=NC(=C(C=C1)N)C2=CC(=CC=C2)OC3CCCC3""",21,"""49B75E489568401F"""
+"""9793E498B3200FAA_E730F7309FE3153F_6004_DP""","""COC1=NC(=C(C=C1)N)C2=CC(=C(OCC)C=C2)OCC""",21,"""49B75E489568401F"""
+"""61F971762357F61C_1B3080F70008E215_6004_DP""","""COC1=NC(=C(C=C1)N)C2=CC=CC(=C2)OCCC(C)C""",21,"""49B75E489568401F"""
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+"""004E0919017C47D9_A58555DE6EBDE1EE_6036_UN""","""C(CCNCC1=CC=CC=C1)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""4B3FE3F66A91E213"""
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+"""D70C94E1F4F5E09F_CA44530EA1BCD3F0_6036_UN""","""C(CCNCC1=CC=CC=C1)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""4B3FE3F66A91E213"""
+"""5F79F8A87C3E6B58_3E39FCB96EBC8359_6036_UN""","""C(CCNCC1=CC=CC=C1)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""4B3FE3F66A91E213"""
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+"""DD9C1287E9B14FD8_36E34E98F0CC0B74_6036_UN""","""C(CCNCC1=CC=CC=C1)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""4B3FE3F66A91E213"""
+"""DEBDBE765EE81C5F_A52151D42A34D090_6036_UN""","""C(CCNCC1=CC=CC=C1)N([S](C)(=O)=O)CCN=[N]#N""",21,"""4B3FE3F66A91E213"""
+"""3FD8B759C115821B_759066722C49D4B4_6036_UN""","""C(CCNCC1=CC=CC=C1)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""4B3FE3F66A91E213"""
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+"""A202DABF20C7771A_DA4F2BC51AF8DA8C_6036_UN""","""C(CCNCC1=CC=CC=C1)N([S](=O)(=O)C2CC2)CC#C""",21,"""4B3FE3F66A91E213"""
+"""C22D5BD224F3DD81_8E4F314EFDF61F4A_6036_UN""","""C(CCNCC1=CC=CC=C1)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""4B3FE3F66A91E213"""
+"""C9F0407961CE6C1A_A6247EB3D8F253A2_6036_UN""","""C(CCNCC1=CC=CC=C1)N2CCCC(C)(C)[S]2(=O)=O""",21,"""4B3FE3F66A91E213"""
+"""CDADC79CD6E78B4B_6D0D85E7513498B1_6036_UN""","""C(CCNCC1=CC=CC=C1)N2CCCC(CC)[S]2(=O)=O""",21,"""4B3FE3F66A91E213"""
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+"""7EDF5CD0642B67B3_837A92934E851730_6036_UN""","""C(CCNCC1=CC=CC=C1)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""4B3FE3F66A91E213"""
+"""AAA44FF89F25329E_28425C0A9A158A1C_6036_UN""","""C(CCNCC1=CC=CC=C1)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""4B3FE3F66A91E213"""
+"""45DDB08BC3602BE0_682EEC5A9F2F53A2_6036_UN""","""C(CCNCC1=CC=CC=C1)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""4B3FE3F66A91E213"""
+"""B51FEA6B325F374B_C061768E64324CCA_6036_UN""","""C(CCNCC1=CC=CC=C1)N2[S](CCN(C)CC2)(=O)=O""",21,"""4B3FE3F66A91E213"""
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+"""53C6A1D5D9E0E7B3_190D4D0AA13E60BD_6036_UN""","""C(CCNCC1=CC=CC=C1)N2[S](CCCCC2C)(=O)=O""",21,"""4B3FE3F66A91E213"""
+"""BD507731FC12F3D6_63A508C60FDE8F43_6036_UN""","""C(CCNCC1=CC=CC=C1)N(CCN)[S](=O)(=O)C2CC2""",21,"""4B3FE3F66A91E213"""
+"""89695E361F8C8FE9_055F2E07ABF21DB4_6036_UN""","""C(CCNCC1=CC=CC=C1)N(CCN)[S](=O)(=O)C(F)F""",21,"""4B3FE3F66A91E213"""
+"""6BE2AEFEEE270D4B_A55AB26295F9E356_6036_UN""","""C(CCNCC1=CC=CC=C1)N([S](CC)(=O)=O)C2CNC2""",21,"""4B3FE3F66A91E213"""
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+"""F53657FB777BAD33_2DB61FCCDBD3F341_6036_UN""","""C(CCNCC1=CC=CC=C1)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""4B3FE3F66A91E213"""
+"""D3A431B28FC308A3_D15D879CD2B1E3F1_6036_UN""","""C(CCNCC1=CC=CC=C1)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""4B3FE3F66A91E213"""
+"""94B3B5E4B23A3225_EF3CE02B1F8F2B6A_6036_UN""","""C(CCNCC1=CC=CC=C1)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""4B3FE3F66A91E213"""
+"""7CFF395A63DAEC0C_4A80DFE2340DBDA0_6005_DP""","""COC1=C(C=CC(=C1)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""4B708EB6C596447C"""
+"""74E697673C39BA4F_E5F727CECF1D115C_6005_DP""","""COC1=C(C=CC(=C1)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""4B708EB6C596447C"""
+"""F81FC01846DD7DEC_19F7500950F6E676_6005_DP""","""COC1=C(C=CC(=C1)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""4B708EB6C596447C"""
+"""9E9210B1CC6D67D8_45CDA85FC3DAD072_6005_DP""","""COC1=C(C=CC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""4B708EB6C596447C"""
+"""7EE9A99766625AC1_76E5C79E44B426DA_6005_DP""","""COC1=C(C=CC(=C1)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""4B708EB6C596447C"""
+"""D59C4E55C337F41F_BD0423EA9CC3D229_6005_DP""","""COC1=C(C=CC(=C1)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""4B708EB6C596447C"""
+"""EF4DA24D545E0860_656B07E6C807C3A1_6005_DP""","""COC1=C(C=CC(=C1)C2=CC=CC(=C2)COCCOC)N""",21,"""4B708EB6C596447C"""
+"""DCAD9260C740CD70_EC068AE7C6BBC8CD_6005_DP""","""COC1=C(C=CC(=C1)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""4B708EB6C596447C"""
+"""E75BF4552108C0E6_F31D9E04F1F12FA8_6005_DP""","""COC1=C(C=CC(=C1)C2=CC=CC(=C2)OC(COC)C)N""",21,"""4B708EB6C596447C"""
+"""FB64262A95D3DBBB_A15C66307A448F84_6005_DP""","""COC1=C(C=CC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""4B708EB6C596447C"""
+"""5D025AF4566D3012_B4A58004E1392EC6_6005_DP""","""COC1=C(C=CC(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""4B708EB6C596447C"""
+"""837A5598EF7F6C75_CD1EEF28160312BB_6005_DP""","""COC1=C(C=CC(=C1)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""4B708EB6C596447C"""
+"""6DFDDBEE5D54C072_D43ACB2A7E6FFD3B_6005_DP""","""COC1=C(C=CC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""4B708EB6C596447C"""
+"""958E92982796CF70_A9CE94C8F9794C52_6005_DP""","""COC1=C(C=CC(=C1)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""4B708EB6C596447C"""
+"""708C1C25580F4ED7_5E13580A681BEF69_6005_DP""","""COC1=C(C=CC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""4B708EB6C596447C"""
+"""C7F0494FDBF30425_6934608E9F71ECDD_6005_DP""","""COC1=C(C=CC(=C1)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""4B708EB6C596447C"""
+"""DA5A77172065FD6B_BBF89E0AB57EC66E_6005_DP""","""COC1=C(C=CC(=C1)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""4B708EB6C596447C"""
+"""B161819FB385D5A6_6B2D50824024F27D_6005_DP""","""COC1=C(C=CC(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""4B708EB6C596447C"""
+"""4FF1B665CACC6388_44B864CD530390B8_6005_DP""","""COC1=C(C=CC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""4B708EB6C596447C"""
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+"""B009F8615E3B1D05_00B646B21D537631_6036_UN""","""C(CCNCC1=CC=NC=C1)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""4CAAAD030930678D"""
+"""52C3E3F00E3844C4_CDD11DFBC21D566E_6036_UN""","""C(CCNCC1=CC=NC=C1)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""4CAAAD030930678D"""
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+"""883FFF912EDD3479_3176006D936D8EEA_6036_UN""","""C(CCNCC1=CC=NC=C1)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""4CAAAD030930678D"""
+"""B90EB42F997DA2AB_A2B41F214995550E_6036_UN""","""C(CCNCC1=CC=NC=C1)N([S](C)(=O)=O)CCN=[N]#N""",21,"""4CAAAD030930678D"""
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+"""15C1A3DB13A7A2DB_D437D154D20C72A8_6036_UN""","""C(CCNCC1=CC=NC=C1)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""4CAAAD030930678D"""
+"""3E83DB73A0353F8F_DDDA653079595F12_6036_UN""","""C(CCNCC1=CC=NC=C1)N([S](=O)(=O)C2CC2)CC#C""",21,"""4CAAAD030930678D"""
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+"""B9515697AC6F8FCF_6A98CB1232951D2F_6036_UN""","""C(CCNCC1=CC=NC=C1)N2CCCC(CC)[S]2(=O)=O""",21,"""4CAAAD030930678D"""
+"""DBDE24F0F2B9B7EC_5BF1BBC8572CAB80_6036_UN""","""C(CCNCC1=CC=NC=C1)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""4CAAAD030930678D"""
+"""ADE4F28EC81B81B9_84EFDC662D2492AE_6036_UN""","""C(CCNCC1=CC=NC=C1)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""4CAAAD030930678D"""
+"""06AF6CCFEA178E85_2FD712FFF9B40F82_6036_UN""","""C(CCNCC1=CC=NC=C1)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""4CAAAD030930678D"""
+"""FACFCF2EF729997F_6FBBA2AFFC8ED63C_6036_UN""","""C(CCNCC1=CC=NC=C1)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""4CAAAD030930678D"""
+"""5C9D17972BADCB97_C7F4387B0793C954_6036_UN""","""C(CCNCC1=CC=NC=C1)N2[S](CCN(C)CC2)(=O)=O""",21,"""4CAAAD030930678D"""
+"""7296DEFCEE1BFE09_4B631EF66F3A22B7_6036_UN""","""C(CCNCC1=CC=NC=C1)N2CC(=O)NCC[S]2(=O)=O""",21,"""4CAAAD030930678D"""
+"""095BEBB09A1EF4DD_1E9803FFC29FE523_6036_UN""","""C(CCNCC1=CC=NC=C1)N2[S](CCCCC2C)(=O)=O""",21,"""4CAAAD030930678D"""
+"""7284F36547AC07A5_643046336C7F0ADD_6036_UN""","""C(CCNCC1=CC=NC=C1)N(CCN)[S](=O)(=O)C2CC2""",21,"""4CAAAD030930678D"""
+"""9A29EE2C537BAA3D_02CA60F2C853982A_6036_UN""","""C(CCNCC1=CC=NC=C1)N(CCN)[S](=O)(=O)C(F)F""",21,"""4CAAAD030930678D"""
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+"""588C3C5E6BFD37A9_CDB80D32BED4C48A_6036_UN""","""NCC(CN(C(C)(C)C)[S](=O)(=O)CBr)CC1CCOCC1""",21,"""4CC3BDCA75F9F569"""
+"""279E84097765C62C_39C5A28571D49423_6036_UN""","""NCC(CN(C(C)(C)C#C)[S](=O)(=O)C)CC1CCOCC1""",21,"""4CC3BDCA75F9F569"""
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+"""E27E5546DAB0D13B_311F10A4EFA41C0E_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=C[NH]C=N1)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""037664C4BC2E69E2_A2DD0FE8355CC7EA_6036_UN""","""NCC(CN([S](C)(=O)=O)CCN=[N]#N)CC1CCOCC1""",21,"""4CC3BDCA75F9F569"""
+"""D2CB52A0864C0A4F_726C384E3321C3CE_6036_UN""","""NCC(CN(CC(C)(C)N)[S](=O)(=O)C)CC1CCOCC1""",21,"""4CC3BDCA75F9F569"""
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+"""29E0701FD58D40C1_D45EC19DAEC5E04C_6036_UN""","""NCC(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)CC3CCOCC3""",21,"""4CC3BDCA75F9F569"""
+"""E45B4D2A459BD090_DDB375F90590CDF6_6036_UN""","""NCC(CN([S](=O)(=O)C1CC1)CC#C)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""B8EA172794C69C39_89B36F72E29E0830_6036_UN""","""NCC(CN1[S](=O)(=O)C2(CCC1)CC2)CC3CCOCC3""",21,"""4CC3BDCA75F9F569"""
+"""FBCDC06CF8CF87F6_A1D8208FC79A44D8_6036_UN""","""NCC(CN1CCCC(C)(C)[S]1(=O)=O)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""493454941E4FC000_6AF1DBDB4E5C8FCB_6036_UN""","""NCC(CN1CCCC(CC)[S]1(=O)=O)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""40383CB59E2BA177_5B98AB012BE53964_6036_UN""","""NCC(CN1C(C(N)CC[S]1(=O)=O)=O)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""A933B311E22AED28_8486CCAF51ED004A_6036_UN""","""NCC(CN([S](C)(=O)=O)[C@@H]1CNCC1)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""BEB5150AFF832F13_2FBE0236857D9D66_6036_UN""","""NCC(CN1CCCC(Cl)(Cl)[S]1(=O)=O)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""9B593A2C6776ED65_6FD2B266804744D8_6036_UN""","""NCC(CN([S](C)(=O)=O)[C@H]1CNCC1)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""FD4CE5C430CDCF2F_C79D28B27B5A5BB0_6036_UN""","""NCC(CN1[S](CCN(C)CC1)(=O)=O)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""ABA6266F97D48018_4B0A0E3F13F3B053_6036_UN""","""NCC(CN1CC(=O)NCC[S]1(=O)=O)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""5FFDC8EB94444343_1EF11336BE5677C7_6036_UN""","""NCC(CN1[S](CCCCC1C)(=O)=O)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""7E6FA77166DD7B67_645956FA10B69839_6036_UN""","""NCC(CN(CCN)[S](=O)(=O)C1CC1)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
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+"""E60BB518E25E5782_A2A6EC5E8A91F42C_6036_UN""","""NCC(CN([S](CC)(=O)=O)C1CNC1)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""6E89E65884DCBA36_903F38621D78A051_6036_DP""","""NCC(CN2CC1(CNC1)C[S]2(=O)=O)CC3CCOCC3""",21,"""4CC3BDCA75F9F569"""
+"""E8FBBD4EFFCEDCF3_2A4A41F0C4BBE43B_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=N[NH]C=N1)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""C1D369DCE8318411_D6A1D9A0CDD9F48B_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=C[NH]N=C1)CC2CCOCC2""",21,"""4CC3BDCA75F9F569"""
+"""ACD9999B0523530D_E8C0BE1700E73C10_6036_UN""","""NCC(CN(C(C)(C)CN)[S](=O)(=O)C)CC1CCOCC1""",21,"""4CC3BDCA75F9F569"""
+"""669520D5A6CB01F5_4CBC55A0D8E99AD1_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=CC=C2)OC3CCCC3)F""",21,"""4D4C04F42972630D"""
+"""32C5FF26CDAC284F_E3CBAD8C23F9362D_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=C(OCC)C=C2)OCC)F""",21,"""4D4C04F42972630D"""
+"""91A35290F33BE405_1FCBDA4BBC12C107_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=CC(=C2)OCCC(C)C)F""",21,"""4D4C04F42972630D"""
+"""578010F125C1278E_43F1221D2F3EF703_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=C(C=C2)C[N]3C=CN=C3)F""",21,"""4D4C04F42972630D"""
+"""F5DE5A9E23D9853C_70D94DDCA85001AB_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=C(C=C2)OC3CCOC3)F""",21,"""4D4C04F42972630D"""
+"""E55C38F9A2633E93_BB38A9A87027F558_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=C(OC)C=C2)CN(C)C)F""",21,"""4D4C04F42972630D"""
+"""09EE945DA62EE85C_63578DA424E3E4D0_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=CC(=C2)COCCOC)F""",21,"""4D4C04F42972630D"""
+"""CE2ED5C1312847FD_EA3A00A52A5FEFBC_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=CC(=C2)CN(C)C3CC3)F""",21,"""4D4C04F42972630D"""
+"""4540AAB22D72FDB2_F52114461D1508D9_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=CC(=C2)OC(COC)C)F""",21,"""4D4C04F42972630D"""
+"""5787040339BBA0F8_A760EC7296A0A8F5_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=C(C(NOC)=O)C=C2)F)F""",21,"""4D4C04F42972630D"""
+"""FE99EFDC97269E5F_B2990A460DDD09B7_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(OC)N=C(C=C2)C(F)(F)F)F""",21,"""4D4C04F42972630D"""
+"""1D69499893041912_CB22656AFAE735CA_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=CC=C2)CN3CCCC3)F""",21,"""4D4C04F42972630D"""
+"""1835A69827DE9B46_D2064168928BDA4A_6005_UN""","""NC1=C(C(=C(C=N1)F)C3=CC=C([N]2C=C(C)C=N2)C=C3)F""",21,"""4D4C04F42972630D"""
+"""E9B982ECAE5E8CB8_AFF21E8A159D6B23_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=CC(=C2)OCCN(C)C)F""",21,"""4D4C04F42972630D"""
+"""0CCBF8DFA4DF4D9A_582FD24884FFC818_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(C=C(C(C)C)C=C2)C(C)C)F""",21,"""4D4C04F42972630D"""
+"""B29E4A6CF89743FA_6F08EACC7395CBAC_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=C(C=C2)C3=CC=CC=C3)F""",21,"""4D4C04F42972630D"""
+"""5F70B694D5A7C791_BDC41448599AE11F_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(C=CC=C2F)OC(F)(F)F)F""",21,"""4D4C04F42972630D"""
+"""1BC2919D95333A3D_6D11DAC0ACC0D50C_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F)F""",21,"""4D4C04F42972630D"""
+"""439B1454027205D3_4284EE8FBFE7B7C9_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(C=C(OC)C=C2)C(F)(F)F)F""",21,"""4D4C04F42972630D"""
+"""2BE171E08796B74A_47BF102A63D765E0_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=CC(=C2F)C(N(C)C)=O)F""",21,"""4D4C04F42972630D"""
+"""39D0EAF2C1F84309_8244B6DD0357F9D4_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=C(OC)C=C2)C(F)(F)F)F""",21,"""4D4C04F42972630D"""
+"""2757935C7AADE378_9268268CDCB94D20_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)F""",21,"""4D4C04F42972630D"""
+"""ABEBE3AA7CBB4864_4F7B7FB5721AB95A_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=CC=C2)C3=CC=CC=C3)F""",21,"""4D4C04F42972630D"""
+"""F5AA7A01FE408431_DF089BCFEBE7338F_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(OC)C=C(C=C2)C(F)(F)F)F""",21,"""4D4C04F42972630D"""
+"""0B8D7A5BB80FA6BB_FA292B7C0BE8FD54_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(C)C=C(C=C2)OC(F)(F)F)F""",21,"""4D4C04F42972630D"""
+"""2A9A18E3AD328E27_9CD49B3D22614C34_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=C(OCCC(C)C)C=C2)F""",21,"""4D4C04F42972630D"""
+"""DCC3EB77DFE434C4_61B9F82BDC2BDC64_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=C(C=C2)OC3CCCC3)F""",21,"""4D4C04F42972630D"""
+"""8D1AD72EB5B8E3A2_E08F21D56BD0B4B0_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(C=C(OC)C=C2)CN(C)C)F""",21,"""4D4C04F42972630D"""
+"""901488AED370926D_95F043E711FC1007_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=C(N=C2)C(F)(F)F)OC)F""",21,"""4D4C04F42972630D"""
+"""7A83773E5E356357_6A17846BC6FDEEEA_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(C)C=C(C=C2)OCC3CC3)F""",21,"""4D4C04F42972630D"""
+"""09A6ECF0E147A391_9D906D9EED84C3F4_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(C=CC(=C2)C3(CC3)C#N)F)F""",21,"""4D4C04F42972630D"""
+"""7919556A88712E18_EB9B438225E8C49F_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(OCC(C)(C)C)N=CC=C2)F""",21,"""4D4C04F42972630D"""
+"""FCFDC422F451A54B_2EABD2B8BC0CADE0_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC=C(C=C2)C[N]3C=NC=N3)F""",21,"""4D4C04F42972630D"""
+"""293A21AB8CCED05F_44CFE79E433AA680_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(OCC)C=CC(=C2)[N](=O)=O)F""",21,"""4D4C04F42972630D"""
+"""3A83C0D3D329EAF7_35F455EB52312873_6005_UN""","""NC1=C(C(=C(C=N1)F)C3=CC2=C(C=C(OC)C=C2)C=C3)F""",21,"""4D4C04F42972630D"""
+"""DA66B1D699B9A463_873FB99E90782131_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=C(C=C2C3CC3)Cl)OC)F""",21,"""4D4C04F42972630D"""
+"""E78C59802C265184_F2F12B16AAD4B103_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=CC=C2)C3=CC=NC=C3)F""",21,"""4D4C04F42972630D"""
+"""5BEC5DDB991D57F2_A10D734F94A61012_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(C=CC=C2)CN3CCCC3)F""",21,"""4D4C04F42972630D"""
+"""7B6DD192D513ED10_39D923CE2814F3A8_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=CC(=N[N]2C3CCCCO3)C)F""",21,"""4D4C04F42972630D"""
+"""0F5006C6416C7447_33DE09CD71691755_6005_UN""","""NC1=C(C(=C(C=N1)F)C2=C(C=C(C=C2)OC(F)(F)F)F)F""",21,"""4D4C04F42972630D"""
+"""53107204ACCFF77B_4C033FDB3F8031C1_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC(=CC=C2)OC3CCCC3""",21,"""4DF36E8FCE1BC81D"""
+"""8B8CC1A5B20571DE_E374C7F7C4909D3D_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC(=C(OCC)C=C2)OCC""",21,"""4DF36E8FCE1BC81D"""
+"""37A7BB3293669D32_1F74B0305B7B6A17_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC=CC(=C2)OCCC(C)C""",21,"""4DF36E8FCE1BC81D"""
+"""831E66BC6F9CE368_434E4866C8575C13_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""4DF36E8FCE1BC81D"""
+"""6A50D9C07626C40F_706627A74F39AABB_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC=C(C=C2)OC3CCOC3""",21,"""4DF36E8FCE1BC81D"""
+"""F862D0639E36065A_BB87C3D3974E5E48_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""4DF36E8FCE1BC81D"""
+"""DE4D78656C765DF3_63E8E7DFC38A4FC0_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC=CC(=C2)COCCOC""",21,"""4DF36E8FCE1BC81D"""
+"""60A35D48EF40236C_EA856ADECD3644AC_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""4DF36E8FCE1BC81D"""
+"""5950EC2DFC7C6145_F59E7E3DFA7CA3C9_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC=CC(=C2)OC(COC)C""",21,"""4DF36E8FCE1BC81D"""
+"""5FDEA454A094D1CA_A7DF860971C903E5_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""4DF36E8FCE1BC81D"""
+"""0561A17BD2F35301_B226603DEAB4A2A7_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""4DF36E8FCE1BC81D"""
+"""FD410330CEA11468_CB9D0F111D8E9EDA_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC(=CC=C2)CN3CCCC3""",21,"""4DF36E8FCE1BC81D"""
+"""83DDF6CE8C2868D8_D2B92B1375E2715A_6004_UN""","""CC(N)C1=C(C=CC=N1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""4DF36E8FCE1BC81D"""
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+"""FA337E94D8CB4A58_6FB780B794FC60BC_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""4DF36E8FCE1BC81D"""
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+"""20C81B68086423AE_6DAEB0BB4BA97E1C_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""4DF36E8FCE1BC81D"""
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+"""5E88A4FC9657D294_954F299CF695BB17_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""4DF36E8FCE1BC81D"""
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+"""DB07658A02002209_EB2429F9C2816F8F_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""4DF36E8FCE1BC81D"""
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+"""F1BA2BCC9E5E42DA_A1B2193473CFBB02_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=C(C=CC=C2)CN3CCCC3""",21,"""4DF36E8FCE1BC81D"""
+"""F02CB7B012569117_396649B5CF7D58B8_6004_UN""","""CC(N)C1=C(C=CC=N1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""4DF36E8FCE1BC81D"""
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+"""765940D8A722778B_2A9D9DC1A2ABB04E_6036_UN""","""NCC(COC1=CC=CC=C1)N(C(C)C)[S](=O)(=O)CCN""",21,"""4F2C33A4D1F3D2F8"""
+"""FE923EC4D26A6D8B_7D1271744CEB9312_6036_UN""","""NCC(COC1=CC=CC=C1)N([S](C)(=O)=O)CCN=C=S""",21,"""4F2C33A4D1F3D2F8"""
+"""73FD91FC7DCCF48D_600470CC0243EADA_6036_UN""","""NCC(COC1=CC=CC=C1)N([S](CC)(=O)=O)CCCN""",21,"""4F2C33A4D1F3D2F8"""
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+"""87F02AEC608AB1DA_AC01DD26C4A25D7A_6036_UN""","""NCC(COC1=CC=CC=C1)N(CCCN)[S](=O)(=O)CCl""",21,"""4F2C33A4D1F3D2F8"""
+"""1B3DE71B53BB1E78_59E051601630C83B_6036_UN""","""NCC(COC1=CC=CC=C1)N(C)[S](=O)(=O)C2CNCC2""",21,"""4F2C33A4D1F3D2F8"""
+"""FE5D9B90E356579A_E7B85A77A9DF6DFF_6036_UN""","""NCC(COC1=CC=CC=C1)N([S](CC)(=O)=O)CCCBr""",21,"""4F2C33A4D1F3D2F8"""
+"""5E8C9119669579DF_5362DB770CD1EE71_6036_UN""","""NCC(COC1=CC=CC=C1)N(CCCNC)[S](=O)(=O)C""",21,"""4F2C33A4D1F3D2F8"""
+"""03908C93C5A02A5E_B60FD3118518F429_6036_UN""","""NCC(COC1=CC=CC=C1)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""4F2C33A4D1F3D2F8"""
+"""E202C1B66F0F8C47_E444B90AD92727E1_6036_UN""","""NCC(COC1=CC=CC=C1)N([S](=O)(=O)CC#N)C2CC2""",21,"""4F2C33A4D1F3D2F8"""
+"""6BC87A3C25168482_6790D27C318165F6_6036_UN""","""NCC(COC1=CC=CC=C1)N([S](C)(=O)=O)C(=O)CCN""",21,"""4F2C33A4D1F3D2F8"""
+"""3463A06FCA9FE9E0_A196858CD5DFD105_6036_UN""","""NCC(COC1=CC=CC=C1)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""4F2C33A4D1F3D2F8"""
+"""A557919E75655D27_0330D815C590C344_6036_UN""","""NCC(COC1=CC=CC=C1)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""4F2C33A4D1F3D2F8"""
+"""1437E4D80FC0F6F9_CE57835C1ADEE31B_6036_UN""","""NCC(COC1=CC=CC=C1)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""4F2C33A4D1F3D2F8"""
+"""4ADCECD19DBF258B_3A2A2CEBD5DEB3B2_6036_UN""","""NCC(COC1=CC=CC=C1)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""4F2C33A4D1F3D2F8"""
+"""68FBF3A0A87B1995_30DECBEB49A58BB4_6036_UN""","""NCC(COC1=CC=CC=C1)N(CC(CC)N)[S](=O)(=O)C""",21,"""4F2C33A4D1F3D2F8"""
+"""83C3C65AAE864F50_32F09ECA4BAE3B9F_6036_UN""","""NCC(COC1=CC=CC=C1)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""4F2C33A4D1F3D2F8"""
+"""3D9F91FCEC3E8B7C_A13281869156E07B_6036_UN""","""NCC(COC1=CC=CC=C1)N([S](C)(=O)=O)CCN=[N]#N""",21,"""4F2C33A4D1F3D2F8"""
+"""AB5028748A6F1C47_7183B620972BE45F_6036_UN""","""NCC(COC1=CC=CC=C1)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""4F2C33A4D1F3D2F8"""
+"""91FDFDD2D8A41646_3B8CD19100E563D2_6036_UN""","""NCC(COC1=CC=CC=C1)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""4F2C33A4D1F3D2F8"""
+"""6C5E45EE296870AF_D7B14FF30ACFC7DD_6036_UN""","""NCC(COC1=CC=CC=C1)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""4F2C33A4D1F3D2F8"""
+"""0CCFD4AD447A4B73_DE5CFB97A19AEA67_6036_UN""","""NCC(COC1=CC=CC=C1)N([S](=O)(=O)C2CC2)CC#C""",21,"""4F2C33A4D1F3D2F8"""
+"""D7E74D75F90DA3C1_8A5CE11C46942FA1_6036_UN""","""NCC(COC1=CC=CC=C1)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""4F2C33A4D1F3D2F8"""
+"""6163DACB75F3B3A8_A237AEE163906349_6036_UN""","""NCC(COC1=CC=CC=C1)N2CCCC(C)(C)[S]2(=O)=O""",21,"""4F2C33A4D1F3D2F8"""
+"""CF5D35814963A307_691E55B5EA56A85A_6036_UN""","""NCC(COC1=CC=CC=C1)N2CCCC(CC)[S]2(=O)=O""",21,"""4F2C33A4D1F3D2F8"""
+"""AD3BCFD4143B3681_5877256F8FEF1EF5_6036_UN""","""NCC(COC1=CC=CC=C1)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""4F2C33A4D1F3D2F8"""
+"""149028928550A2C6_876942C1F5E727DB_6036_UN""","""NCC(COC1=CC=CC=C1)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""4F2C33A4D1F3D2F8"""
+"""A74CE684EABF5E0E_2C518C582177BAF7_6036_UN""","""NCC(COC1=CC=CC=C1)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""4F2C33A4D1F3D2F8"""
+"""A2F1E4D953A74AC6_6C3D3C08244D6349_6036_UN""","""NCC(COC1=CC=CC=C1)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""4F2C33A4D1F3D2F8"""
+"""A966DE5DBBF006FC_C472A6DCDF507C21_6036_UN""","""NCC(COC1=CC=CC=C1)N2[S](CCN(C)CC2)(=O)=O""",21,"""4F2C33A4D1F3D2F8"""
+"""0611CFA3D05E4E94_48E58051B7F997C2_6036_UN""","""NCC(COC1=CC=CC=C1)N2CC(=O)NCC[S]2(=O)=O""",21,"""4F2C33A4D1F3D2F8"""
+"""D8551322A27F14D7_1D1E9D581A5C5056_6036_UN""","""NCC(COC1=CC=CC=C1)N2[S](CCCCC2C)(=O)=O""",21,"""4F2C33A4D1F3D2F8"""
+"""FE41D7696AD81B11_67B6D894B4BCBFA8_6036_UN""","""NCC(COC1=CC=CC=C1)N(CCN)[S](=O)(=O)C2CC2""",21,"""4F2C33A4D1F3D2F8"""
+"""C9AE2E4CC571420B_014CFE5510902D5F_6036_UN""","""NCC(COC1=CC=CC=C1)N(CCN)[S](=O)(=O)C(F)F""",21,"""4F2C33A4D1F3D2F8"""
+"""3F668669367E1381_A14962302E9BD3BD_6036_UN""","""NCC(COC1=CC=CC=C1)N([S](CC)(=O)=O)C2CNC2""",21,"""4F2C33A4D1F3D2F8"""
+"""C4089C9A15993AFB_93D0B60CB97287C0_6036_DP""","""NCC(COC1=CC=CC=C1)N3CC2(CNC2)C[S]3(=O)=O""",21,"""4F2C33A4D1F3D2F8"""
+"""7F93CCBF8DDDF9F9_29A5CF9E60B1C3AA_6036_UN""","""NCC(COC1=CC=CC=C1)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""4F2C33A4D1F3D2F8"""
+"""B18D83E767504B1D_D54E57CE69D3D31A_6036_UN""","""NCC(COC1=CC=CC=C1)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""4F2C33A4D1F3D2F8"""
+"""F9452E760114F115_EB2F3079A4ED1B81_6036_UN""","""NCC(COC1=CC=CC=C1)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""4F2C33A4D1F3D2F8"""
+"""ADED5D66530D3161_4EC72A0E4F8BA304_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=CC=C2)OC3CCCC3""",21,"""4F377B5ABE105AD8"""
+"""68764E052817E295_E1B0D222B49B0FF8_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=C(OCC)C=C2)OCC""",21,"""4F377B5ABE105AD8"""
+"""0A0CF2A17A343A1B_1DB0A5E52B70F8D2_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=CC(=C2)OCCC(C)C""",21,"""4F377B5ABE105AD8"""
+"""2813D0887B97CFA6_418A5DB3B85CCED6_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""4F377B5ABE105AD8"""
+"""D0FEB3216E71A2D7_72A232723F32387E_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=C(C=C2)OC3CCOC3""",21,"""4F377B5ABE105AD8"""
+"""4AFC4B09D5D3E7A5_B943D606E745CC8D_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""4F377B5ABE105AD8"""
+"""557E8EC8FB4F9307_612CF20AB381DD05_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=CC(=C2)COCCOC""",21,"""4F377B5ABE105AD8"""
+"""BE7CC9EC8EC03804_E8417F0BBD3DD669_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""4F377B5ABE105AD8"""
+"""3902508E5101F108_F75A6BE88A77310C_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=CC(=C2)OC(COC)C""",21,"""4F377B5ABE105AD8"""
+"""8EF76699B2603523_A51B93DC01C29120_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""4F377B5ABE105AD8"""
+"""F2C8A9039B521686_B0E275E89ABF3062_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""4F377B5ABE105AD8"""
+"""9F8BCE4ECBBC94BF_C9591AC46D850C1F_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=CC=C2)CN3CCCC3""",21,"""4F377B5ABE105AD8"""
+"""8777D92C66BF1CD0_D07D3EC605E9E39F_6004_UN""","""COC1=C(N=CC(=C1)N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""4F377B5ABE105AD8"""
+"""D0DF5656A50529A6_AD89612482FF52F6_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=CC(=C2)OCCN(C)C""",21,"""4F377B5ABE105AD8"""
+"""C12FEEB46E19473F_5A54ADE6139DF1CD_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""4F377B5ABE105AD8"""
+"""F9C2DB10BE9B8075_6D739562E4F7F279_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""4F377B5ABE105AD8"""
+"""8976645816AB7AB7_BFBF6BE6CEF8D8CA_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""4F377B5ABE105AD8"""
+"""1FD6795FEACC4727_6F6AA56E3BA2ECD9_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""4F377B5ABE105AD8"""
+"""B51D768CC71630DB_40FF912128858E1C_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""4F377B5ABE105AD8"""
+"""B8F84192AEDBF88D_45C46F84F4B55C35_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""4F377B5ABE105AD8"""
+"""8959F2B57191C0E9_803FC9739435C001_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""4F377B5ABE105AD8"""
+"""70CDFC6C79FCA87E_901359224BDB74F5_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""4F377B5ABE105AD8"""
+"""EBA5265F8E2D8C10_4D00001BE578808F_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""4F377B5ABE105AD8"""
+"""5BBC49505668880E_DD73E4617C850A5A_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""4F377B5ABE105AD8"""
+"""A3778056C6FA1591_F85254D29C8AC481_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""4F377B5ABE105AD8"""
+"""AABDE50B6ED2D8BC_9EAFE493B50375E1_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=C(OCCC(C)C)C=C2""",21,"""4F377B5ABE105AD8"""
+"""BD9208257DD5E192_63C287854B49E5B1_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=C(C=C2)OC3CCCC3""",21,"""4F377B5ABE105AD8"""
+"""69875484FA37CD5F_E2F45E7BFCB28D65_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""4F377B5ABE105AD8"""
+"""7D3578C0C7D2437E_978B3C49869E29D2_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""4F377B5ABE105AD8"""
+"""CE51C2B689D41FB8_686CFBC5519FD73F_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""4F377B5ABE105AD8"""
+"""54FC316A62DBDEC2_9FEB12307AE6FA21_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""4F377B5ABE105AD8"""
+"""E19D6BE4D6C2206E_E9E03C2CB28AFD4A_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""4F377B5ABE105AD8"""
+"""B7211008B93169B7_2CD0AD162B6E9435_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""4F377B5ABE105AD8"""
+"""F5A480167466D33B_46B49830D4589F55_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""4F377B5ABE105AD8"""
+"""F57763A1C1A8CE4B_378F2A45C55311A6_6004_UN""","""COC1=C(N=CC(=C1)N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""4F377B5ABE105AD8"""
+"""BDC395B4DEB9593E_8544C630071A18E4_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""4F377B5ABE105AD8"""
+"""969EA31FA31773CD_F08A54B83DB688D6_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""4F377B5ABE105AD8"""
+"""67574027399C2AF9_A3760CE103C429C7_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(C=CC=C2)CN3CCCC3""",21,"""4F377B5ABE105AD8"""
+"""68B1EAC0B387D95B_3BA25C60BF76CA7D_6004_UN""","""COC1=C(N=CC(=C1)N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""4F377B5ABE105AD8"""
+"""C17E0A60E099AA01_31A57663E60B2E80_6004_UN""","""COC1=C(N=CC(=C1)N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""4F377B5ABE105AD8"""
+"""6D4AFB81622A29A9_5075D5695FF439C9_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=CC=C2)OC3CCCC3)Cl""",21,"""5185843DAE6FC015"""
+"""CDF4167E8B9A5256_FF022D45A4E49535_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(OCC)C=C2)OCC)Cl""",21,"""5185843DAE6FC015"""
+"""75E1EA30B2FC074F_03025A823B0F621F_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2)OCCC(C)C)Cl""",21,"""5185843DAE6FC015"""
+"""C2D0D41263C0B55D_5F38A2D4A823541B_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(C=C2)C[N]3C=CN=C3)Cl""",21,"""5185843DAE6FC015"""
+"""9F830C0A9B1A768A_6C10CD152F4DA2B3_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(C=C2)OC3CCOC3)Cl""",21,"""5185843DAE6FC015"""
+"""6BE023DA6EEF79E2_A7F12961F73A5640_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(OC)C=C2)CN(C)C)Cl""",21,"""5185843DAE6FC015"""
+"""927C7DC1FEDDB1B7_7F9E0D6DA3FE47C8_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2)COCCOC)Cl""",21,"""5185843DAE6FC015"""
+"""2F3EF4AD893F38BF_F6F3806CAD424CA4_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2)CN(C)C3CC3)Cl""",21,"""5185843DAE6FC015"""
+"""CB3107B22473F517_E9E8948F9A08ABC1_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2)OC(COC)C)Cl""",21,"""5185843DAE6FC015"""
+"""8C183DD2D783A20D_BBA96CBB11BD0BED_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(C(NOC)=O)C=C2)F)Cl""",21,"""5185843DAE6FC015"""
+"""BEA40C1276B41F2E_AE508A8F8AC0AAAF_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(OC)N=C(C=C2)C(F)(F)F)Cl""",21,"""5185843DAE6FC015"""
+"""EEEF7B6D57D14056_D7EBE5A37DFA96D2_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=CC=C2)CN3CCCC3)Cl""",21,"""5185843DAE6FC015"""
+"""D45472C9A8F10E05_CECFC1A115967952_6005_UN""","""NC1=C(C(=C(C=C1)F)C3=CC=C([N]2C=C(C)C=N2)C=C3)Cl""",21,"""5185843DAE6FC015"""
+"""992B97525F1EFED2_B33B9E439280C83B_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2)OCCN(C)C)Cl""",21,"""5185843DAE6FC015"""
+"""24A9C77769097006_44E6528103E26B00_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=C(C(C)C)C=C2)C(C)C)Cl""",21,"""5185843DAE6FC015"""
+"""F8E25431972BB10E_73C16A05F48868B4_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(C=C2)C3=CC=CC=C3)Cl""",21,"""5185843DAE6FC015"""
+"""A3632A4E41D7030F_A10D9481DE874207_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=CC=C2F)OC(F)(F)F)Cl""",21,"""5185843DAE6FC015"""
+"""A7FD255415AD0E95_71D85A092BDD7614_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Cl""",21,"""5185843DAE6FC015"""
+"""BBDEC44CEA8E3A9D_5E4D6E4638FA14D1_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=C(OC)C=C2)C(F)(F)F)Cl""",21,"""5185843DAE6FC015"""
+"""F63B01E9258C8B0E_5B7690E3E4CAC6F8_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2F)C(N(C)C)=O)Cl""",21,"""5185843DAE6FC015"""
+"""5ABE20EBA8146204_9E8D3614844A5ACC_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(OC)C=C2)C(F)(F)F)Cl""",21,"""5185843DAE6FC015"""
+"""6CC6D276681F9FEA_8EA1A6455BA4EE38_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Cl""",21,"""5185843DAE6FC015"""
+"""F387C6243600FC46_53B2FF7CF5071A42_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=CC=C2)C3=CC=CC=C3)Cl""",21,"""5185843DAE6FC015"""
+"""8550FDE0E74196EA_C3C11B066CFA9097_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(OC)C=C(C=C2)C(F)(F)F)Cl""",21,"""5185843DAE6FC015"""
+"""8185209E857DAF1F_E6E0ABB58CF55E4C_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C)C=C(C=C2)OC(F)(F)F)Cl""",21,"""5185843DAE6FC015"""
+"""A645B063988494DA_801D1BF4A57CEF2C_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(OCCC(C)C)C=C2)Cl""",21,"""5185843DAE6FC015"""
+"""BE3FDE8C1214E4D3_7D7078E25B367F7C_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(C=C2)OC3CCCC3)Cl""",21,"""5185843DAE6FC015"""
+"""6CB95E54095B6015_FC46A11CECCD17A8_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=C(OC)C=C2)CN(C)C)Cl""",21,"""5185843DAE6FC015"""
+"""247574EABC9594F8_8939C32E96E1B31F_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(N=C2)C(F)(F)F)OC)Cl""",21,"""5185843DAE6FC015"""
+"""6A9BF90CC762C75A_76DE04A241E04DF2_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C)C=C(C=C2)OCC3CC3)Cl""",21,"""5185843DAE6FC015"""
+"""1DA0568EA6268266_8159ED576A9960EC_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=CC(=C2)C3(CC3)C#N)F)Cl""",21,"""5185843DAE6FC015"""
+"""A2134255AEA95641_F752C34BA2F56787_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(OCC(C)(C)C)N=CC=C2)Cl""",21,"""5185843DAE6FC015"""
+"""FDB72C58024F92FE_326252713B110EF8_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(C=C2)C[N]3C=NC=N3)Cl""",21,"""5185843DAE6FC015"""
+"""B17CEFE74EE32557_58066757C4270598_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(OCC)C=CC(=C2)[N](=O)=O)Cl""",21,"""5185843DAE6FC015"""
+"""B2FCFBEE687E5951_293DD522D52C8B6B_6005_UN""","""NC1=C(C(=C(C=C1)F)C3=CC2=C(C=C(OC)C=C2)C=C3)Cl""",21,"""5185843DAE6FC015"""
+"""CCE2548769CF3D6A_9BF6395717658229_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(C=C2C3CC3)Cl)OC)Cl""",21,"""5185843DAE6FC015"""
+"""D2E8563BA21E5905_EE38ABDF2DC9121B_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=CC=C2)C3=CC=NC=C3)Cl""",21,"""5185843DAE6FC015"""
+"""D6634C7057C49ACF_BDC4F38613BBB30A_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=CC=C2)CN3CCCC3)Cl""",21,"""5185843DAE6FC015"""
+"""BA6D15A73E21CD3B_2510A307AF0950B0_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=N[N]2C3CCCCO3)C)Cl""",21,"""5185843DAE6FC015"""
+"""502BDE6AF7755387_2F178904F674B44D_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=C(C=C2)OC(F)(F)F)F)Cl""",21,"""5185843DAE6FC015"""
+"""430CE7611D14C9AE_AF121EEA572B6629_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](CCN)(=O)=O)C2CC2""",21,"""51DA600589D00B31"""
+"""0486D5053E2E5871_346BCE60FA886987_6036_UN""","""CC(C1CCN(CC1)CCN)N(C(C)C)[S](=O)(=O)CCN""",21,"""51DA600589D00B31"""
+"""227CAE9CDD2EA56E_63E422D514C84ADB_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](C)(=O)=O)CCN=C=S""",21,"""51DA600589D00B31"""
+"""357A54C8F9B0537A_7EF2236D5A603313_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](CC)(=O)=O)CCCN""",21,"""51DA600589D00B31"""
+"""7005AEBEC0FC832B_F42D8680ACB40632_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](C)(=O)=O)C2CC(C2)N""",21,"""51DA600589D00B31"""
+"""B7A2666603E28A4C_B2F78E879C8184B3_6036_UN""","""CC(C1CCN(CC1)CCN)N(CCCN)[S](=O)(=O)CCl""",21,"""51DA600589D00B31"""
+"""170893323B11485E_471602C14E1311F2_6036_UN""","""CC(C1CCN(CC1)CCN)N(C)[S](=O)(=O)C2CNCC2""",21,"""51DA600589D00B31"""
+"""3D03C23EFE626359_F94E09D6F1FCB436_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](CC)(=O)=O)CCCBr""",21,"""51DA600589D00B31"""
+"""8DA7275247C3D635_4D9488D654F237B8_6036_UN""","""CC(C1CCN(CC1)CCN)N(CCCNC)[S](=O)(=O)C""",21,"""51DA600589D00B31"""
+"""1D69248FCAA2B8B2_A8F980B0DD3B2DE0_6036_UN""","""CC(C1CCN(CC1)CCN)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""51DA600589D00B31"""
+"""85020911FC172BB7_FAB2EAAB8104FE28_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](=O)(=O)CC#N)C2CC2""",21,"""51DA600589D00B31"""
+"""89896946816BD7F1_796681DD69A2BC3F_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](C)(=O)=O)C(=O)CCN""",21,"""51DA600589D00B31"""
+"""4514B234F7B69255_BF60D62D8DFC08CC_6036_UN""","""CC(C1CCN(CC1)CCN)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""51DA600589D00B31"""
+"""F38911839A7EE683_1DC68BB49DB31A8D_6036_UN""","""CC(C1CCN(CC1)CCN)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""51DA600589D00B31"""
+"""C0E60F743D90C36D_D0A1D0FD42FD3AD2_6036_UN""","""CC(C1CCN(CC1)CCN)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""51DA600589D00B31"""
+"""114DB1901C33D0D3_24DC7F4A8DFD6A7B_6036_UN""","""CC(C1CCN(CC1)CCN)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""51DA600589D00B31"""
+"""5D0D6E990CD330DD_2E28984A1186527D_6036_UN""","""CC(C1CCN(CC1)CCN)N(CC(CC)N)[S](=O)(=O)C""",21,"""51DA600589D00B31"""
+"""F95E7CB9DD2099E4_2C06CD6B138DE256_6036_UN""","""CC(C1CCN(CC1)CCN)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""51DA600589D00B31"""
+"""DA837BEEEB41CC20_BFC4D227C97539B2_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](C)(=O)=O)CCN=[N]#N""",21,"""51DA600589D00B31"""
+"""BFE7A98B9AF3F70E_6F75E581CF083D96_6036_UN""","""CC(C1CCN(CC1)CCN)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""51DA600589D00B31"""
+"""0D42FA28B2EEF81A_257A823058C6BA1B_6036_UN""","""CC(C1CCN(CC1)CCN)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""51DA600589D00B31"""
+"""8B88A229B7F7DF08_C9471C5252EC1E14_6036_UN""","""CC(C1CCN(CC1)CCN)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""51DA600589D00B31"""
+"""BBE31C0304C5EB7D_C0AAA836F9B933AE_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](=O)(=O)C2CC2)CC#C""",21,"""51DA600589D00B31"""
+"""752F3BEA3FD6FF84_94AAB2BD1EB7F668_6036_UN""","""CC(C1CCN(CC1)CCN)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""51DA600589D00B31"""
+"""F401F6AE6A7A063D_BCC1FD403BB3BA80_6036_UN""","""CC(C1CCN(CC1)CCN)N2CCCC(C)(C)[S]2(=O)=O""",21,"""51DA600589D00B31"""
+"""8A5AED05BBBD64AA_77E80614B2757193_6036_UN""","""CC(C1CCN(CC1)CCN)N2CCCC(CC)[S]2(=O)=O""",21,"""51DA600589D00B31"""
+"""CB866F9FB7134915_468176CED7CCC73C_6036_UN""","""CC(C1CCN(CC1)CCN)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""51DA600589D00B31"""
+"""3ECE4F96010F580F_999F1160ADC4FE12_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""51DA600589D00B31"""
+"""671AC07349A87A92_32A7DFF97954633E_6036_UN""","""CC(C1CCN(CC1)CCN)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""51DA600589D00B31"""
+"""81AE98570DDC2110_72CB6FA97C6EBA80_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""51DA600589D00B31"""
+"""56DA9E680BF368AA_DA84F57D8773A5E8_6036_UN""","""CC(C1CCN(CC1)CCN)N2[S](CCN(C)CC2)(=O)=O""",21,"""51DA600589D00B31"""
+"""6790162CAF667785_5613D3F0EFDA4E0B_6036_UN""","""CC(C1CCN(CC1)CCN)N2CC(=O)NCC[S]2(=O)=O""",21,"""51DA600589D00B31"""
+"""DE962E46D2333D23_03E8CEF9427F899F_6036_UN""","""CC(C1CCN(CC1)CCN)N2[S](CCCCC2C)(=O)=O""",21,"""51DA600589D00B31"""
+"""EC24D88C001D5ECA_79408B35EC9F6661_6036_UN""","""CC(C1CCN(CC1)CCN)N(CCN)[S](=O)(=O)C2CC2""",21,"""51DA600589D00B31"""
+"""B9064E9BD5D4CA3B_1FBAADF448B3F496_6036_UN""","""CC(C1CCN(CC1)CCN)N(CCN)[S](=O)(=O)C(F)F""",21,"""51DA600589D00B31"""
+"""7D0E080A2919DF21_BFBF319176B80A74_6036_UN""","""CC(C1CCN(CC1)CCN)N([S](CC)(=O)=O)C2CNC2""",21,"""51DA600589D00B31"""
+"""9054130512E9531A_8D26E5ADE1515E09_6036_DP""","""CC(C1CCN(CC1)CCN)N3CC2(CNC2)C[S]3(=O)=O""",21,"""51DA600589D00B31"""
+"""6A1F96DCEA6DFE20_37539C3F38921A63_6036_UN""","""CC(C1CCN(CC1)CCN)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""51DA600589D00B31"""
+"""CAC666F26A9A9FD5_CBB8046F31F00AD3_6036_UN""","""CC(C1CCN(CC1)CCN)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""51DA600589D00B31"""
+"""7D9BE99E855936A5_F5D963D8FCCEC248_6036_UN""","""CC(C1CCN(CC1)CCN)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""51DA600589D00B31"""
+"""01F50B51BB4B4B6B_53EDC4C26B1AD037_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=CC=C3)OC4CCCC4""",21,"""521D95969A8129EB"""
+"""3361862CCE61EEE0_FC9A3CEE900A7CCB_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=C(OCC)C=C3)OCC""",21,"""521D95969A8129EB"""
+"""FA03A4B39414D030_009A4B290FE18BE1_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=CC(=C3)OCCC(C)C""",21,"""521D95969A8129EB"""
+"""3D42EB14BED20AB2_5CA0B37F9CCDBDE5_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""521D95969A8129EB"""
+"""A5F6F78717F4C7C9_6F88DCBE1BA34B4D_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=C(C=C3)OC4CCOC4""",21,"""521D95969A8129EB"""
+"""CD5691648A2CBC1D_A46938CAC3D4BFBE_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""521D95969A8129EB"""
+"""798E3BA5CE239CBE_7C061CC69710AE36_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=CC(=C3)COCCOC""",21,"""521D95969A8129EB"""
+"""8670FAE5D820AEA8_F56B91C799ACA55A_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""521D95969A8129EB"""
+"""25D7D20794A6BC4B_EA708524AEE6423F_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=CC(=C3)OC(COC)C""",21,"""521D95969A8129EB"""
+"""5C34FC5D73024820_B8317D102553E213_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""521D95969A8129EB"""
+"""C0E1E169E42FCCA5_ADC89B24BE2E4351_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""521D95969A8129EB"""
+"""3166240B56C18991_D473F40849147F2C_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=CC=C3)CN4CCCC4""",21,"""521D95969A8129EB"""
+"""C290D7C18AE7D2AA_CD57D00A217890AC_6004_DP""","""NC1=CC(=C(S1)C2CC2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""521D95969A8129EB"""
+"""BD3D1EFA09627D3D_B0A38FE8A66E21C5_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=CC(=C3)OCCN(C)C""",21,"""521D95969A8129EB"""
+"""BF4674277A504D40_477E432A370C82FE_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""521D95969A8129EB"""
+"""C84BDD3C152CCD68_70597BAEC066814A_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""521D95969A8129EB"""
+"""D0BDD51D3F978A97_A295852AEA69ABF9_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""521D95969A8129EB"""
+"""F9C2419D8D185CDA_72404BA21F339FEA_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""521D95969A8129EB"""
+"""76C922CFA0733950_5DD57FED0C14FD2F_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""521D95969A8129EB"""
+"""825151F52306BA07_58EE8148D0242F06_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""521D95969A8129EB"""
+"""EDC24838873EDEAF_9D1527BFB0A4B332_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""521D95969A8129EB"""
+"""7380ACB064EF26C2_8D39B7EE6F4A07C6_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""521D95969A8129EB"""
+"""0C1ACEAEBB8BC283_502AEED7C1E9F3BC_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""521D95969A8129EB"""
+"""53D4DC45DC04AEFA_C0590AAD58147969_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""521D95969A8129EB"""
+"""CDC34BA2456DEE77_E578BA1EB81BB7B2_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""521D95969A8129EB"""
+"""5F8C2B72708F76A0_83850A5F919206D2_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=C(OCCC(C)C)C=C3""",21,"""521D95969A8129EB"""
+"""3EDE47C5126808E4_7EE869496FD89682_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=C(C=C3)OC4CCCC4""",21,"""521D95969A8129EB"""
+"""8BA20078E1F26EDC_FFDEB0B7D823FE56_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""521D95969A8129EB"""
+"""B22A18282273FB46_8AA1D285A20F5AE1_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""521D95969A8129EB"""
+"""E0F24C33291BD519_75461509750EA40C_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""521D95969A8129EB"""
+"""D3883A1DA797ADFD_82C1FCFC5E778912_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""521D95969A8129EB"""
+"""CC102E349BF76CE1_F4CAD2E0961B8E79_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""521D95969A8129EB"""
+"""1299CE2DC8825CB5_31FA43DA0FFFE706_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""521D95969A8129EB"""
+"""9173DD037656C17F_5B9E76FCF0C9EC66_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""521D95969A8129EB"""
+"""505ADBD6FFBB83F6_2AA5C489E1C26295_6004_DP""","""NC1=CC(=C(S1)C2CC2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""521D95969A8129EB"""
+"""7CCAAFBFE788EE54_986E28FC238B6BD7_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""521D95969A8129EB"""
+"""6C3E6B7F9272CFB3_EDA0BA741927FBE5_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""521D95969A8129EB"""
+"""8AD6A87685C8C3AB_BE5CE22D27555AF4_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(C=CC=C3)CN4CCCC4""",21,"""521D95969A8129EB"""
+"""E5916928971A2813_2688B2AC9BE7B94E_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""521D95969A8129EB"""
+"""7C3CBC3F92EC644C_2C8F98AFC29A5DB3_6004_DP""","""NC1=CC(=C(S1)C2CC2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""521D95969A8129EB"""
+"""63AC1357D5448A90_AC4A147CDCF09544_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](CCN)(=O)=O)C2CC2""",21,"""52826A93020BF85C"""
+"""BED9FD40C25CEF6B_3733C4F671539AEA_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C(C)C)[S](=O)(=O)CCN""",21,"""52826A93020BF85C"""
+"""AA2494A3607D64E0_60BC28439F13B9B6_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](C)(=O)=O)CCN=C=S""",21,"""52826A93020BF85C"""
+"""599AEDCDD09081D4_7DAA29FBD1BBC07E_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](CC)(=O)=O)CCCN""",21,"""52826A93020BF85C"""
+"""58F160A42B82E541_F7758C16276FF55F_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](C)(=O)=O)C2CC(C2)N""",21,"""52826A93020BF85C"""
+"""3A47FFDFE5052C00_B1AF8411175A77DE_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(CCCN)[S](=O)(=O)CCl""",21,"""52826A93020BF85C"""
+"""FB0076B5D9BEFBB6_444E0857C5C8E29F_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C)[S](=O)(=O)C2CNCC2""",21,"""52826A93020BF85C"""
+"""065B696F92F4D03D_FA1603407A27475B_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](CC)(=O)=O)CCCBr""",21,"""52826A93020BF85C"""
+"""10609A9B1E53B3F2_4ECC8240DF29C4D5_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(CCCNC)[S](=O)(=O)C""",21,"""52826A93020BF85C"""
+"""3318892424DD1F17_ABA18A2656E0DE8D_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""52826A93020BF85C"""
+"""852AF1511CBDD8DF_F9EAE03D0ADF0D45_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](=O)(=O)CC#N)C2CC2""",21,"""52826A93020BF85C"""
+"""FAFE453E8C20D2A5_7A3E8B4BE2794F52_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](C)(=O)=O)C(=O)CCN""",21,"""52826A93020BF85C"""
+"""CE306A0A5E4217EA_BC38DCBB0627FBA1_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""52826A93020BF85C"""
+"""88645F7FDAA651A5_1E9E81221668E9E0_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""52826A93020BF85C"""
+"""F0BD9007DDCA7FB1_D3F9DA6BC926C9BF_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""52826A93020BF85C"""
+"""0E58A0C36BA69950_278475DC06269916_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""52826A93020BF85C"""
+"""58AC280E8562E6EF_2D7092DC9A5DA110_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(CC(CC)N)[S](=O)(=O)C""",21,"""52826A93020BF85C"""
+"""5CC4769187834909_2F5EC7FD9856113B_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""52826A93020BF85C"""
+"""926FAED3EB7F0820_BC9CD8B142AECADF_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](C)(=O)=O)CCN=[N]#N""",21,"""52826A93020BF85C"""
+"""9C637ABDA0939E44_6C2DEF1744D3CEFB_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""52826A93020BF85C"""
+"""A5AA273AB5D3C46B_262288A6D31D4976_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""52826A93020BF85C"""
+"""9B495F0BACCA0F0E_CA1F16C4D937ED79_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""52826A93020BF85C"""
+"""16E89BBD7E6B25E2_C3F2A2A07262C0C3_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](=O)(=O)C2CC2)CC#C""",21,"""52826A93020BF85C"""
+"""49B7946877D41F0B_97F2B82B956C0505_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""52826A93020BF85C"""
+"""E3896438B4944B1B_BF99F7D6B06849ED_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N2CCCC(C)(C)[S]2(=O)=O""",21,"""52826A93020BF85C"""
+"""2C188051B0DBA352_74B00C8239AE82FE_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N2CCCC(CC)[S]2(=O)=O""",21,"""52826A93020BF85C"""
+"""DAAD4523AF35B892_45D97C585C173451_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""52826A93020BF85C"""
+"""6540D865A740376A_9AC71BF6261F0D7F_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""52826A93020BF85C"""
+"""A2795EEBA6B3AE09_31FFD56FF28F9053_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""52826A93020BF85C"""
+"""657A1DA552619C71_7193653FF7B549ED_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""52826A93020BF85C"""
+"""C45408A6EFA1D813_D9DCFFEB0CA85685_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N2[S](CCN(C)CC2)(=O)=O""",21,"""52826A93020BF85C"""
+"""2439C29B8719F269_554BD9666401BD66_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N2CC(=O)NCC[S]2(=O)=O""",21,"""52826A93020BF85C"""
+"""ADDFA3BDBEFD0752_00B0C46FC9A47AF2_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N2[S](CCCCC2C)(=O)=O""",21,"""52826A93020BF85C"""
+"""FD6BAD7F2EF84F11_7A1881A36744950C_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(CCN)[S](=O)(=O)C2CC2""",21,"""52826A93020BF85C"""
+"""08A117733A9C79A3_1CE2A762C36807FB_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(CCN)[S](=O)(=O)C(F)F""",21,"""52826A93020BF85C"""
+"""D2C110DB78BC2D0D_BCE73B07FD63F919_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N([S](CC)(=O)=O)C2CNC2""",21,"""52826A93020BF85C"""
+"""571B2B057EB7AC60_8E7EEF3B6A8AAD64_6036_DP""","""NCC(C1=CC(=CC(=C1)F)Cl)N3CC2(CNC2)C[S]3(=O)=O""",21,"""52826A93020BF85C"""
+"""9614735BB0CC7D11_340B96A9B349E90E_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""52826A93020BF85C"""
+"""DE9E95264214022A_C8E00EF9BA2BF9BE_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""52826A93020BF85C"""
+"""0BF9012B4DCA1224_F681694E77153125_6036_UN""","""NCC(C1=CC(=CC(=C1)F)Cl)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""52826A93020BF85C"""
+"""F0F546588B6BC74B_537CF398E08984E8_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=CC=C2)OC3CCCC3""",21,"""528CA2CC11127D34"""
+"""43CFFAEC6EA55F4C_FC0B0BB41B992814_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=C(OCC)C=C2)OCC""",21,"""528CA2CC11127D34"""
+"""474B803A675FCEE2_000B7C738472DF3E_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=CC(=C2)OCCC(C)C""",21,"""528CA2CC11127D34"""
+"""947B75892EEB295A_5C318425175EE93A_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""528CA2CC11127D34"""
+"""28D1A22AEA4EA3E9_6F19EBE490301F92_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=C(C=C2)OC3CCOC3""",21,"""528CA2CC11127D34"""
+"""86BEE70EB0286883_A4F80F904847EB61_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""528CA2CC11127D34"""
+"""5FCF8C805903B26B_7C972B9C1C83FAE9_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=CC(=C2)COCCOC""",21,"""528CA2CC11127D34"""
+"""80FB5AEE0D3A7487_F5FAA69D123FF185_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""528CA2CC11127D34"""
+"""53CB7A35B57919FD_EAE1B27E257516E0_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=CC(=C2)OC(COC)C""",21,"""528CA2CC11127D34"""
+"""C24695E03FADC5EE_B8A04A4AAEC0B6CC_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""528CA2CC11127D34"""
+"""45776419D0C4EA4B_AD59AC7E35BD178E_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""528CA2CC11127D34"""
+"""7F0F2996215BCEA2_D4E2C352C2872BF3_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=CC=C2)CN3CCCC3""",21,"""528CA2CC11127D34"""
+"""4F9D2F89A898409E_CDC6E750AAEBC473_6005_UN""","""NC1=C(C=C(C=C1F)F)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""528CA2CC11127D34"""
+"""821C8839005DAD21_B032B8B22DFD751A_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=CC(=C2)OCCN(C)C""",21,"""528CA2CC11127D34"""
+"""C7B6D725BA0D90C2_47EF7470BC9FD621_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""528CA2CC11127D34"""
+"""69E5E187678FB1A3_70C84CF44BF5D595_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""528CA2CC11127D34"""
+"""9E491A21032F923B_A204B27061FAFF26_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""528CA2CC11127D34"""
+"""349B43229C998CB6_72D17CF894A0CB35_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""528CA2CC11127D34"""
+"""28422200D8DCE21C_5D4448B78787A9F0_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""528CA2CC11127D34"""
+"""70B67FCFE61CC972_587FB6125BB77BD9_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""528CA2CC11127D34"""
+"""38E77EBEB56BCC41_9D8410E53B37E7ED_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""528CA2CC11127D34"""
+"""8EF23104CA70E9AE_8DA880B4E4D95319_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""528CA2CC11127D34"""
+"""FFB9D423336F7004_50BBD98D4A7AA763_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""528CA2CC11127D34"""
+"""B00DD4B866CFB923_C0C83DF7D3872DB6_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""528CA2CC11127D34"""
+"""092ACA735D6E48BD_E5E98D443388E36D_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""528CA2CC11127D34"""
+"""1D44E42D929E9417_83143D051A01520D_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=C(OCCC(C)C)C=C2""",21,"""528CA2CC11127D34"""
+"""BD77B48AA693307D_7E795E13E44BC25D_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=C(C=C2)OC3CCCC3""",21,"""528CA2CC11127D34"""
+"""78B19872537E0F1F_FF4F87ED53B0AA89_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""528CA2CC11127D34"""
+"""02E9082EA0F4F291_8A30E5DF299C0E3E_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""528CA2CC11127D34"""
+"""B4B8B9DBE7890C9B_75D72253FE9DF0D3_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""528CA2CC11127D34"""
+"""0C80755F41817D5A_8250CBA6D5E4DDCD_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""528CA2CC11127D34"""
+"""7098F194CEFDA9FD_F45BE5BA1D88DAA6_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""528CA2CC11127D34"""
+"""57C014B58F0ECE90_316B7480846CB3D9_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""528CA2CC11127D34"""
+"""D530086E769E5B13_5B0F41A67B5AB8B9_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""528CA2CC11127D34"""
+"""34DFC8460F8BE3EA_2A34F3D36A51364A_6005_UN""","""NC1=C(C=C(C=C1F)F)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""528CA2CC11127D34"""
+"""1BB7E2F375B44C52_98FF1FA6A8183F08_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""528CA2CC11127D34"""
+"""3AA3BA69184CC4D3_ED318D2E92B4AF3A_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""528CA2CC11127D34"""
+"""D2B23A0AE80E534F_BECDD577ACC60E2B_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(C=CC=C2)CN3CCCC3""",21,"""528CA2CC11127D34"""
+"""34C17A8BCCDBDAC6_261985F61074ED91_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=CC(=N[N]2C3CCCCO3)C""",21,"""528CA2CC11127D34"""
+"""FD91AF0F3F6C72CC_2C1EAFF54909096C_6005_UN""","""NC1=C(C=C(C=C1F)F)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""528CA2CC11127D34"""
+"""9E2607AF98EAFFAB_52B1A34D95BF351F_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""5341F2196424CCC3"""
+"""25F939932AEB1662_FDC65B616EAF99E3_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""5341F2196424CCC3"""
+"""E97F1284795D9A4C_01C62CA6F1446EC9_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""5341F2196424CCC3"""
+"""6034956D6AA8B161_5DFCD4F0626858CD_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""5341F2196424CCC3"""
+"""5B0F22248AB915D3_6ED4BB31E506AE65_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""5341F2196424CCC3"""
+"""DE469D9BEAE81F73_A5355F453D715A96_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""5341F2196424CCC3"""
+"""F39B82DAB9CCE69A_7D5A7B4969B54B1E_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=CC(=C2)COCCOC""",21,"""5341F2196424CCC3"""
+"""62E777A281BEAE16_F437F64867094072_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""5341F2196424CCC3"""
+"""09641C4D0B223CD8_EB2CE2AB5043A717_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""5341F2196424CCC3"""
+"""632A3B52FE02CBE8_B96D1A9FDBF6073B_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""5341F2196424CCC3"""
+"""65EBCE54FB3567D9_AC94FCAB408BA679_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""5341F2196424CCC3"""
+"""CDF90477751FA773_D52F9387B7B19A04_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""5341F2196424CCC3"""
+"""409B85C1AD500F20_CC0BB785DFDD7584_6005_UN""","""SCCC1=C(C=CC=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""5341F2196424CCC3"""
+"""D07BEEF882F79582_B1FFE86758CBC4ED_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""5341F2196424CCC3"""
+"""10CBC4B146E5AB35_462224A5C9A967D6_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""5341F2196424CCC3"""
+"""9CCFAEF61670B7AD_71051C213EC36462_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""5341F2196424CCC3"""
+"""96D76060823964B4_A3C9E2A514CC4ED1_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""5341F2196424CCC3"""
+"""7FF6BB6E98C24957_731C2C2DE1967AC2_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""5341F2196424CCC3"""
+"""477D404E5A9D12D4_5C891862F2B11807_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""5341F2196424CCC3"""
+"""DF4AEFB5F2CE02A4_59B2E6C72E81CA2E_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""5341F2196424CCC3"""
+"""F333E7F6E0374D22_9C4940304E01561A_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""5341F2196424CCC3"""
+"""5D46CDF7D281E8B5_8C65D06191EFE2EE_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""5341F2196424CCC3"""
+"""F746C96FFAFAFC26_517689583F4C1694_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""5341F2196424CCC3"""
+"""F7EC02659508DE68_C1056D22A6B19C41_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""5341F2196424CCC3"""
+"""238DC88B1A675672_E424DD9146BE529A_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""5341F2196424CCC3"""
+"""E878CE111D876E2D_82D96DD06F37E3FA_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""5341F2196424CCC3"""
+"""BCB64F731ACC758F_7FB40EC6917D73AA_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""5341F2196424CCC3"""
+"""900DF35FA2F1C91B_FE82D73826861B7E_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""5341F2196424CCC3"""
+"""0DB228229FFB7312_8BFDB50A5CAABFC9_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""5341F2196424CCC3"""
+"""88DB1D679A452F6C_741A72868BAB4124_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""5341F2196424CCC3"""
+"""43743B90E8C13B11_839D9B73A0D26C3A_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""5341F2196424CCC3"""
+"""3E032F89BBC3061F_F596B56F68BE6B51_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""5341F2196424CCC3"""
+"""4D6B85D136ADBDBB_30A62455F15A022E_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""5341F2196424CCC3"""
+"""2CA3F898C7AF6BC0_5AC211730E6C094E_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""5341F2196424CCC3"""
+"""F50BD33CDBEB3F96_2BF9A3061F6787BD_6005_UN""","""SCCC1=C(C=CC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""5341F2196424CCC3"""
+"""5C326C8AE2601852_99324F73DD2E8EFF_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""5341F2196424CCC3"""
+"""6EA74288E4437B24_ECFCDDFBE7821ECD_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""5341F2196424CCC3"""
+"""7956353A6A046AB9_BF0085A2D9F0BFDC_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""5341F2196424CCC3"""
+"""2B198BE68D272666_27D4D52365425C66_6005_UN""","""SCCC1=C(C=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""5341F2196424CCC3"""
+"""3D01B4ECA73F365A_2DD3FF203C3FB89B_6005_UN""","""SCCC1=C(C=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""5341F2196424CCC3"""
+"""2EABBC0136B7248A_AD358EFA2D38ACE6_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](CCN)(=O)=O)C2CC2""",21,"""53FDF015F3C3C1FE"""
+"""4C43D438FB1DED28_364C5E70809BA348_6036_UN""","""COC1=NC=C(C=C1)NCCN(C(C)C)[S](=O)(=O)CCN""",21,"""53FDF015F3C3C1FE"""
+"""D322F4ADE04C0A60_61C3B2C56EDB8014_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](C)(=O)=O)CCN=C=S""",21,"""53FDF015F3C3C1FE"""
+"""129D350A7345B3DA_7CD5B37D2073F9DC_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](CC)(=O)=O)CCCN""",21,"""53FDF015F3C3C1FE"""
+"""DB5B96EED660FE11_F60A1690D6A7CCFD_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](C)(=O)=O)C2CC(C2)N""",21,"""53FDF015F3C3C1FE"""
+"""5BD0EC6F1E5AE0E3_B0D01E97E6924E7C_6036_UN""","""COC1=NC=C(C=C1)NCCN(CCCN)[S](=O)(=O)CCl""",21,"""53FDF015F3C3C1FE"""
+"""54ADF50366DFD2CB_453192D13400DB3D_6036_UN""","""COC1=NC=C(C=C1)NCCN(C)[S](=O)(=O)C2CNCC2""",21,"""53FDF015F3C3C1FE"""
+"""7634817E27365CA9_FB6999C68BEF7EF9_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](CC)(=O)=O)CCCBr""",21,"""53FDF015F3C3C1FE"""
+"""94C9BCB3AB314BFC_4FB318C62EE1FD77_6036_UN""","""COC1=NC=C(C=C1)NCCN(CCCNC)[S](=O)(=O)C""",21,"""53FDF015F3C3C1FE"""
+"""AF69ECB3593594AC_AADE10A0A728E72F_6036_UN""","""COC1=NC=C(C=C1)NCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""53FDF015F3C3C1FE"""
+"""0CB2B90A6AFEADD7_F8957ABBFB1734E7_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](=O)(=O)CC#N)C2CC2""",21,"""53FDF015F3C3C1FE"""
+"""4BAA9B8D07FBD536_7B4111CD13B176F0_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](C)(=O)=O)C(=O)CCN""",21,"""53FDF015F3C3C1FE"""
+"""F6C09FD304A2C77C_BD47463DF7EFC203_6036_UN""","""COC1=NC=C(C=C1)NCCN(C)[S](=O)(=O)C2=CC=CS2""",21,"""53FDF015F3C3C1FE"""
+"""1F20710A84AF4FE2_1FE11BA4E7A0D042_6036_UN""","""COC1=NC=C(C=C1)NCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""53FDF015F3C3C1FE"""
+"""BDC4777B1BD9AA3C_D28640ED38EEF01D_6036_UN""","""COC1=NC=C(C=C1)NCCN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""53FDF015F3C3C1FE"""
+"""38D9F4DC7312C469_26FBEF5AF7EEA0B4_6036_UN""","""COC1=NC=C(C=C1)NCCN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""53FDF015F3C3C1FE"""
+"""0B1BC0742ECB42DC_2C0F085A6B9598B2_6036_UN""","""COC1=NC=C(C=C1)NCCN(CC(CC)N)[S](=O)(=O)C""",21,"""53FDF015F3C3C1FE"""
+"""F89F69F9CEB46D38_2E215D7B699E2899_6036_UN""","""COC1=NC=C(C=C1)NCCN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""53FDF015F3C3C1FE"""
+"""080B9C7FDBBD8E20_BDE34237B366F37D_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](C)(=O)=O)CCN=[N]#N""",21,"""53FDF015F3C3C1FE"""
+"""42F34228A812B46B_6D527591B51BF759_6036_UN""","""COC1=NC=C(C=C1)NCCN(CC(C)(C)N)[S](=O)(=O)C""",21,"""53FDF015F3C3C1FE"""
+"""95C2E8526D1E5EFB_275D122022D570D4_6036_UN""","""COC1=NC=C(C=C1)NCCN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""53FDF015F3C3C1FE"""
+"""972928F8ADFE16EA_CB608C4228FFD4DB_6036_UN""","""COC1=NC=C(C=C1)NCCN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""53FDF015F3C3C1FE"""
+"""E31E953B5248379D_C28D382683AAF961_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](=O)(=O)C2CC2)CC#C""",21,"""53FDF015F3C3C1FE"""
+"""3BBD16AB87018215_968D22AD64A43CA7_6036_UN""","""COC1=NC=C(C=C1)NCCN2[S](=O)(=O)C3(CCC2)CC3""",21,"""53FDF015F3C3C1FE"""
+"""83C5A40063983E02_BEE66D5041A0704F_6036_UN""","""COC1=NC=C(C=C1)NCCN2CCCC(C)(C)[S]2(=O)=O""",21,"""53FDF015F3C3C1FE"""
+"""34798178D71689F4_75CF9604C866BB5C_6036_UN""","""COC1=NC=C(C=C1)NCCN2CCCC(CC)[S]2(=O)=O""",21,"""53FDF015F3C3C1FE"""
+"""2BF6006364020578_44A6E6DEADDF0DF3_6036_UN""","""COC1=NC=C(C=C1)NCCN2C(C(N)CC[S]2(=O)=O)=O""",21,"""53FDF015F3C3C1FE"""
+"""7FC789CAB98A9E8E_9BB88170D7D734DD_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""53FDF015F3C3C1FE"""
+"""5CD2FBE616764FF0_30804FE90347A9F1_6036_UN""","""COC1=NC=C(C=C1)NCCN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""53FDF015F3C3C1FE"""
+"""A442818212726334_70ECFFB9067D704F_6036_UN""","""COC1=NC=C(C=C1)NCCN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""53FDF015F3C3C1FE"""
+"""AD1613FCF771C6B0_D8A3656DFD606F27_6036_UN""","""COC1=NC=C(C=C1)NCCN2[S](CCN(C)CC2)(=O)=O""",21,"""53FDF015F3C3C1FE"""
+"""88A785ED734B6DB8_543443E095C984C4_6036_UN""","""COC1=NC=C(C=C1)NCCN2CC(=O)NCC[S]2(=O)=O""",21,"""53FDF015F3C3C1FE"""
+"""BC5F2C808DB42C43_01CF5EE9386C4350_6036_UN""","""COC1=NC=C(C=C1)NCCN2[S](CCCCC2C)(=O)=O""",21,"""53FDF015F3C3C1FE"""
+"""E2FF84F78EA2A056_7B671B25968CACAE_6036_UN""","""COC1=NC=C(C=C1)NCCN(CCN)[S](=O)(=O)C2CC2""",21,"""53FDF015F3C3C1FE"""
+"""C6871620B8E11CC9_1D9D3DE432A03E59_6036_UN""","""COC1=NC=C(C=C1)NCCN(CCN)[S](=O)(=O)C(F)F""",21,"""53FDF015F3C3C1FE"""
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+"""582268C2F812F19F_2E08C35F60FEDDA0_6005_UN""","""O=[N](=O)C1=C(C=CC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""56B092401BBD96DE"""
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+"""AE76679E246FA8BF_BAF1E5FBA669E5C1_6005_UN""","""O=[N](=O)C1=C(C=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""56B092401BBD96DE"""
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+"""F264098A3ABA2C9E_28229F7943A6E286_6005_UN""","""O=[N](=O)C1=C(C=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""56B092401BBD96DE"""
+"""30A8BCD21183406B_57239D6D70A6FFA6_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC(=CC=C2)OC3CCCC3)O""",21,"""56D3CC39813D067A"""
+"""D004664E15B492CA_F85465418BB6535A_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC(=C(OCC)C=C2)OCC)O""",21,"""56D3CC39813D067A"""
+"""4408348A85DAE59F_04541286145DA470_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC=CC(=C2)OCCC(C)C)O""",21,"""56D3CC39813D067A"""
+"""C245433A0F980721_586EEAD087719274_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)O""",21,"""56D3CC39813D067A"""
+"""3C215B16B279B477_6B468511001F64DC_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC=C(C=C2)OC3CCOC3)O""",21,"""56D3CC39813D067A"""
+"""DF9B575AFB6EDA13_A0A76165D868902F_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC(=C(OC)C=C2)CN(C)C)O""",21,"""56D3CC39813D067A"""
+"""79A75D9E676677DA_78C845698CAC81A7_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC=CC(=C2)COCCOC)O""",21,"""56D3CC39813D067A"""
+"""CE53AB79213A8B3B_F1A5C86882108ACB_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC=CC(=C2)CN(C)C3CC3)O""",21,"""56D3CC39813D067A"""
+"""D49E441A775F82A2_EEBEDC8BB55A6DAE_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC=CC(=C2)OC(COC)C)O""",21,"""56D3CC39813D067A"""
+"""7AE4786098ECAF23_BCFF24BF3EEFCD82_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)O""",21,"""56D3CC39813D067A"""
+"""ABF0E153DD71FC66_A906C28BA5926CC0_6004_UN""","""NCC1=C(N=CC(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)O""",21,"""56D3CC39813D067A"""
+"""7DFB6739067619F8_D0BDADA752A850BD_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC(=CC=C2)CN3CCCC3)O""",21,"""56D3CC39813D067A"""
+"""2BA459621B7ABBA3_C99989A53AC4BF3D_6004_UN""","""NCC1=C(N=CC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)O""",21,"""56D3CC39813D067A"""
+"""AA4B3E8621E5C752_B46DD647BDD20E54_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC=CC(=C2)OCCN(C)C)O""",21,"""56D3CC39813D067A"""
+"""B48852C4E5F1EFA4_43B01A852CB0AD6F_6004_UN""","""NCC1=C(N=CC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)O""",21,"""56D3CC39813D067A"""
+"""D03BCF93874B20F4_74972201DBDAAEDB_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC=C(C=C2)C3=CC=CC=C3)O""",21,"""56D3CC39813D067A"""
+"""853D267BE5ED0C6E_A65BDC85F1D58468_6004_UN""","""NCC1=C(N=CC(=C1)C2=C(C=CC=C2F)OC(F)(F)F)O""",21,"""56D3CC39813D067A"""
+"""BA8F82FDB003082A_768E120D048FB07B_6004_UN""","""NCC1=C(N=CC(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)O""",21,"""56D3CC39813D067A"""
+"""9B373CD52835FF47_591B264217A8D2BE_6004_UN""","""NCC1=C(N=CC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)O""",21,"""56D3CC39813D067A"""
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+"""DDC6222C657A5C3C_BBD0A73F6688B88E_6004_UN""","""NC(=NO)C1=CSC=C1C2=C(C=CC=C2)CN3CCCC3""",21,"""5791D084DB5CCB91"""
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+"""12F5D1B770347647_FF3B9381BD411FAF_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN([S](CC)(=O)=O)CCCBr""",21,"""57AFFA52C56DA0A8"""
+"""BB25D26DA69555F2_4BE11281184F9C21_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN(CCCNC)[S](=O)(=O)C""",21,"""57AFFA52C56DA0A8"""
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+"""0663891128482D29_FCC770FCCDB955B1_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN([S](=O)(=O)CC#N)C2CC2""",21,"""57AFFA52C56DA0A8"""
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+"""3A7E1393FBA1A20A_B9154C7AC141A355_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN(C)[S](=O)(=O)C2=CC=CS2""",21,"""57AFFA52C56DA0A8"""
+"""829447F44B5B26DD_1BB311E3D10EB114_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""57AFFA52C56DA0A8"""
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+"""BC6693A0A6F09E61_69007FD683B5960F_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN(CC(C)(C)N)[S](=O)(=O)C""",21,"""57AFFA52C56DA0A8"""
+"""A43268160BCCA466_230F1867147B1182_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""57AFFA52C56DA0A8"""
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+"""AEECB6FE539A06AD_40F4EC999B716CA5_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN2C(C(N)CC[S]2(=O)=O)=O""",21,"""57AFFA52C56DA0A8"""
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+"""286EF8CB03471746_34D245AE35E9C8A7_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""57AFFA52C56DA0A8"""
+"""071C831179C5DBDA_74BEF5FE30D31119_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""57AFFA52C56DA0A8"""
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+"""B4024A86D9C68A16_506649A7A367E592_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN2CC(=O)NCC[S]2(=O)=O""",21,"""57AFFA52C56DA0A8"""
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+"""C20B3520697ABD02_7F351162A022CDF8_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN(CCN)[S](=O)(=O)C2CC2""",21,"""57AFFA52C56DA0A8"""
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+"""801C207C8D6CD193_B9CAABC63A05A1ED_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN([S](CC)(=O)=O)C2CNC2""",21,"""57AFFA52C56DA0A8"""
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+"""A40180BC1AF89938_CDCD9E387D4DA14A_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""57AFFA52C56DA0A8"""
+"""C7579BBCD28DF459_F3ACF98FB07369D1_6036_UN""","""CC1=C(C=CC(=C1)N)OCCN(C(C)(C)CN)[S](=O)(=O)C""",21,"""57AFFA52C56DA0A8"""
+"""295B22087E450780_A7AB451CD7387146_6036_UN""","""CN(CCN([S](CCN)(=O)=O)C1CC1)C2=CC=C(C=C2)N""",21,"""59633BF309C31C5E"""
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+"""2605F8A538AEC27F_FC94DD762CA7115D_6036_UN""","""CN(CCN([S](C)(=O)=O)C1CC(C1)N)C2=CC=C(C=C2)N""",21,"""59633BF309C31C5E"""
+"""B0D8BED4EF132E1B_BA4ED5711C9293DC_6036_UN""","""CN(CCN(CCCN)[S](=O)(=O)CCl)C1=CC=C(C=C1)N""",21,"""59633BF309C31C5E"""
+"""3FF5247B026A295F_4FAF5937CE00069D_6036_UN""","""CN(CCN(C)[S](=O)(=O)C1CNCC1)C2=CC=C(C=C2)N""",21,"""59633BF309C31C5E"""
+"""41815BF9DE91B711_F1F7522071EFA359_6036_UN""","""CN(CCN([S](CC)(=O)=O)CCCBr)C1=CC=C(C=C1)N""",21,"""59633BF309C31C5E"""
+"""ED58D6EFFF8BBCF2_452DD320D4E120D7_6036_UN""","""CN(CCN(CCCNC)[S](=O)(=O)C)C1=CC=C(C=C1)N""",21,"""59633BF309C31C5E"""
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+"""36BBDF300A0F5302_B1C020FF8F91B7A3_6005_UN""","""CCOC1=CC=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""5BECC87930437C5B"""
+"""0421808F9B0AB860_A439C6CB14EC16E1_6005_UN""","""CCOC1=CC=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""5BECC87930437C5B"""
+"""1C3697D1765BA025_DD82A9E7E3D62A9C_6005_UN""","""CCOC1=CC=C(C=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""5BECC87930437C5B"""
+"""0C5A6FA40AC839E9_C4A68DE58BBAC51C_6005_UN""","""CCOC1=CC=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""5BECC87930437C5B"""
+"""CBC0E32F5C6B5735_B952D2070CAC7475_6005_UN""","""CCOC1=CC=C(C=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""5BECC87930437C5B"""
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+"""DF7364A09FF4BF98_AB64D8C540ABFE49_6005_UN""","""CCOC1=CC=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""5BECC87930437C5B"""
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+"""3B20E6DEC5DDC895_511FDCA77AE67AB6_6005_UN""","""CCOC1=CC=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""5BECC87930437C5B"""
+"""A364443EA4791292_94E47A501A66E682_6005_UN""","""CCOC1=CC=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""5BECC87930437C5B"""
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+"""783D80038F7E3671_59DBB3386B2BA60C_6005_UN""","""CCOC1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""5BECC87930437C5B"""
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+"""3FF5BA1CB6B2D8B7_83508F6A08CD0F51_6005_UN""","""CCOC1=CC=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""5BECC87930437C5B"""
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+"""66D7171F2B6B921A_235499664B003725_6005_UN""","""CCOC1=CC=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""5BECC87930437C5B"""
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+"""189273C01624D533_E451E79BB3E5AE55_6005_UN""","""CCOC1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""5BECC87930437C5B"""
+"""A420FED72C618085_B7ADBFC28D970F44_6005_UN""","""CCOC1=CC=C(C=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""5BECC87930437C5B"""
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+"""F6E65EE2B5613A4B_A2DA9EE3C683D337_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N([S](CCN)(=O)=O)C2CC2""",21,"""5C12E00C1878BE2F"""
+"""83F56FD5148D3CB6_39A34E696B20DC99_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(C(C)C)[S](=O)(=O)CCN""",21,"""5C12E00C1878BE2F"""
+"""5A5EB429C7E240A7_6E2CA2DC8560FFC5_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N([S](C)(=O)=O)CCN=C=S""",21,"""5C12E00C1878BE2F"""
+"""E0377A25EC134219_733AA364CBC8860D_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N([S](CC)(=O)=O)CCCN""",21,"""5C12E00C1878BE2F"""
+"""668792FE9F329507_F9E506893D1CB32C_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N([S](C)(=O)=O)C2CC(C2)N""",21,"""5C12E00C1878BE2F"""
+"""4BA66FB1BFA0FDCF_BF3F0E8E0D2931AD_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(CCCN)[S](=O)(=O)CCl""",21,"""5C12E00C1878BE2F"""
+"""4FC64BB44A535CA3_4ADE82C8DFBBA4EC_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(C)[S](=O)(=O)C2CNCC2""",21,"""5C12E00C1878BE2F"""
+"""4E502973DC93D9E9_F48689DF60540128_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N([S](CC)(=O)=O)CCCBr""",21,"""5C12E00C1878BE2F"""
+"""E167933FBA1AA1E9_405C08DFC55A82A6_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(CCCNC)[S](=O)(=O)C""",21,"""5C12E00C1878BE2F"""
+"""1BB1E1A3891052E7_A53100B94C9398FE_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""5C12E00C1878BE2F"""
+"""73C00B187AFA0B0F_F77A6AA210AC4B36_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N([S](=O)(=O)CC#N)C2CC2""",21,"""5C12E00C1878BE2F"""
+"""16A97BD8F2150691_74AE01D4F80A0921_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N([S](C)(=O)=O)C(=O)CCN""",21,"""5C12E00C1878BE2F"""
+"""34738B339A406925_B2A856241C54BDD2_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""5C12E00C1878BE2F"""
+"""D47AFBCF6390AE73_100E0BBD0C1BAF93_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""5C12E00C1878BE2F"""
+"""F0D0E7AA7152BF33_DD6950F4D3558FCC_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""5C12E00C1878BE2F"""
+"""A151EA3F47D2A7C8_2914FF431C55DF65_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""5C12E00C1878BE2F"""
+"""3222F38866906F18_23E01843802EE763_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(CC(CC)N)[S](=O)(=O)C""",21,"""5C12E00C1878BE2F"""
+"""620F37BE7E4B7EFC_21CE4D6282255748_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""5C12E00C1878BE2F"""
+"""F4C30F4F1A4B5A9D_B20C522E58DD8CAC_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N([S](C)(=O)=O)CCN=[N]#N""",21,"""5C12E00C1878BE2F"""
+"""C5033E863FE80F12_62BD65885EA08888_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""5C12E00C1878BE2F"""
+"""CB5A3D0F9A328396_28B20239C96E0F05_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""5C12E00C1878BE2F"""
+"""EAF3C9313B9C0996_C48F9C5BC344AB0A_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""5C12E00C1878BE2F"""
+"""C9E00D4F66F8D340_CD62283F681186B0_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N([S](=O)(=O)C2CC2)CC#C""",21,"""5C12E00C1878BE2F"""
+"""E1B7A4AE56D7CDAA_996232B48F1F4376_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""5C12E00C1878BE2F"""
+"""1701B6E4958BFDA5_B1097D49AA1B0F9E_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N2CCCC(C)(C)[S]2(=O)=O""",21,"""5C12E00C1878BE2F"""
+"""66D8995C87D7F233_7A20861D23DDC48D_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N2CCCC(CC)[S]2(=O)=O""",21,"""5C12E00C1878BE2F"""
+"""4034D95C29A9C0C1_4B49F6C746647222_6036_UN""","""NCC(C1=C(C=CC=C1Cl)Cl)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""5C12E00C1878BE2F"""
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+"""44AF553B258B98A2_8F6D7D9DECB610F6_6006_UN""","""NCC(=O)C1=C(C2=C(S1)C=CC=C2)C3=C(CC)C=CC=C3""",21,"""5CECD9C7C9C66A15"""
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+"""538DB2E2E3CFA97F_592777BC0D8EC40E_6006_UN""","""NCC(=O)C1=C(C2=C(S1)C=CC=C2)C3=C(C)C=CC(=C3)F""",21,"""5CECD9C7C9C66A15"""
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+"""64B4CBA328A81825_40911579E4626D63_6006_UN""","""NCC(=O)C1=C(C2=C(S1)C=CC=C2)C3=CN=C(NC)C=C3""",21,"""5CECD9C7C9C66A15"""
+"""8C6368B95CE11F0A_FCE9C9222CA66332_2201_UN""","""NC1=CC4=C(N=C1C2=C(C3=C(S2)C=CC=C3)Cl)N=CC=C4""",21,"""5CECD9C7C9C66A15"""
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+"""B78E998042F90426_7DDC4DC6D6290C91_2201_UN""","""NC2=C(C)C1=C(SC=C1)N=C2C3=C(C4=C(S3)C=CC=C4)Cl""",21,"""5CECD9C7C9C66A15"""
+"""91E22BB1548902EA_75E1B77935599D7F_2201_UN""","""NC2=CC1=C([N](C)N=C1)N=C2C3=C(C4=C(S3)C=CC=C4)Cl""",21,"""5CECD9C7C9C66A15"""
+"""6E092AF4E9F42D7E_89666A36D2C863AA_2201_UN""","""NC1=CC4=C(N=C1C2=C(C3=C(S2)C=CC=C3)Cl)C=NC=C4""",21,"""5CECD9C7C9C66A15"""
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+"""0B428991F264730F_8E7E61146A4F27C3_6005_UN""","""OC(=O)C1=C(C=NC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""5EA2087EAEB9873A"""
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+"""70AE12657A805B55_E11F279C2D1F5534_6005_UN""","""OC(=O)C1=C(C=NC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""5EA2087EAEB9873A"""
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+"""BC99B40130CB094D_A06E3D0423A8F346_6036_UN""","""NCC1(CCOCC1)OCCN([S](CCN)(=O)=O)C2CC2""",21,"""5EA643EBFD539E5E"""
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+"""2BCC13075BE24BE2_6C98013B604BDFB4_6036_UN""","""NCC1(CCOCC1)OCCN([S](C)(=O)=O)CCN=C=S""",21,"""5EA643EBFD539E5E"""
+"""C97080BF05858B70_718E00832EE3A67C_6036_UN""","""NCC1(CCOCC1)OCCN([S](CC)(=O)=O)CCCN""",21,"""5EA643EBFD539E5E"""
+"""1B0E5A45C651703F_FB51A56ED837935D_6036_UN""","""NCC1(CCOCC1)OCCN([S](C)(=O)=O)C2CC(C2)N""",21,"""5EA643EBFD539E5E"""
+"""F3DD22A958A00F9C_BD8BAD69E80211DC_6036_UN""","""NCC1(CCOCC1)OCCN(CCCN)[S](=O)(=O)CCl""",21,"""5EA643EBFD539E5E"""
+"""D4372E9B07C69E08_486A212F3A90849D_6036_UN""","""NCC1(CCOCC1)OCCN(C)[S](=O)(=O)C2CNCC2""",21,"""5EA643EBFD539E5E"""
+"""8BB95E4A0102BF85_F6322A38857F2159_6036_UN""","""NCC1(CCOCC1)OCCN([S](CC)(=O)=O)CCCBr""",21,"""5EA643EBFD539E5E"""
+"""64388C5DB6101721_42E8AB382071A2D7_6036_UN""","""NCC1(CCOCC1)OCCN(CCCNC)[S](=O)(=O)C""",21,"""5EA643EBFD539E5E"""
+"""9AEB54B5CC7E31DC_A785A35EA9B8B88F_6036_UN""","""NCC1(CCOCC1)OCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""5EA643EBFD539E5E"""
+"""E67A0088857D8B59_F5CEC945F5876B47_6036_UN""","""NCC1(CCOCC1)OCCN([S](=O)(=O)CC#N)C2CC2""",21,"""5EA643EBFD539E5E"""
+"""9D64ED1A646ED0D8_761AA2331D212950_6036_UN""","""NCC1(CCOCC1)OCCN([S](C)(=O)=O)C(=O)CCN""",21,"""5EA643EBFD539E5E"""
+"""8092C5152A1977B4_B01CF5C3F97F9DA3_6036_UN""","""NCC1(CCOCC1)OCCN(C)[S](=O)(=O)C2=CC=CS2""",21,"""5EA643EBFD539E5E"""
+"""BE0368AF754C9EAD_12BAA85AE9308FE2_6036_UN""","""NCC1(CCOCC1)OCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""5EA643EBFD539E5E"""
+"""BBCAD34916F7EB1E_DFDDF313367EAFBD_6036_UN""","""NCC1(CCOCC1)OCCN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""5EA643EBFD539E5E"""
+"""52325F24DB4786DE_2BA05CA4F97EFF14_6036_UN""","""NCC1(CCOCC1)OCCN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""5EA643EBFD539E5E"""
+"""3AF708F1D530986A_2154BBA46505C712_6036_UN""","""NCC1(CCOCC1)OCCN(CC(CC)N)[S](=O)(=O)C""",21,"""5EA643EBFD539E5E"""
+"""A2204FA23648BFC2_237AEE85670E7739_6036_UN""","""NCC1(CCOCC1)OCCN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""5EA643EBFD539E5E"""
+"""5D4A4FE76F3D3E26_B0B8F1C9BDF6ACDD_6036_UN""","""NCC1(CCOCC1)OCCN([S](C)(=O)=O)CCN=[N]#N""",21,"""5EA643EBFD539E5E"""
+"""F68CDD08A00EB417_6009C66FBB8BA8F9_6036_UN""","""NCC1(CCOCC1)OCCN(CC(C)(C)N)[S](=O)(=O)C""",21,"""5EA643EBFD539E5E"""
+"""AAC18174C21141BD_2A06A1DE2C452F74_6036_UN""","""NCC1(CCOCC1)OCCN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""5EA643EBFD539E5E"""
+"""7AD65FEE54480D98_C63B3FBC266F8B7B_6036_UN""","""NCC1(CCOCC1)OCCN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""5EA643EBFD539E5E"""
+"""8CFAB1F5DC3EC4F9_CFD68BD88D3AA6C1_6036_UN""","""NCC1(CCOCC1)OCCN([S](=O)(=O)C2CC2)CC#C""",21,"""5EA643EBFD539E5E"""
+"""24B848D7C92A61BB_9BD691536A346307_6036_UN""","""NCC1(CCOCC1)OCCN2[S](=O)(=O)C3(CCC2)CC3""",21,"""5EA643EBFD539E5E"""
+"""BF541B5592B6C2D2_B3BDDEAE4F302FEF_6036_UN""","""NCC1(CCOCC1)OCCN2CCCC(C)(C)[S]2(=O)=O""",21,"""5EA643EBFD539E5E"""
+"""C7B3B9D221CB00C3_789425FAC6F6E4FC_6036_UN""","""NCC1(CCOCC1)OCCN2CCCC(CC)[S]2(=O)=O""",21,"""5EA643EBFD539E5E"""
+"""97E451C5CE250EE3_49FD5520A34F5253_6036_UN""","""NCC1(CCOCC1)OCCN2C(C(N)CC[S]2(=O)=O)=O""",21,"""5EA643EBFD539E5E"""
+"""D116C5695AFFCEEC_96E3328ED9476B7D_6036_UN""","""NCC1(CCOCC1)OCCN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""5EA643EBFD539E5E"""
+"""64AC32D235A56333_3DDBFC170DD7F651_6036_UN""","""NCC1(CCOCC1)OCCN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""5EA643EBFD539E5E"""
+"""DACE2D7DA169FEF8_7DB74C4708ED2FEF_6036_UN""","""NCC1(CCOCC1)OCCN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""5EA643EBFD539E5E"""
+"""7BB3116504766C1F_D5F8D693F3F03087_6036_UN""","""NCC1(CCOCC1)OCCN2[S](CCN(C)CC2)(=O)=O""",21,"""5EA643EBFD539E5E"""
+"""16ED5EFEAE81F2B2_596FF01E9B59DB64_6036_UN""","""NCC1(CCOCC1)OCCN2CC(=O)NCC[S]2(=O)=O""",21,"""5EA643EBFD539E5E"""
+"""A4B252CA32A92677_0C94ED1736FC1CF0_6036_UN""","""NCC1(CCOCC1)OCCN2[S](CCCCC2C)(=O)=O""",21,"""5EA643EBFD539E5E"""
+"""CC1962640ACE789F_763CA8DB981CF30E_6036_UN""","""NCC1(CCOCC1)OCCN(CCN)[S](=O)(=O)C2CC2""",21,"""5EA643EBFD539E5E"""
+"""C3AAE3FE01FCEB9E_10C68E1A3C3061F9_6036_UN""","""NCC1(CCOCC1)OCCN(CCN)[S](=O)(=O)C(F)F""",21,"""5EA643EBFD539E5E"""
+"""7A794BE09B6D4A6E_B0C3127F023B9F1B_6036_UN""","""NCC1(CCOCC1)OCCN([S](CC)(=O)=O)C2CNC2""",21,"""5EA643EBFD539E5E"""
+"""5E08A50F3FD5052F_825AC64395D2CB66_6036_DP""","""NCC1(CCOCC1)OCCN3CC2(CNC2)C[S]3(=O)=O""",21,"""5EA643EBFD539E5E"""
+"""B82080E9DC91FB02_382FBFD14C118F0C_6036_UN""","""NCC1(CCOCC1)OCCN(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""5EA643EBFD539E5E"""
+"""D5A506EDD1297DA8_C4C4278145739FBC_6036_UN""","""NCC1(CCOCC1)OCCN(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""5EA643EBFD539E5E"""
+"""D653869E09F22500_FAA54036884D5727_6036_UN""","""NCC1(CCOCC1)OCCN(C(C)(C)CN)[S](=O)(=O)C""",21,"""5EA643EBFD539E5E"""
+"""B6D22365684687F6_A145965D1B88ADAE_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](CCN)(=O)=O)C2CC2""",21,"""5F8DE8B2C573C0B6"""
+"""CE196DC690AA2952_3A3C46D7B62BA200_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""5F8DE8B2C573C0B6"""
+"""F113BA932BB9B8EE_6DB3AA62586B815C_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""5F8DE8B2C573C0B6"""
+"""861A6A0BA13108A7_70A5ABDA16C3F894_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](CC)(=O)=O)CCCN""",21,"""5F8DE8B2C573C0B6"""
+"""6613D023FF1D8778_FA7A0E37E017CDB5_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2CC(C2)N""",21,"""5F8DE8B2C573C0B6"""
+"""F83F13C151F7A5C8_BCA00630D0224F34_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""5F8DE8B2C573C0B6"""
+"""4C9F84788CE735D9_49418A7602B0DA75_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2CNCC2""",21,"""5F8DE8B2C573C0B6"""
+"""7F2E5FB1BF9C4AC0_F7198161BD5F7FB1_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](CC)(=O)=O)CCCBr""",21,"""5F8DE8B2C573C0B6"""
+"""5C7BB47DE3E89134_43C300611851FC3F_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(CCCNC)[S](=O)(=O)C""",21,"""5F8DE8B2C573C0B6"""
+"""E86BB5B6A8B06FE1_A6AE08079198E667_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""5F8DE8B2C573C0B6"""
+"""1BBE6C77E5EFCEF9_F4E5621CCDA735AF_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](=O)(=O)CC#N)C2CC2""",21,"""5F8DE8B2C573C0B6"""
+"""C8FC062134C89E0D_7731096A250177B8_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""5F8DE8B2C573C0B6"""
+"""4712D0C1589D309A_B1375E9AC15FC34B_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""5F8DE8B2C573C0B6"""
+"""A47EA0192EFD8365_13910303D110D10A_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""5F8DE8B2C573C0B6"""
+"""B8E754E25C643D2E_DEF6584A0E5EF155_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""5F8DE8B2C573C0B6"""
+"""F2FA79C76E920ECF_2A8BF7FDC15EA1FC_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""5F8DE8B2C573C0B6"""
+"""2D10F241730D0DEC_207F10FD5D2599FA_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""5F8DE8B2C573C0B6"""
+"""6D8F84BD22F9F434_225145DC5F2E29D1_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""5F8DE8B2C573C0B6"""
+"""E390ED0DC49B19FF_B1935A9085D6F235_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""5F8DE8B2C573C0B6"""
+"""B2D4835E49138CD8_61226D3683ABF611_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""5F8DE8B2C573C0B6"""
+"""5FEF01D036DF4304_2B2D0A871465719C_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""5F8DE8B2C573C0B6"""
+"""282FB3CF3F06A0DA_C71094E51E4FD593_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""5F8DE8B2C573C0B6"""
+"""6A743FC0AF1B2E3C_CEFD2081B51AF829_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](=O)(=O)C2CC2)CC#C""",21,"""5F8DE8B2C573C0B6"""
+"""35D3B091850E2917_9AFD3A0A52143DEF_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""5F8DE8B2C573C0B6"""
+"""4B861BC7A4D49A82_B29675F777107107_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N2CCCC(C)(C)[S]2(=O)=O""",21,"""5F8DE8B2C573C0B6"""
+"""058F2CA850F0980D_79BF8EA3FED6BA14_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N2CCCC(CC)[S]2(=O)=O""",21,"""5F8DE8B2C573C0B6"""
+"""FBF7B8A73ABD9D65_48D6FE799B6F0CBB_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""5F8DE8B2C573C0B6"""
+"""AC5A4E92E6A772CA_97C899D7E1673595_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""5F8DE8B2C573C0B6"""
+"""DFA60CFF167CE02A_3CF0574E35F7A8B9_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""5F8DE8B2C573C0B6"""
+"""37266E9F3614C6CB_7C9CE71E30CD7107_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""5F8DE8B2C573C0B6"""
+"""7DC007E8461487A3_D4D37DCACBD06E6F_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N2[S](CCN(C)CC2)(=O)=O""",21,"""5F8DE8B2C573C0B6"""
+"""2439654409362C2E_58445B47A379858C_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N2CC(=O)NCC[S]2(=O)=O""",21,"""5F8DE8B2C573C0B6"""
+"""4848270AA11787F8_0DBF464E0EDC4218_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N2[S](CCCCC2C)(=O)=O""",21,"""5F8DE8B2C573C0B6"""
+"""6DA95BBFB4D871B7_77170382A03CADE6_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(CCN)[S](=O)(=O)C2CC2""",21,"""5F8DE8B2C573C0B6"""
+"""ED53B4A2D50DC7DA_11ED254304103F11_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""5F8DE8B2C573C0B6"""
+"""B4BD64373FA68F72_B1E8B9263A1BC1F3_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N([S](CC)(=O)=O)C2CNC2""",21,"""5F8DE8B2C573C0B6"""
+"""0812E0EA68D8EF09_83716D1AADF2958E_6036_DP""","""CC(N)C(C1=CC=C(C=C1)Br)N3CC2(CNC2)C[S]3(=O)=O""",21,"""5F8DE8B2C573C0B6"""
+"""87563DC2C3DF694B_390414887431D1E4_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""5F8DE8B2C573C0B6"""
+"""D952DF436EC80303_C5EF8CD87D53C154_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""5F8DE8B2C573C0B6"""
+"""08D2CD7513B4E54C_FB8EEB6FB06D09CF_6036_UN""","""CC(N)C(C1=CC=C(C=C1)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""5F8DE8B2C573C0B6"""
+"""717EE123FF7D5063_5E398559986F03B0_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""5FC9D40D69F4FA6C"""
+"""5D7DEF085C5BC849_F14E7D75637FAF4C_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""5FC9D40D69F4FA6C"""
+"""EA552EF2966D3196_0D4E0AB2FC945866_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""5FC9D40D69F4FA6C"""
+"""A93B6C53297AB1D3_5174F2E46FB86E62_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""5FC9D40D69F4FA6C"""
+"""EE829B643F02865B_625C9D25E8D698CA_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""5FC9D40D69F4FA6C"""
+"""400DE5B148A0F3AC_A9BD795130A16C39_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""5FC9D40D69F4FA6C"""
+"""A5CAA6A6B644666D_71D25D5D64657DB1_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC=CC(=C2)COCCOC""",21,"""5FC9D40D69F4FA6C"""
+"""E4663390E05DD9E8_F8BFD05C6AD976DD_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""5FC9D40D69F4FA6C"""
+"""59268CB6C1F75F9C_E7A4C4BF5D9391B8_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""5FC9D40D69F4FA6C"""
+"""946429BEDE9A300A_B5E53C8BD6263194_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""5FC9D40D69F4FA6C"""
+"""5D8BF3DBC6AE96C9_A01CDABF4D5B90D6_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""5FC9D40D69F4FA6C"""
+"""8123161C2B86FD9D_D9A7B593BA61ACAB_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""5FC9D40D69F4FA6C"""
+"""9B8578BFB3FAD214_C0839191D20D432B_6004_UN""","""NC(=N)C1=NC=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""5FC9D40D69F4FA6C"""
+"""46F69319F5E41B33_BD77CE73551BF242_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""5FC9D40D69F4FA6C"""
+"""51A5F8AD08A3AC28_4AAA02B1C4795179_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""5FC9D40D69F4FA6C"""
+"""D6852D1D91DBB110_7D8D3A35331352CD_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""5FC9D40D69F4FA6C"""
+"""FC7C8B2807E6F3D8_AF41C4B1191C787E_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""5FC9D40D69F4FA6C"""
+"""217E46EFC0F8600E_7F940A39EC464C6D_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""5FC9D40D69F4FA6C"""
+"""E136D95D455F3782_50013E76FF612EA8_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""5FC9D40D69F4FA6C"""
+"""FF31E9E43F157CB1_553AC0D32351FC81_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""5FC9D40D69F4FA6C"""
+"""46C9222A8C7DF958_90C1662443D160B5_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""5FC9D40D69F4FA6C"""
+"""3164CA79DB26246D_80EDF6759C3FD441_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""5FC9D40D69F4FA6C"""
+"""0B85DE9D1B397910_5DFEAF4C329C203B_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""5FC9D40D69F4FA6C"""
+"""8967555DBEB00515_CD8D4B36AB61AAEE_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""5FC9D40D69F4FA6C"""
+"""77B52A5886FE61C4_E8ACFB854B6E6435_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""5FC9D40D69F4FA6C"""
+"""506129E764330764_8E514BC462E7D555_6004_UN""","""NC(=N)C1=NC=C(C=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""5FC9D40D69F4FA6C"""
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+"""BECD9D365E4944DD_481797D70F9886C3_6036_UN""","""NC1=CC2=C(C=C1)C(CCC2)N(CCN)[S](=O)(=O)C3CC3""",21,"""608D7CE76AD7EB93"""
+"""42C243DE4F0A562E_2EEDB116ABB41434_6036_UN""","""NC1=CC2=C(C=C1)C(CCC2)N(CCN)[S](=O)(=O)C(F)F""",21,"""608D7CE76AD7EB93"""
+"""8A41569018A3647A_8EE82D7395BFEAD6_6036_UN""","""NC1=CC2=C(C=C1)C(CCC2)N([S](CC)(=O)=O)C3CNC3""",21,"""608D7CE76AD7EB93"""
+"""C095AC2A739B719B_BC71F94F0256BEAB_6036_DP""","""NC1=CC2=C(C=C1)C(CCC2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""608D7CE76AD7EB93"""
+"""2DE3678C2C3B3784_060480DDDB95FAC1_6036_UN""","""NC1=CC2=C(C=C1)C(CCC2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""608D7CE76AD7EB93"""
+"""1A4076020C9FCEC5_FAEF188DD2F7EA71_6036_UN""","""NC1=CC2=C(C=C1)C(CCC2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""608D7CE76AD7EB93"""
+"""D3FF4C7F0CCDCFF6_C48E7F3A1FC922EA_6036_UN""","""NC1=CC2=C(C=C1)C(CCC2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""608D7CE76AD7EB93"""
+"""426D03EAB9447311_616ACC7C295534A4_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=CC=C2)OC3CCCC3)Cl""",21,"""609A9D28D8CECD78"""
+"""D4D88CC522DD6E67_CE1D3450D2459858_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=C(OCC)C=C2)OCC)Cl""",21,"""609A9D28D8CECD78"""
+"""377DCC6407C5941A_321D43974DAE6F72_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=CC(=C2)OCCC(C)C)Cl""",21,"""609A9D28D8CECD78"""
+"""5340D2E9891D049C_6E27BBC1DE825976_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=C(C=C2)C[N]3C=CN=C3)Cl""",21,"""609A9D28D8CECD78"""
+"""8FCBA8493D31CF4E_5D0FD40059ECAFDE_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=C(C=C2)OC3CCOC3)Cl""",21,"""609A9D28D8CECD78"""
+"""541A38730DA9BEE2_96EE3074819B5B2D_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=C(OC)C=C2)CN(C)C)Cl""",21,"""609A9D28D8CECD78"""
+"""1709D865229F820E_4E811478D55F4AA5_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=CC(=C2)COCCOC)Cl""",21,"""609A9D28D8CECD78"""
+"""32677D547C88B73F_C7EC9979DBE341C9_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=CC(=C2)CN(C)C3CC3)Cl""",21,"""609A9D28D8CECD78"""
+"""CC38AF5E578A4A3E_D8F78D9AECA9A6AC_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=CC(=C2)OC(COC)C)Cl""",21,"""609A9D28D8CECD78"""
+"""AA806E021EB0CFB7_8AB675AE671C0680_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=C(C(NOC)=O)C=C2)F)Cl""",21,"""609A9D28D8CECD78"""
+"""3F38F7E296C47028_9F4F939AFC61A7C2_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(OC)N=C(C=C2)C(F)(F)F)Cl""",21,"""609A9D28D8CECD78"""
+"""3E3FEA65E3A6C8B7_E6F4FCB60B5B9BBF_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=CC=C2)CN3CCCC3)Cl""",21,"""609A9D28D8CECD78"""
+"""880E3958B393465A_FFD0D8B46337743F_6004_UN""","""NCC1=C(C=C(C=N1)C3=CC=C([N]2C=C(C)C=N2)C=C3)Cl""",21,"""609A9D28D8CECD78"""
+"""D44FACB99D282C9D_82248756E421C556_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=CC(=C2)OCCN(C)C)Cl""",21,"""609A9D28D8CECD78"""
+"""50EAC9FC254832FE_75F94B947543666D_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(C=C(C(C)C)C=C2)C(C)C)Cl""",21,"""609A9D28D8CECD78"""
+"""ABF981EBEA2EBBEC_42DE7310822965D9_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=C(C=C2)C3=CC=CC=C3)Cl""",21,"""609A9D28D8CECD78"""
+"""EA613A9F4EE422CC_90128D94A8264F6A_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(C=CC=C2F)OC(F)(F)F)Cl""",21,"""609A9D28D8CECD78"""
+"""3797A8FDB111CA86_40C7431C5D7C7B79_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Cl""",21,"""609A9D28D8CECD78"""
+"""700C95E114208DD9_6F5277534E5B19BC_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(C=C(OC)C=C2)C(F)(F)F)Cl""",21,"""609A9D28D8CECD78"""
+"""8F2F56A96F9A8F3B_6A6989F6926BCB95_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=CC(=C2F)C(N(C)C)=O)Cl""",21,"""609A9D28D8CECD78"""
+"""519E6EB59E4EB1D7_AF922F01F2EB57A1_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=C(OC)C=C2)C(F)(F)F)Cl""",21,"""609A9D28D8CECD78"""
+"""8380E2C07342610D_BFBEBF502D05E355_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Cl""",21,"""609A9D28D8CECD78"""
+"""85792583306E4B8F_62ADE66983A6172F_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=CC=C2)C3=CC=CC=C3)Cl""",21,"""609A9D28D8CECD78"""
+"""5FD32313C6F6FF81_F2DE02131A5B9DFA_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(OC)C=C(C=C2)C(F)(F)F)Cl""",21,"""609A9D28D8CECD78"""
+"""D5151656DB065989_D7FFB2A0FA545321_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(C)C=C(C=C2)OC(F)(F)F)Cl""",21,"""609A9D28D8CECD78"""
+"""C9A76370734BFBF1_B10202E1D3DDE241_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=C(OCCC(C)C)C=C2)Cl""",21,"""609A9D28D8CECD78"""
+"""EDE0A8CF58619454_4C6F61F72D977211_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=C(C=C2)OC3CCCC3)Cl""",21,"""609A9D28D8CECD78"""
+"""1CC485B4F399848B_CD59B8099A6C1AC5_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(C=C(OC)C=C2)CN(C)C)Cl""",21,"""609A9D28D8CECD78"""
+"""4236D16E2131B67D_B826DA3BE040BE72_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=C(N=C2)C(F)(F)F)OC)Cl""",21,"""609A9D28D8CECD78"""
+"""29EA8ABC952E5AA2_47C11DB73741409F_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(C)C=C(C=C2)OCC3CC3)Cl""",21,"""609A9D28D8CECD78"""
+"""2FDEB6088CC96F5A_B046F4421C386D81_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(C=CC(=C2)C3(CC3)C#N)F)Cl""",21,"""609A9D28D8CECD78"""
+"""5B2ED74643C7422B_C64DDA5ED4546AEA_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(OCC(C)(C)C)N=CC=C2)Cl""",21,"""609A9D28D8CECD78"""
+"""87EECB7E5377B15D_037D4B644DB00395_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC=C(C=C2)C[N]3C=NC=N3)Cl""",21,"""609A9D28D8CECD78"""
+"""366911E3007D3D67_69197E42B28608F5_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(OCC)C=CC(=C2)[N](=O)=O)Cl""",21,"""609A9D28D8CECD78"""
+"""1FB2539AFF977594_1822CC37A38D8606_6004_UN""","""NCC1=C(C=C(C=N1)C3=CC2=C(C=C(OC)C=C2)C=C3)Cl""",21,"""609A9D28D8CECD78"""
+"""B19A3D615DDE3943_AAE9204261C48F44_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=C(C=C2C3CC3)Cl)OC)Cl""",21,"""609A9D28D8CECD78"""
+"""24951E0A00095821_DF27B2CA5B681F76_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=CC=C2)C3=CC=NC=C3)Cl""",21,"""609A9D28D8CECD78"""
+"""E77C3A44B94CD5F7_8CDBEA93651ABE67_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(C=CC=C2)CN3CCCC3)Cl""",21,"""609A9D28D8CECD78"""
+"""D08D92AADBE1B2D1_140FBA12D9A85DDD_6004_UN""","""NCC1=C(C=C(C=N1)C2=CC(=N[N]2C3CCCCO3)C)Cl""",21,"""609A9D28D8CECD78"""
+"""9FFCF8CEF8EE2E54_1E08901180D5B920_6004_UN""","""NCC1=C(C=C(C=N1)C2=C(C=C(C=C2)OC(F)(F)F)F)Cl""",21,"""609A9D28D8CECD78"""
+"""BF94B274761D41BC_9F9903F99505998F_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](CCN)(=O)=O)C3CC3""",21,"""61517D164BFEF497"""
+"""B7FF0DE29C61D926_04E0D37338A69621_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""61517D164BFEF497"""
+"""D448C20543938302_536F3FC6D6E6B57D_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""61517D164BFEF497"""
+"""DB5E279353DFD2BD_4E793E7E984ECCB5_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](CC)(=O)=O)CCCN""",21,"""61517D164BFEF497"""
+"""54B945A73B0F4320_C4A69B936E9AF994_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](C)(=O)=O)C3CC(C3)N""",21,"""61517D164BFEF497"""
+"""8482E0632BC5D8DB_827C93945EAF7B15_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""61517D164BFEF497"""
+"""160B320C25E984E4_779D1FD28C3DEE54_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C)[S](=O)(=O)C3CNCC3""",21,"""61517D164BFEF497"""
+"""E748B0FCD0EE5271_C9C514C533D24B90_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](CC)(=O)=O)CCCBr""",21,"""61517D164BFEF497"""
+"""9548C694D8122E73_7D1F95C596DCC81E_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(CCCNC)[S](=O)(=O)C""",21,"""61517D164BFEF497"""
+"""F60EECEDB62F63AD_98729DA31F15D246_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""61517D164BFEF497"""
+"""326D72A714000265_CA39F7B8432A018E_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](=O)(=O)CC#N)C3CC3""",21,"""61517D164BFEF497"""
+"""6E945BDFBDEF5F6A_49ED9CCEAB8C4399_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""61517D164BFEF497"""
+"""5629EDF822B3FF1C_8FEBCB3E4FD2F76A_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""61517D164BFEF497"""
+"""64159F4E58FA2FA3_2D4D96A75F9DE52B_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""61517D164BFEF497"""
+"""1B82269A98FA2981_E02ACDEE80D3C574_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""61517D164BFEF497"""
+"""CC723986F72D52B6_145762594FD395DD_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""61517D164BFEF497"""
+"""07E13F959A8F58BE_1EA38559D3A8ADDB_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""61517D164BFEF497"""
+"""D245C9807B0EB7E6_1C8DD078D1A31DF0_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""61517D164BFEF497"""
+"""5E25A4A9B281E337_8F4FCF340B5BC614_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""61517D164BFEF497"""
+"""4C57B2AFCA294FBB_5FFEF8920D26C230_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""61517D164BFEF497"""
+"""1A561FD4927A1C79_15F19F239AE845BD_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""61517D164BFEF497"""
+"""EBE146143F50A431_F9CC014190C2E1B2_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""61517D164BFEF497"""
+"""F1C75176FC355D32_F021B5253B97CC08_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](=O)(=O)C3CC3)CC#C""",21,"""61517D164BFEF497"""
+"""FA78A21812AC9998_A421AFAEDC9909CE_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""61517D164BFEF497"""
+"""75BCF55604DB0C5D_8C4AE053F99D4526_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N3CCCC(C)(C)[S]3(=O)=O""",21,"""61517D164BFEF497"""
+"""F51A7091E247F238_47631B07705B8E35_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N3CCCC(CC)[S]3(=O)=O""",21,"""61517D164BFEF497"""
+"""03874FB3D7FCFE4F_760A6BDD15E2389A_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""61517D164BFEF497"""
+"""56369C4C4D51C029_A9140C736FEA01B4_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""61517D164BFEF497"""
+"""417E8D611996E695_022CC2EABB7A9C98_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""61517D164BFEF497"""
+"""00857740F5A2D218_424072BABE404526_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""61517D164BFEF497"""
+"""80593BD13058D67A_EA0FE86E455D5A4E_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N3[S](CCN(C)CC3)(=O)=O""",21,"""61517D164BFEF497"""
+"""635B242BDB8BAE12_6698CEE32DF4B1AD_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N3CC(=O)NCC[S]3(=O)=O""",21,"""61517D164BFEF497"""
+"""33351670F7DAFEBC_3363D3EA80517639_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N3[S](CCCCC3C)(=O)=O""",21,"""61517D164BFEF497"""
+"""B7B5D04B6668FE3C_49CB96262EB199C7_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(CCN)[S](=O)(=O)C3CC3""",21,"""61517D164BFEF497"""
+"""07FD7B97D49F8E8F_2F31B0E78A9D0B30_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""61517D164BFEF497"""
+"""B428BF4B19A009FF_8F342C82B496F5D2_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N([S](CC)(=O)=O)C3CNC3""",21,"""61517D164BFEF497"""
+"""4799AAD19D9F5713_BDADF8BE237FA1AF_6036_DP""","""C(C2=CC(=C1OCOC1=C2)Br)N4CC3(CNC3)C[S]4(=O)=O""",21,"""61517D164BFEF497"""
+"""FD67EF525446FE64_07D8812CFABCE5C5_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""61517D164BFEF497"""
+"""B31E0CE1C1FF088E_FB33197CF3DEF575_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""61517D164BFEF497"""
+"""F1C34B09060CE3E3_C5527ECB3EE03DEE_6036_UN""","""C(C2=CC(=C1OCOC1=C2)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""61517D164BFEF497"""
+"""89778BF7C6DAB61C_609B851171723099_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC(=CC=C2)OC3CCCC3""",21,"""616BD44580E9C945"""
+"""0B6476CBCA5C6A76_CFEC7D3D8A629C65_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC(=C(OCC)C=C2)OCC""",21,"""616BD44580E9C945"""
+"""8CDEE7C3534BED65_33EC0AFA15896B4F_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC=CC(=C2)OCCC(C)C""",21,"""616BD44580E9C945"""
+"""7DF0CD55CF80C36D_6FD6F2AC86A55D4B_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""616BD44580E9C945"""
+"""B0F8F2EE8EDB7C0C_5CFE9D6D01CBABE3_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC=C(C=C2)OC3CCOC3""",21,"""616BD44580E9C945"""
+"""7D66079DFE7ABE83_971F7919D9BC5F10_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""616BD44580E9C945"""
+"""D0935A0172D10AE3_4F705D158D784E98_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC=CC(=C2)COCCOC""",21,"""616BD44580E9C945"""
+"""B5A5B3974A28F1F1_C61DD01483C445F4_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""616BD44580E9C945"""
+"""3DFFE6BF48F1855F_D906C4F7B48EA291_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC=CC(=C2)OC(COC)C""",21,"""616BD44580E9C945"""
+"""9DDC6E60CC120C1E_8B473CC33F3B02BD_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""616BD44580E9C945"""
+"""AB4B958E5F4499DA_9EBEDAF7A446A3FF_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""616BD44580E9C945"""
+"""0B69E5D20C218490_E705B5DB537C9F82_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC(=CC=C2)CN3CCCC3""",21,"""616BD44580E9C945"""
+"""78DA5D370542EBF9_FE2191D93B107002_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""616BD44580E9C945"""
+"""AE86816169642CFD_83D5CE3BBC06C16B_6025_UN""","""C1(=N[N](C)C=C1C(=O)O)C2=CC=CC(=C2)OCCN(C)C""",21,"""616BD44580E9C945"""
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+"""727409A1913BD62D_80AA505C705CE22A_6004_UN""","""COC1=C(C(=NC=N1)N)C2=CC=CC(=C2)OCCN(C)C""",21,"""62144A224CB3EA04"""
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+"""605DA4CEACC6D708_AD1CF80B669670DD_6004_UN""","""COC1=C(C(=NC=N1)N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""62144A224CB3EA04"""
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+"""12A378F1015A0E28_6023316317DB3053_6004_UN""","""COC1=C(C(=NC=N1)N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""62144A224CB3EA04"""
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+"""F82BDB42CE2CBA18_4EE1B6FDB9EA556D_6004_UN""","""COC1=C(C(=NC=N1)N)C2=CC=C(C=C2)OC3CCCC3""",21,"""62144A224CB3EA04"""
+"""C0BDBF9731471EE8_CFD76F030E113DB9_6004_UN""","""COC1=C(C(=NC=N1)N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""62144A224CB3EA04"""
+"""E95E2950113BF430_BAA80D31743D990E_6004_UN""","""COC1=C(C(=NC=N1)N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""62144A224CB3EA04"""
+"""2984615299702F63_454FCABDA33C67E3_6004_UN""","""COC1=C(C(=NC=N1)N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""62144A224CB3EA04"""
+"""A74715BF4A8122A5_B2C8234888454AFD_6004_UN""","""COC1=C(C(=NC=N1)N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""62144A224CB3EA04"""
+"""CA3380069E1B427F_C4C30D5440294D96_6004_UN""","""COC1=C(C(=NC=N1)N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""62144A224CB3EA04"""
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+"""62A3AA55B11CE6B4_6B97A94826FB2F89_6004_UN""","""COC1=C(C(=NC=N1)N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""62144A224CB3EA04"""
+"""B4796120F81435F8_1AAC1B3D37F0A17A_6004_UN""","""COC1=C(C(=NC=N1)N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""62144A224CB3EA04"""
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+"""E02C02D628C9157B_8E553D99F167991B_6004_UN""","""COC1=C(C(=NC=N1)N)C2=C(C=CC=C2)CN3CCCC3""",21,"""62144A224CB3EA04"""
+"""0428B578F6765C0C_16816D184DD57AA1_6004_UN""","""COC1=C(C(=NC=N1)N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""62144A224CB3EA04"""
+"""4A653E1BB1C45BBD_1C86471B14A89E5C_6004_UN""","""COC1=C(C(=NC=N1)N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""62144A224CB3EA04"""
+"""D24F0FFBEAEC6B39_63EE464D0F78C957_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""621E1719FEE3308B"""
+"""5A0A4AED02ADC2D4_CC99BE61F46865AB_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""621E1719FEE3308B"""
+"""3BB1B6BBFCB046DB_3099C9A66B839281_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""621E1719FEE3308B"""
+"""0578EB2BB924EE09_6CA331F0F8AFA485_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""621E1719FEE3308B"""
+"""1CCBDF5DF9E03A15_5F8B5E317FC1522D_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""621E1719FEE3308B"""
+"""A2C894F4B38F3A06_946ABA45A7B6A6DE_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""621E1719FEE3308B"""
+"""E65ABBD3F996F709_4C059E49F372B756_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=CC(=C2)COCCOC""",21,"""621E1719FEE3308B"""
+"""DA76ADB3389F959E_C5681348FDCEBC3A_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""621E1719FEE3308B"""
+"""5A3402D429A5D516_DA7307ABCA845B5F_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""621E1719FEE3308B"""
+"""E63761A853CA0EDF_8832FF9F4131FB73_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""621E1719FEE3308B"""
+"""DEEB7A931749C4E7_9DCB19ABDA4C5A31_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""621E1719FEE3308B"""
+"""7850EFDF6EAFCA43_E47076872D76664C_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""621E1719FEE3308B"""
+"""CEBBDC1D8DF0B1AD_FD545285451A89CC_6004_UN""","""NC(=S)C1=CC(=CN=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""621E1719FEE3308B"""
+"""CC01047084E82F26_80A00D67C20C38A5_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""621E1719FEE3308B"""
+"""F130EE6AB505AD4E_777DC1A5536E9B9E_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""621E1719FEE3308B"""
+"""BB3B2C573535079A_405AF921A404982A_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""621E1719FEE3308B"""
+"""5F498B84F2F065EF_929607A58E0BB299_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""621E1719FEE3308B"""
+"""B48CC237F3CFA5FA_4243C92D7B51868A_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""621E1719FEE3308B"""
+"""6FE94CB968EAE448_6DD6FD626876E44F_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""621E1719FEE3308B"""
+"""7FE5F939E351DFCF_68ED03C7B4463666_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""621E1719FEE3308B"""
+"""8675BB6B1751CDA9_AD16A530D4C6AA52_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""621E1719FEE3308B"""
+"""4F203BC8128F40EA_BD3A35610B281EA6_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""621E1719FEE3308B"""
+"""DA44F23722C64E6E_60296C58A58BEADC_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""621E1719FEE3308B"""
+"""7EA5AB1D84A4DB10_F05A88223C766009_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""621E1719FEE3308B"""
+"""42A414ED76611C84_D57B3891DC79AED2_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""621E1719FEE3308B"""
+"""6EB1E291DAC6F2FB_B38688D0F5F01FB2_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""621E1719FEE3308B"""
+"""B9875EFED095798E_4EEBEBC60BBA8FE2_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""621E1719FEE3308B"""
+"""5729F9A8251BADD3_CFDD3238BC41E736_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""621E1719FEE3308B"""
+"""2DF17B3AC8641741_BAA2500AC66D4381_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""621E1719FEE3308B"""
+"""679B531ABFAC5E80_45459786116CBD6C_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""621E1719FEE3308B"""
+"""2CEC81355C1DAB89_B2C27E733A159072_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""621E1719FEE3308B"""
+"""BF97238D7D2CF9E6_C4C9506FF2799719_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""621E1719FEE3308B"""
+"""55CD1A61B1E24641_01F9C1556B9DFE66_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""621E1719FEE3308B"""
+"""6971D0C8AD224681_6B9DF47394ABF506_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""621E1719FEE3308B"""
+"""4C01ABB199D55E9F_1AA6460685A07BF5_6004_UN""","""NC(=S)C1=CC(=CN=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""621E1719FEE3308B"""
+"""1FAD5C37E4922876_A86DAA7347E972B7_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""621E1719FEE3308B"""
+"""7C98E9A52B39CBDC_DDA338FB7D45E285_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""621E1719FEE3308B"""
+"""B4DDC028A701A343_8E5F60A243374394_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""621E1719FEE3308B"""
+"""017060728671AABA_168B3023FF85A02E_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""621E1719FEE3308B"""
+"""F585419C085F3347_1C8C1A20A6F844D3_6004_UN""","""NC(=S)C1=CC(=CN=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""621E1719FEE3308B"""
+"""1976ADD23AE493A8_9CF3676BE1C25BE4_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](CCN)(=O)=O)C2CC2""",21,"""623B19843F3936FC"""
+"""74196CA01B264574_078AB7E14C61544A_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C(C)C)[S](=O)(=O)CCN""",21,"""623B19843F3936FC"""
+"""9DF50E98C6CFA5F5_50055B54A2217716_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](C)(=O)=O)CCN=C=S""",21,"""623B19843F3936FC"""
+"""3BDCED37427768E6_4D135AECEC890EDE_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](CC)(=O)=O)CCCN""",21,"""623B19843F3936FC"""
+"""9B896CD3C1D638E4_C7CCFF011A5D3BFF_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](C)(=O)=O)C2CC(C2)N""",21,"""623B19843F3936FC"""
+"""E83A770C9E8B1083_8116F7062A68B97E_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(CCCN)[S](=O)(=O)CCl""",21,"""623B19843F3936FC"""
+"""354F15DEC4D66AAF_74F77B40F8FA2C3F_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C)[S](=O)(=O)C2CNCC2""",21,"""623B19843F3936FC"""
+"""DE83F984DB854ADA_CAAF7057471589FB_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](CC)(=O)=O)CCCBr""",21,"""623B19843F3936FC"""
+"""650511328A4F4F63_7E75F157E21B0A75_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(CCCNC)[S](=O)(=O)C""",21,"""623B19843F3936FC"""
+"""E55D5A7BB03A5C65_9B18F9316BD2102D_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""623B19843F3936FC"""
+"""4AC6AFE5211C3149_C953932A37EDC3E5_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](=O)(=O)CC#N)C2CC2""",21,"""623B19843F3936FC"""
+"""B6D78EF556B4F430_4A87F85CDF4B81F2_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](C)(=O)=O)C(=O)CCN""",21,"""623B19843F3936FC"""
+"""F13B8228CE18FB12_8C81AFAC3B153501_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C)[S](=O)(=O)C2=CC=CS2""",21,"""623B19843F3936FC"""
+"""0056638C079E24E3_2E27F2352B5A2740_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""623B19843F3936FC"""
+"""F83CA31F496AD994_E340A97CF414071F_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""623B19843F3936FC"""
+"""80EBE1750D25ABC6_173D06CB3B1457B6_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""623B19843F3936FC"""
+"""F5CCDB532841499D_1DC9E1CBA76F6FB0_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(CC(CC)N)[S](=O)(=O)C""",21,"""623B19843F3936FC"""
+"""69F1E629E0A5564E_1FE7B4EAA564DF9B_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""623B19843F3936FC"""
+"""12700FDC77662EE3_8C25ABA67F9C047F_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](C)(=O)=O)CCN=[N]#N""",21,"""623B19843F3936FC"""
+"""171EF0F6CFBA2B7C_5C949C0079E1005B_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(CC(C)(C)N)[S](=O)(=O)C""",21,"""623B19843F3936FC"""
+"""825127322DC1951B_169BFBB1EE2F87D6_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""623B19843F3936FC"""
+"""611564EE20E1E60A_FAA665D3E40523D9_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""623B19843F3936FC"""
+"""C3E7DD0EB1E341E9_F34BD1B74F500E63_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](=O)(=O)C2CC2)CC#C""",21,"""623B19843F3936FC"""
+"""FEF11E94AEB6663D_A74BCB3CA85ECBA5_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN2[S](=O)(=O)C3(CCC2)CC3""",21,"""623B19843F3936FC"""
+"""96CC47986925B2A4_8F2084C18D5A874D_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN2CCCC(C)(C)[S]2(=O)=O""",21,"""623B19843F3936FC"""
+"""C39697E7B71B6B1E_44097F95049C4C5E_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN2CCCC(CC)[S]2(=O)=O""",21,"""623B19843F3936FC"""
+"""B8CB33FC5B3F2981_75600F4F6125FAF1_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN2C(C(N)CC[S]2(=O)=O)=O""",21,"""623B19843F3936FC"""
+"""5CFAA1C9352C32A7_AA7E68E11B2DC3DF_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""623B19843F3936FC"""
+"""6E6E3332FBFD33D3_0146A678CFBD5EF3_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""623B19843F3936FC"""
+"""D0AC227738307E4C_412A1628CA87874D_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""623B19843F3936FC"""
+"""60C6C908F3036DB3_E9658CFC319A9825_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN2[S](CCN(C)CC2)(=O)=O""",21,"""623B19843F3936FC"""
+"""F56E3BAA7FF29B32_65F2AA71593373C6_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN2CC(=O)NCC[S]2(=O)=O""",21,"""623B19843F3936FC"""
+"""DB4856A6CF31FDAA_3009B778F496B452_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN2[S](CCCCC2C)(=O)=O""",21,"""623B19843F3936FC"""
+"""CC31EBD48E074F5F_4AA1F2B45A765BAC_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(CCN)[S](=O)(=O)C2CC2""",21,"""623B19843F3936FC"""
+"""1E47FE5B7807D9EC_2C5BD475FE5AC95B_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(CCN)[S](=O)(=O)C(F)F""",21,"""623B19843F3936FC"""
+"""785773436B7C787E_8C5E4810C05137B9_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN([S](CC)(=O)=O)C2CNC2""",21,"""623B19843F3936FC"""
+"""F74FC9B4CFD7EB2F_BEC79C2C57B863C4_6036_DP""","""CC1=C(C=CC=C1)CC(N)CN3CC2(CNC2)C[S]3(=O)=O""",21,"""623B19843F3936FC"""
+"""11D51A86C478BB46_04B2E5BE8E7B27AE_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""623B19843F3936FC"""
+"""E06C851496546F39_F8597DEE8719371E_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""623B19843F3936FC"""
+"""75C5E961E6483F71_C6381A594A27FF85_6036_UN""","""CC1=C(C=CC=C1)CC(N)CN(C(C)(C)CN)[S](=O)(=O)C""",21,"""623B19843F3936FC"""
+"""A0D15E11CF9149FE_6346F4440F4E320B_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""62B6A510FED5CBD7"""
+"""EAC4B4A8935AEC20_CC310C68F45E9EF7_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""62B6A510FED5CBD7"""
+"""9205CBD31B9B90DA_30317BAF6BB569DD_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""62B6A510FED5CBD7"""
+"""EC91908C8739AED4_6C0B83F9F8995FD9_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""62B6A510FED5CBD7"""
+"""B66AB3DC218B1466_5F23EC387FF7A971_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""62B6A510FED5CBD7"""
+"""2F154411A6B42712_94C2084CA7805D82_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""62B6A510FED5CBD7"""
+"""90DEE39CC44412FE_4CAD2C40F3444C0A_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=CC(=C2)COCCOC)N""",21,"""62B6A510FED5CBD7"""
+"""6206402E0A52F261_C5C0A141FDF84766_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""62B6A510FED5CBD7"""
+"""9C4741A203195299_DADBB5A2CAB2A003_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=CC(=C2)OC(COC)C)N""",21,"""62B6A510FED5CBD7"""
+"""4A47330FAC90A6FC_889A4D964107002F_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""62B6A510FED5CBD7"""
+"""A2A040ADAB5A9B2F_9D63ABA2DA7AA16D_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""62B6A510FED5CBD7"""
+"""5D10AC82D9EB9DE2_E4D8C48E2D409D10_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""62B6A510FED5CBD7"""
+"""EFACBCA43E5F96F8_FDFCE08C452C7290_6005_UN""","""CCC1=C(C=CC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""62B6A510FED5CBD7"""
+"""517F93A534EE5B69_8008BF6EC23AC3F9_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""62B6A510FED5CBD7"""
+"""45F8E6EC81F5F8DB_77D573AC535860C2_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""62B6A510FED5CBD7"""
+"""04F01A954B85D094_40F24B28A4326376_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""62B6A510FED5CBD7"""
+"""6CB97EA922BC37F8_923EB5AC8E3D49C5_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""62B6A510FED5CBD7"""
+"""8272137FE3F43EE5_42EB7B247B677DD6_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""62B6A510FED5CBD7"""
+"""F73A50ADA2D8DA06_6D7E4F6B68401F13_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""62B6A510FED5CBD7"""
+"""DF3DF2242E1571CE_6845B1CEB470CD3A_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""62B6A510FED5CBD7"""
+"""1DA4B879A2043738_ADBE1739D4F0510E_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""62B6A510FED5CBD7"""
+"""29E0BFECB4B7DB07_BD9287680B1EE5FA_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""62B6A510FED5CBD7"""
+"""42443C5E86B52624_6081DE51A5BD1180_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""62B6A510FED5CBD7"""
+"""40A5A9D6F10FB12A_F0F23A2B3C409B55_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""62B6A510FED5CBD7"""
+"""2B39D5462B039722_D5D38A98DC4F558E_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""62B6A510FED5CBD7"""
+"""D03A4F54F503912D_B32E3AD9F5C6E4EE_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=C(OCCC(C)C)C=C2)N""",21,"""62B6A510FED5CBD7"""
+"""F6D40C9F1647B36B_4E4359CF0B8C74BE_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=C(C=C2)OC3CCCC3)N""",21,"""62B6A510FED5CBD7"""
+"""3A6CFE0E437087C8_CF758031BC771C6A_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(C=C(OC)C=C2)CN(C)C)N""",21,"""62B6A510FED5CBD7"""
+"""853143A735293F50_BA0AE203C65BB8DD_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)N""",21,"""62B6A510FED5CBD7"""
+"""24E0EAD266129ED6_45ED258F115A4630_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(C)C=C(C=C2)OCC3CC3)N""",21,"""62B6A510FED5CBD7"""
+"""AE5AACA541B8B6D3_B26ACC7A3A236B2E_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)N""",21,"""62B6A510FED5CBD7"""
+"""8DD890AA06C99B8B_C461E266F24F6C45_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(OCC(C)(C)C)N=CC=C2)N""",21,"""62B6A510FED5CBD7"""
+"""D263724A0C170F97_0151735C6BAB053A_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)N""",21,"""62B6A510FED5CBD7"""
+"""EE5E6BE8BC4D3030_6B35467A949D0E5A_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)N""",21,"""62B6A510FED5CBD7"""
+"""7A9D40EF0B90CAE8_1A0EF40F859680A9_6005_UN""","""CCC1=C(C=CC(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)N""",21,"""62B6A510FED5CBD7"""
+"""B96DEA968D56B6CA_A8C5187A47DF89EB_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)N""",21,"""62B6A510FED5CBD7"""
+"""FF879843D51EED69_DD0B8AF27D7319D9_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=CC=C2)C3=CC=NC=C3)N""",21,"""62B6A510FED5CBD7"""
+"""37663952878655AA_8EF7D2AB4301B8C8_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(C=CC=C2)CN3CCCC3)N""",21,"""62B6A510FED5CBD7"""
+"""2EC1138E73D07FDC_1623822AFFB35B72_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=N[N]2C3CCCCO3)C)N""",21,"""62B6A510FED5CBD7"""
+"""0D390D7F6BA521B6_1C24A829A6CEBF8F_6005_UN""","""CCC1=C(C=CC(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)N""",21,"""62B6A510FED5CBD7"""
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+"""45C39155D7C10736_0470D64BFB58C32A_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N2CCCC(Cl)(Cl)[S]2(=O)=O)Br""",21,"""670D69B70BDCAB25"""
+"""296E2ABFCE43B183_441C661BFE621A94_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N([S](C)(=O)=O)[C@H]2CNCC2)Br""",21,"""670D69B70BDCAB25"""
+"""C46F7F59A6E600EA_EC53FCCF057F05FC_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N2[S](CCN(C)CC2)(=O)=O)Br""",21,"""670D69B70BDCAB25"""
+"""59C6A00932B5FDDA_60C4DA426DD6EE1F_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N2CC(=O)NCC[S]2(=O)=O)Br""",21,"""670D69B70BDCAB25"""
+"""3F2A15FA124703E0_353FC74BC073298B_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N2[S](CCCCC2C)(=O)=O)Br""",21,"""670D69B70BDCAB25"""
+"""2DBE88DA093D9D8D_4F9782876E93C675_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N(CCN)[S](=O)(=O)C2CC2)Br""",21,"""670D69B70BDCAB25"""
+"""A02915192DE97684_296DA446CABF5482_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N(CCN)[S](=O)(=O)C(F)F)Br""",21,"""670D69B70BDCAB25"""
+"""D455117F5B75D46C_89683823F4B4AA60_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N([S](CC)(=O)=O)C2CNC2)Br""",21,"""670D69B70BDCAB25"""
+"""2669DB6D631195F5_BBF1EC1F635DFE1D_6036_DP""","""COC1=C(C=C(C=C1)[C@@H](C)N3CC2(CNC2)C[S]3(=O)=O)Br""",21,"""670D69B70BDCAB25"""
+"""76CD84EF09A71BDD_0184958DBA9EBA77_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N(C)[S](=O)(=O)C2=N[NH]C=N2)Br""",21,"""670D69B70BDCAB25"""
+"""E60C1A9033B396BE_FD6F0DDDB3FCAAC7_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N(C)[S](=O)(=O)C2=C[NH]N=C2)Br""",21,"""670D69B70BDCAB25"""
+"""126EC076561A1F43_C30E6A6A7EC2625C_6036_UN""","""COC1=C(C=C(C=C1)[C@@H](C)N(C(C)(C)CN)[S](=O)(=O)C)Br""",21,"""670D69B70BDCAB25"""
+"""6EE858C74759F837_66E9DD9BC6362AF4_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=CC=C2)OC3CCCC3)F)F""",21,"""67198CCF37ADD328"""
+"""AAFBCF2ED193E269_C99E25B73D268608_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=C(OCC)C=C2)OCC)F)F""",21,"""67198CCF37ADD328"""
+"""B6190F86D2521F31_359E5270A2CD7122_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=CC(=C2)OCCC(C)C)F)F""",21,"""67198CCF37ADD328"""
+"""F1E96722FA767D97_69A4AA2631E14726_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)F)F""",21,"""67198CCF37ADD328"""
+"""C71A4750518E83CE_5A8CC5E7B68FB18E_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=C(C=C2)OC3CCOC3)F)F""",21,"""67198CCF37ADD328"""
+"""452BDE2B0AB0CADC_916D21936EF8457D_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=C(OC)C=C2)CN(C)C)F)F""",21,"""67198CCF37ADD328"""
+"""5D587360F9FE21B4_4902059F3A3C54F5_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=CC(=C2)COCCOC)F)F""",21,"""67198CCF37ADD328"""
+"""6499EBB9C6296E2A_C06F889E34805F99_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=CC(=C2)CN(C)C3CC3)F)F""",21,"""67198CCF37ADD328"""
+"""C999117CBBF74944_DF749C7D03CAB8FC_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=CC(=C2)OC(COC)C)F)F""",21,"""67198CCF37ADD328"""
+"""1888EAC33D0EF551_8D356449887F18D0_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)F)F""",21,"""67198CCF37ADD328"""
+"""C6B35BC515291459_98CC827D1302B992_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)F)F""",21,"""67198CCF37ADD328"""
+"""0D48772E4BF0F7D3_E177ED51E43885EF_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=CC=C2)CN3CCCC3)F)F""",21,"""67198CCF37ADD328"""
+"""3FE0A66BB431A849_F853C9538C546A6F_6005_UN""","""FC1=C(C(=CC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)F)F""",21,"""67198CCF37ADD328"""
+"""159710A2282452AA_85A796B10B42DB06_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=CC(=C2)OCCN(C)C)F)F""",21,"""67198CCF37ADD328"""
+"""0DD58E14F9A335C2_727A5A739A20783D_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)F)F""",21,"""67198CCF37ADD328"""
+"""6595794A8B929DA9_455D62F76D4A7B89_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=C(C=C2)C3=CC=CC=C3)F)F""",21,"""67198CCF37ADD328"""
+"""DF1DD705CACE976C_97919C734745513A_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(C=CC=C2F)OC(F)(F)F)F)F""",21,"""67198CCF37ADD328"""
+"""7E935537AC0AB95A_474452FBB21F6529_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)F)F""",21,"""67198CCF37ADD328"""
+"""B5EDC20436BD6E27_68D166B4A13807EC_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)F)F""",21,"""67198CCF37ADD328"""
+"""7820944F830261EB_6DEA98117D08D5C5_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=CC(=C2F)C(N(C)C)=O)F)F""",21,"""67198CCF37ADD328"""
+"""D1A76F73DBCAD7C8_A8113EE61D8849F1_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)F)F""",21,"""67198CCF37ADD328"""
+"""68B7E7D77B6F21DC_B83DAEB7C266FD05_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)F)F""",21,"""67198CCF37ADD328"""
+"""8DA9A35168A2F88A_652EF78E6CC5097F_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=CC=C2)C3=CC=CC=C3)F)F""",21,"""67198CCF37ADD328"""
+"""2E54CA625475371B_F55D13F4F53883AA_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)F)F""",21,"""67198CCF37ADD328"""
+"""3A40A5D39F5A7156_D07CA34715374D71_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)F)F""",21,"""67198CCF37ADD328"""
+"""B24A2126DAE0ECB7_B68113063CBEFC11_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=C(OCCC(C)C)C=C2)F)F""",21,"""67198CCF37ADD328"""
+"""4DFD015048D7BB60_4BEC7010C2F46C41_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=C(C=C2)OC3CCCC3)F)F""",21,"""67198CCF37ADD328"""
+"""A8E7DDDBF76B7C0D_CADAA9EE750F0495_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(C=C(OC)C=C2)CN(C)C)F)F""",21,"""67198CCF37ADD328"""
+"""18F90A63D47B1230_BFA5CBDC0F23A022_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)F)F""",21,"""67198CCF37ADD328"""
+"""C7EA11B61CC91517_40420C50D8225ECF_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(C)C=C(C=C2)OCC3CC3)F)F""",21,"""67198CCF37ADD328"""
+"""4C30B7CE890D98CF_B7C5E5A5F35B73D1_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)F)F""",21,"""67198CCF37ADD328"""
+"""39D88F99F873B128_C1CECBB93B3774BA_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(OCC(C)(C)C)N=CC=C2)F)F""",21,"""67198CCF37ADD328"""
+"""B4C39E646541AB38_04FE5A83A2D31DC5_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)F)F""",21,"""67198CCF37ADD328"""
+"""B2B033601B295F95_6E9A6FA55DE516A5_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)F)F""",21,"""67198CCF37ADD328"""
+"""61BA7958253C2D83_1FA1DDD04CEE9856_6005_UN""","""FC1=C(C(=CC(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)F)F""",21,"""67198CCF37ADD328"""
+"""7F0799DB35BC136D_AD6A31A58EA79114_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)F)F""",21,"""67198CCF37ADD328"""
+"""1E0A7C9A9BC299BA_D8A4A32DB40B0126_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=CC=C2)C3=CC=NC=C3)F)F""",21,"""67198CCF37ADD328"""
+"""1EB74377986E00C1_8B58FB748A79A037_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(C=CC=C2)CN3CCCC3)F)F""",21,"""67198CCF37ADD328"""
+"""66EBF0F0DB4D2204_138CABF536CB438D_6005_UN""","""FC1=C(C(=CC(=C1)C2=CC(=N[N]2C3CCCCO3)C)F)F""",21,"""67198CCF37ADD328"""
+"""EABA75D5FA32DF11_198B81F66FB6A770_6005_UN""","""FC1=C(C(=CC(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)F)F""",21,"""67198CCF37ADD328"""
+"""8637440B13C4E17D_99145833F998B3C4_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](CCN)(=O)=O)C2CC2""",21,"""67DC26DC2763DEDC"""
+"""773EA19274D033ED_026D88B9543BBC6A_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C(C)C)[S](=O)(=O)CCN""",21,"""67DC26DC2763DEDC"""
+"""CB2689E52397483F_55E2640CBA7B9F36_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](C)(=O)=O)CCN=C=S""",21,"""67DC26DC2763DEDC"""
+"""BFED2EEE30B01666_48F465B4F4D3E6FE_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](CC)(=O)=O)CCCN""",21,"""67DC26DC2763DEDC"""
+"""3C73CE2322F7C0E4_C22BC0590207D3DF_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](C)(=O)=O)C2CC(C2)N""",21,"""67DC26DC2763DEDC"""
+"""F837CAF7378D02B6_84F1C85E3232515E_6036_UN""","""NC1=CC=C(C=C1)OCCCN(CCCN)[S](=O)(=O)CCl""",21,"""67DC26DC2763DEDC"""
+"""BD151644C4B84700_71104418E0A0C41F_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C)[S](=O)(=O)C2CNCC2""",21,"""67DC26DC2763DEDC"""
+"""048575AA8B454D2F_CF484F0F5F4F61DB_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](CC)(=O)=O)CCCBr""",21,"""67DC26DC2763DEDC"""
+"""02A04D1726DE5E27_7B92CE0FFA41E255_6036_UN""","""NC1=CC=C(C=C1)OCCCN(CCCNC)[S](=O)(=O)C""",21,"""67DC26DC2763DEDC"""
+"""6003B79014F2BB6A_9EFFC6697388F80D_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""67DC26DC2763DEDC"""
+"""63A9CFE3118E462B_CCB4AC722FB72BC5_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](=O)(=O)CC#N)C2CC2""",21,"""67DC26DC2763DEDC"""
+"""020E27480CEF3489_4F60C704C71169D2_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](C)(=O)=O)C(=O)CCN""",21,"""67DC26DC2763DEDC"""
+"""3D1020EF90BC16EF_896690F4234FDD21_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C)[S](=O)(=O)C2=CC=CS2""",21,"""67DC26DC2763DEDC"""
+"""D57D810F2B061859_2BC0CD6D3300CF60_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""67DC26DC2763DEDC"""
+"""EC139753A0787789_E6A79624EC4EEF3F_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""67DC26DC2763DEDC"""
+"""B81EB6D054F9AD24_12DA3993234EBF96_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""67DC26DC2763DEDC"""
+"""578FB2F6C86372F8_182EDE93BF358790_6036_UN""","""NC1=CC=C(C=C1)OCCCN(CC(CC)N)[S](=O)(=O)C""",21,"""67DC26DC2763DEDC"""
+"""302BB021117B7C40_1A008BB2BD3E37BB_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""67DC26DC2763DEDC"""
+"""D7E7763E4A273055_89C294FE67C6EC5F_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](C)(=O)=O)CCN=[N]#N""",21,"""67DC26DC2763DEDC"""
+"""0C1E7F1D5C218431_5973A35861BBE87B_6036_UN""","""NC1=CC=C(C=C1)OCCCN(CC(C)(C)N)[S](=O)(=O)C""",21,"""67DC26DC2763DEDC"""
+"""92493F5F1D9F265B_137CC4E9F6756FF6_6036_UN""","""NC1=CC=C(C=C1)OCCCN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""67DC26DC2763DEDC"""
+"""0798FF35ED280070_FF415A8BFC5FCBF9_6036_UN""","""NC1=CC=C(C=C1)OCCCN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""67DC26DC2763DEDC"""
+"""FF7332D4390DC0A8_F6ACEEEF570AE643_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](=O)(=O)C2CC2)CC#C""",21,"""67DC26DC2763DEDC"""
+"""79551BCE3EBC1550_A2ACF464B0042385_6036_UN""","""NC1=CC=C(C=C1)OCCCN2[S](=O)(=O)C3(CCC2)CC3""",21,"""67DC26DC2763DEDC"""
+"""5F7DD388366A9B89_8AC7BB9995006F6D_6036_UN""","""NC1=CC=C(C=C1)OCCCN2CCCC(C)(C)[S]2(=O)=O""",21,"""67DC26DC2763DEDC"""
+"""DE65FA0CF0852646_41EE40CD1CC6A47E_6036_UN""","""NC1=CC=C(C=C1)OCCCN2CCCC(CC)[S]2(=O)=O""",21,"""67DC26DC2763DEDC"""
+"""503045D82974D14A_70873017797F12D1_6036_UN""","""NC1=CC=C(C=C1)OCCCN2C(C(N)CC[S]2(=O)=O)=O""",21,"""67DC26DC2763DEDC"""
+"""69F8DE792D0E3C13_AF9957B903772BFF_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""67DC26DC2763DEDC"""
+"""8353485480D5374D_04A19920D7E7B6D3_6036_UN""","""NC1=CC=C(C=C1)OCCCN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""67DC26DC2763DEDC"""
+"""3803530B07BB519F_44CD2970D2DD6F6D_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""67DC26DC2763DEDC"""
+"""3367ECBB3EF55D7F_EC82B3A429C07005_6036_UN""","""NC1=CC=C(C=C1)OCCCN2[S](CCN(C)CC2)(=O)=O""",21,"""67DC26DC2763DEDC"""
+"""51AD04B208A038B9_6015952941699BE6_6036_UN""","""NC1=CC=C(C=C1)OCCCN2CC(=O)NCC[S]2(=O)=O""",21,"""67DC26DC2763DEDC"""
+"""652410BDBD429C39_35EE8820ECCC5C72_6036_UN""","""NC1=CC=C(C=C1)OCCCN2[S](CCCCC2C)(=O)=O""",21,"""67DC26DC2763DEDC"""
+"""467EA4920F1A32A8_4F46CDEC422CB38C_6036_UN""","""NC1=CC=C(C=C1)OCCCN(CCN)[S](=O)(=O)C2CC2""",21,"""67DC26DC2763DEDC"""
+"""F48BF306F37720BF_29BCEB2DE600217B_6036_UN""","""NC1=CC=C(C=C1)OCCCN(CCN)[S](=O)(=O)C(F)F""",21,"""67DC26DC2763DEDC"""
+"""A75AE5A65A03710C_89B97748D80BDF99_6036_UN""","""NC1=CC=C(C=C1)OCCCN([S](CC)(=O)=O)C2CNC2""",21,"""67DC26DC2763DEDC"""
+"""4A46F0B56CB3B8D6_BB20A3744FE28BE4_6036_DP""","""NC1=CC=C(C=C1)OCCCN3CC2(CNC2)C[S]3(=O)=O""",21,"""67DC26DC2763DEDC"""
+"""C1353FBCDA964318_0155DAE69621CF8E_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""67DC26DC2763DEDC"""
+"""DE91A0EB2FB00FC0_FDBE42B69F43DF3E_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""67DC26DC2763DEDC"""
+"""287F2AACDD2D3181_C3DF2501527D17A5_6036_UN""","""NC1=CC=C(C=C1)OCCCN(C(C)(C)CN)[S](=O)(=O)C""",21,"""67DC26DC2763DEDC"""
+"""E34EB7890905AFA1_96C3C21E8DD34456_6036_UN""","""CCC1=CC=C(C=C1)C(N)CN([S](CCN)(=O)=O)C2CC2""",21,"""680BBCF15328294E"""
+"""B7C5FB5C2AFB0A1B_0DBA129420704BF8_6036_UN""","""CCC1=CC=C(C=C1)C(N)CN(C(C)C)[S](=O)(=O)CCN""",21,"""680BBCF15328294E"""
+"""519C3C14C5300ED2_5A35FE21CE3068A4_6036_UN""","""CCC1=CC=C(C=C1)C(N)CN([S](C)(=O)=O)CCN=C=S""",21,"""680BBCF15328294E"""
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+"""26F5104EA0E90CDE_86F5F9FDE9FA7734_6036_UN""","""CNCC(C1=CC=C(C=C1)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""68EB4BDFA95F45B7"""
+"""4D956BDBCE404298_5644CE5BEF877310_6036_UN""","""CNCC(C1=CC=C(C=C1)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""68EB4BDFA95F45B7"""
+"""762ADD23FE62853F_1C4BA9EA7849F49D_6036_UN""","""CNCC(C1=CC=C(C=C1)F)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""68EB4BDFA95F45B7"""
+"""34D964141B6FF7D6_F076378872635092_6036_UN""","""CNCC(C1=CC=C(C=C1)F)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""68EB4BDFA95F45B7"""
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+"""050D5CB579D06002_1CC6D03FA552C544_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""69C0CF70A17FA40E"""
+"""B902BB443EAA6E27_1632373F3929FD42_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N(CC(CC)N)[S](=O)(=O)C""",21,"""69C0CF70A17FA40E"""
+"""1318E5FA0D1C13FE_141C621E3B224D69_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""69C0CF70A17FA40E"""
+"""6B6E76E953F9A592_87DE7D52E1DA968D_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""69C0CF70A17FA40E"""
+"""BEE5C4B62BFCCD94_576F4AF4E7A792A9_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""69C0CF70A17FA40E"""
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+"""CE7D04E463E3833E_F15DB3277A43B12B_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""69C0CF70A17FA40E"""
+"""78572EFC44589034_F8B00743D1169C91_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N([S](=O)(=O)C3CC3)CC#C""",21,"""69C0CF70A17FA40E"""
+"""83BD83D02FC3AAFB_ACB01DC836185957_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""69C0CF70A17FA40E"""
+"""6FFF5379602D14A6_84DB5235131C15BF_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""69C0CF70A17FA40E"""
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+"""44D5BF54E5BAD52D_A185BE15856B512D_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""69C0CF70A17FA40E"""
+"""7ACC9B16EBD556AA_0ABD708C51FBCC01_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""69C0CF70A17FA40E"""
+"""BA4DB9049091E278_4AD1C0DC54C115BF_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""69C0CF70A17FA40E"""
+"""B47E2EF97C1DC7EC_E29E5A08AFDC0AD7_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N3[S](CCN(C)CC3)(=O)=O""",21,"""69C0CF70A17FA40E"""
+"""58A9E71FEBEBE88E_6E097C85C775E134_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N3CC(=O)NCC[S]3(=O)=O""",21,"""69C0CF70A17FA40E"""
+"""6916A99067241479_3BF2618C6AD026A0_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N3[S](CCCCC3C)(=O)=O""",21,"""69C0CF70A17FA40E"""
+"""693D8DDBB1A963BC_415A2440C430C95E_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N(CCN)[S](=O)(=O)C3CC3""",21,"""69C0CF70A17FA40E"""
+"""926027B3ACC79E42_27A00281601C5BA9_6036_UN""","""NC1C(C2=C(OC1)C=CC=C2)N(CCN)[S](=O)(=O)C(F)F""",21,"""69C0CF70A17FA40E"""
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+"""729DCAAAC8786257_6340792E3F5336A0_6004_UN""","""N[S](=O)(=O)C1=C(C=NS1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""6AC39A44551BF32D"""
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+"""39809183AE163BEC_A0B0272EEC11B111_6004_UN""","""N[S](=O)(=O)C1=C(C=NS1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""6AC39A44551BF32D"""
+"""8F9546D3716F052D_D57EB5A6D6BD2123_6004_UN""","""N[S](=O)(=O)C1=C(C=NS1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""6AC39A44551BF32D"""
+"""B053AA2887600B36_8682EDFFE8CF8032_6004_UN""","""N[S](=O)(=O)C1=C(C=NS1)C2=C(C=CC=C2)CN3CCCC3""",21,"""6AC39A44551BF32D"""
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+"""15C5C24B4F4C4A1B_1451977D0D008775_6004_UN""","""N[S](=O)(=O)C1=C(C=NS1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""6AC39A44551BF32D"""
+"""8F4E72A97472EE4C_9432DE4819394CA7_6036_UN""","""NC2(CN([S](CCN)(=O)=O)C1CC1)CCC3=C2C=CC=C3""",21,"""6AFAA0A7C7C221BF"""
+"""D04C3372ED6CFA0B_0F4B0EC2B49A4309_6036_UN""","""NC1(CN(C(C)C)[S](=O)(=O)CCN)CCC2=C1C=CC=C2""",21,"""6AFAA0A7C7C221BF"""
+"""058E0DBFA9170C87_58C4E2775ADA6055_6036_UN""","""NC1(CN([S](C)(=O)=O)CCN=C=S)CCC2=C1C=CC=C2""",21,"""6AFAA0A7C7C221BF"""
+"""A4D178E4BB9B6D35_45D2E3CF1472199D_6036_UN""","""NC1(CN([S](CC)(=O)=O)CCCN)CCC2=C1C=CC=C2""",21,"""6AFAA0A7C7C221BF"""
+"""F52C8EBEFC05E28C_CF0D4622E2A62CBC_6036_UN""","""NC2(CN([S](C)(=O)=O)C1CC(C1)N)CCC3=C2C=CC=C3""",21,"""6AFAA0A7C7C221BF"""
+"""09ECB977002446F8_89D74E25D293AE3D_6036_UN""","""NC1(CN(CCCN)[S](=O)(=O)CCl)CCC2=C1C=CC=C2""",21,"""6AFAA0A7C7C221BF"""
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+"""ECBD57E495AE50CC_6FA09D5849BB9CB8_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""6D97E61912D346EF"""
+"""E868DFBC77AA829A_FFD37922D046166D_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""6D97E61912D346EF"""
+"""976A07934B5202B1_DAF2C9913049D8B6_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""6D97E61912D346EF"""
+"""4D8DE7C64EBE2779_BC0F79D019C069D6_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""6D97E61912D346EF"""
+"""DE78690DCFE003A0_41621AC6E78AF986_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""6D97E61912D346EF"""
+"""52EB8996D7A48A25_C054C33850719152_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""6D97E61912D346EF"""
+"""27E6A8FC91A890A9_B52BA10A2A5D35E5_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""6D97E61912D346EF"""
+"""9CC8297900200256_4ACC6686FD5CCB08_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""6D97E61912D346EF"""
+"""3D944F5E65DF400E_BD4B8F73D625E616_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""6D97E61912D346EF"""
+"""A88B0E0D3FED0E0B_CB40A16F1E49E17D_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""6D97E61912D346EF"""
+"""D54C683DEF745545_0E70305587AD8802_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""6D97E61912D346EF"""
+"""F23DF5CDFB132AB1_64140573789B8362_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""6D97E61912D346EF"""
+"""4A0AFF16E0C5551D_152FB70669900D91_6005_UN""","""OC(=O)C1=CC(=CN=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""6D97E61912D346EF"""
+"""4D712B1444079FCD_A7E45B73ABD904D3_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""6D97E61912D346EF"""
+"""7D9610B3E3FA8431_D22AC9FB917594E1_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""6D97E61912D346EF"""
+"""7C513E486B4EB794_81D691A2AF0735F0_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""6D97E61912D346EF"""
+"""F0D201003B043917_1902C12313B5D64A_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""6D97E61912D346EF"""
+"""403769578EC2BF7B_1305EB204AC832B7_6005_UN""","""OC(=O)C1=CC(=CN=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""6D97E61912D346EF"""
+"""81188E920CE1EA8C_6FDB76D6EB936EB9_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=CC=C2)OC3CCCC3""",21,"""6E2B27821A089765"""
+"""A276361F5A386B2E_C0AC8EFA1083C245_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=C(OCC)C=C2)OCC""",21,"""6E2B27821A089765"""
+"""B9392303D4F63766_3CACF93D8F68356F_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=CC(=C2)OCCC(C)C""",21,"""6E2B27821A089765"""
+"""2A1054777BA224C5_6096016B1C44036B_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""6E2B27821A089765"""
+"""A41441D565E0F0DA_53BE6EAA9B2AF5C3_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=C(C=C2)OC3CCOC3""",21,"""6E2B27821A089765"""
+"""8357C9AA663EEFF2_985F8ADE435D0130_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""6E2B27821A089765"""
+"""BB833E53E8816960_4030AED2179910B8_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=CC(=C2)COCCOC""",21,"""6E2B27821A089765"""
+"""F6F1F6483404B1F9_C95D23D319251BD4_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""6E2B27821A089765"""
+"""61209AE6990B1588_D64637302E6FFCB1_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=CC(=C2)OC(COC)C""",21,"""6E2B27821A089765"""
+"""D950D8E1B4935777_8407CF04A5DA5C9D_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""6E2B27821A089765"""
+"""C3669B13104CBC85_91FE29303EA7FDDF_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""6E2B27821A089765"""
+"""ABFDEBEC895BAA97_E845461CC99DC1A2_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=CC=C2)CN3CCCC3""",21,"""6E2B27821A089765"""
+"""0FECA318F0E4796F_F161621EA1F12E22_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""6E2B27821A089765"""
+"""CE3CA89EAA95972F_8C953DFC26E79F4B_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=CC(=C2)OCCN(C)C""",21,"""6E2B27821A089765"""
+"""6A2D4038CDD66705_7B48F13EB7853C70_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""6E2B27821A089765"""
+"""DDD801D78265A24F_4C6FC9BA40EF3FC4_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""6E2B27821A089765"""
+"""C550D8D58C52FFC7_9EA3373E6AE01577_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""6E2B27821A089765"""
+"""C716CB5D9A358C33_4E76F9B69FBA2164_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""6E2B27821A089765"""
+"""9E8A7A3AC398E60C_61E3CDF98C9D43A1_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""6E2B27821A089765"""
+"""7F14F811C639B20A_64D8335C50AD9188_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""6E2B27821A089765"""
+"""3DB77AC056FA82EE_A12395AB302D0DBC_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""6E2B27821A089765"""
+"""C3D8F22A6B4BADC9_B10F05FAEFC3B948_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""6E2B27821A089765"""
+"""8F636D58C5B1C546_6C1C5CC341604D32_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""6E2B27821A089765"""
+"""0690305E4BB1BA9B_FC6FB8B9D89DC7E7_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""6E2B27821A089765"""
+"""C6684ADC5A5DC1E0_D94E080A3892093C_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""6E2B27821A089765"""
+"""01B7ED459C87FF18_BFB3B84B111BB85C_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=C(OCCC(C)C)C=C2""",21,"""6E2B27821A089765"""
+"""2C4AC01BD502E49E_42DEDB5DEF51280C_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=C(C=C2)OC3CCCC3""",21,"""6E2B27821A089765"""
+"""84896EEA4CBC981B_C3E802A358AA40D8_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""6E2B27821A089765"""
+"""5FD8B1BEBFFFCC25_B69760912286E46F_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""6E2B27821A089765"""
+"""0FAF300F684A8F65_4970A71DF5871A82_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""6E2B27821A089765"""
+"""53680404E83140FC_BEF74EE8DEFE379C_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""6E2B27821A089765"""
+"""FC14EFE8B7C293FF_C8FC60F4169230F7_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""6E2B27821A089765"""
+"""D50A160FC23C2584_0DCCF1CE8F765988_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""6E2B27821A089765"""
+"""837F10A26597817F_67A8C4E8704052E8_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""6E2B27821A089765"""
+"""3BB8A3407F0F56DC_1693769D614BDC1B_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""6E2B27821A089765"""
+"""9E14EDB699FA980C_A4589AE8A302D559_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""6E2B27821A089765"""
+"""03970C81124F21A8_D196086099AE456B_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""6E2B27821A089765"""
+"""BD43F68DF0D421FC_826A5039A7DCE47A_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(C=CC=C2)CN3CCCC3""",21,"""6E2B27821A089765"""
+"""91D2A0964CEBA42C_1ABE00B81B6E07C0_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""6E2B27821A089765"""
+"""31F0AD928A32A164_10B92ABB4213E33D_6005_UN""","""CC(C)(C)C1=NC(=C[NH]1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""6E2B27821A089765"""
+"""EA7BD72B67CDD9D4_6FADDD0377E24FD8_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=CC=C2)OC3CCCC3)Cl""",21,"""6E5D8C578679B604"""
+"""56FD153715CF4364_C0DA252F8CF2E324_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=C(OCC)C=C2)OCC)Cl""",21,"""6E5D8C578679B604"""
+"""64E598ED25BA116E_3CDA52E81319140E_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=CC(=C2)OCCC(C)C)Cl""",21,"""6E5D8C578679B604"""
+"""E9FE2E56A64DE792_60E0AABE8035220A_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)Cl""",21,"""6E5D8C578679B604"""
+"""C29CC3780B399ADB_53C8C57F075BD4A2_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=C(C=C2)OC3CCOC3)Cl""",21,"""6E5D8C578679B604"""
+"""0289822EC538D421_9829210BDF2C2051_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=C(OC)C=C2)CN(C)C)Cl""",21,"""6E5D8C578679B604"""
+"""2763A4D3D8CDE919_404605078BE831D9_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=CC(=C2)COCCOC)Cl""",21,"""6E5D8C578679B604"""
+"""17BE382E98FAB262_C92B880685543AB5_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=CC(=C2)CN(C)C3CC3)Cl""",21,"""6E5D8C578679B604"""
+"""5CD5309593A03992_D6309CE5B21EDDD0_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=CC(=C2)OC(COC)C)Cl""",21,"""6E5D8C578679B604"""
+"""7A167E01E7C48538_847164D139AB7DFC_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)Cl""",21,"""6E5D8C578679B604"""
+"""9994A5057C364BB1_918882E5A2D6DCBE_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)Cl""",21,"""6E5D8C578679B604"""
+"""76912C6F0F1F4272_E833EDC955ECE0C3_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=CC=C2)CN3CCCC3)Cl""",21,"""6E5D8C578679B604"""
+"""AD6D9CCD7AC06CC5_F117C9CB3D800F43_6004_UN""","""NCC1=NC(=CC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)Cl""",21,"""6E5D8C578679B604"""
+"""5259AF2B904495A6_8CE39629BA96BE2A_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=CC(=C2)OCCN(C)C)Cl""",21,"""6E5D8C578679B604"""
+"""8E63576A9ACDEE8D_7B3E5AEB2BF41D11_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)Cl""",21,"""6E5D8C578679B604"""
+"""2601DF8E1446D4F8_4C19626FDC9E1EA5_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=C(C=C2)C3=CC=CC=C3)Cl""",21,"""6E5D8C578679B604"""
+"""B6357B13F3DC9D5A_9ED59CEBF6913416_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(C=CC=C2F)OC(F)(F)F)Cl""",21,"""6E5D8C578679B604"""
+"""B502FED05373845A_4E00526303CB0005_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Cl""",21,"""6E5D8C578679B604"""
+"""C929513EBF74850D_6195662C10EC62C0_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)Cl""",21,"""6E5D8C578679B604"""
+"""5CE94B8553AFEA29_64AE9889CCDCB0E9_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=CC(=C2F)C(N(C)C)=O)Cl""",21,"""6E5D8C578679B604"""
+"""AEF8F2841F5A58E2_A1553E7EAC5C2CDD_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)Cl""",21,"""6E5D8C578679B604"""
+"""3832F715A6B3CA37_B179AE2F73B29829_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Cl""",21,"""6E5D8C578679B604"""
+"""6BE36D69859E4E68_6C6AF716DD116C53_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=CC=C2)C3=CC=CC=C3)Cl""",21,"""6E5D8C578679B604"""
+"""73A017A3F47FC0B5_FC19136C44ECE686_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)Cl""",21,"""6E5D8C578679B604"""
+"""AB4BF2AF083E86FA_D938A3DFA4E3285D_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)Cl""",21,"""6E5D8C578679B604"""
+"""E51496DB698E0573_BFC5139E8D6A993D_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=C(OCCC(C)C)C=C2)Cl""",21,"""6E5D8C578679B604"""
+"""9DCF8D45A9363CFB_42A870887320096D_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=C(C=C2)OC3CCCC3)Cl""",21,"""6E5D8C578679B604"""
+"""FE60E1A89EA3FE97_C39EA976C4DB61B9_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(C=C(OC)C=C2)CN(C)C)Cl""",21,"""6E5D8C578679B604"""
+"""5D27120FAA75A7BE_B6E1CB44BEF7C50E_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)Cl""",21,"""6E5D8C578679B604"""
+"""42503EA294408333_49060CC869F63BE3_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(C)C=C(C=C2)OCC3CC3)Cl""",21,"""6E5D8C578679B604"""
+"""39B112E924E75653_BE81E53D428F16FD_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)Cl""",21,"""6E5D8C578679B604"""
+"""84A21D680D0A4BE5_C88ACB218AE31196_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(OCC(C)(C)C)N=CC=C2)Cl""",21,"""6E5D8C578679B604"""
+"""7ACD4A005D5E08FB_0DBA5A1B130778E9_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)Cl""",21,"""6E5D8C578679B604"""
+"""5F06C9F860A74196_67DE6F3DEC317389_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)Cl""",21,"""6E5D8C578679B604"""
+"""AB38110785D0EBCE_16E5DD48FD3AFD7A_6004_UN""","""NCC1=NC(=CC(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)Cl""",21,"""6E5D8C578679B604"""
+"""BC2DE4D13BFC63D1_A42E313D3F73F438_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)Cl""",21,"""6E5D8C578679B604"""
+"""57DF9984889F107F_D1E0A3B505DF640A_6004_UN""","""NCC1=NC(=CC(=C1)C2=CC(=CC=C2)C3=CC=NC=C3)Cl""",21,"""6E5D8C578679B604"""
+"""85230EE67FC891E7_821CFBEC3BADC51B_6004_UN""","""NCC1=NC(=CC(=C1)C2=C(C=CC=C2)CN3CCCC3)Cl""",21,"""6E5D8C578679B604"""
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+"""A2B7117BE085E69D_B988733266E9BD38_6035_UN""","""O(C13C(CCC2=C1C=C(C=C2)Br)C3(F)F)C4=NC=CC=C4""",21,"""6E80E0E6E82D775C"""
+"""1A86E5FA0BE6FF47_1C0D1258B312417C_6035_UN""","""O(C13C(CCC2=C1C=C(C=C2)Br)C3(F)F)C4=NN=N[N]4C""",21,"""6E80E0E6E82D775C"""
+"""CA4B4FE9F0423D02_D1531638F96EBA1B_6035_UN""","""O(C13C(CCC2=C1C=C(C=C2)Br)C3(F)F)C4=CC=CC=C4""",21,"""6E80E0E6E82D775C"""
+"""2B0B444F22193F63_6BDC80901F62885C_6035_UN""","""O(C13C(CCC2=C1C=C(C=C2)Br)C3(F)F)C4=CN=C(C)O4""",21,"""6E80E0E6E82D775C"""
+"""3BF52DF962742A7D_17BBFE88AFD64559_6035_UN""","""O(C13C(CCC2=C1C=C(C=C2)Br)C3(F)F)C4=N[N](C)C=C4""",21,"""6E80E0E6E82D775C"""
+"""BBAB262065B47823_53489C02F221D841_6035_UN""","""O(C13C(CCC2=C1C=C(C=C2)Br)C3(F)F)C4=NC(=NO4)N""",21,"""6E80E0E6E82D775C"""
+"""F3BB5FD128D6ECDE_ED282A7741CF2DCF_6035_UN""","""O(C13C(CCC2=C1C=C(C=C2)Br)C3(F)F)C4=NSC=C4Br""",21,"""6E80E0E6E82D775C"""
+"""21F9A78C7CAB9C24_32DBF089E71A6FA5_6035_UN""","""O(C13C(CCC2=C1C=C(C=C2)Br)C3(F)F)C4=CC=N[N]4C""",21,"""6E80E0E6E82D775C"""
+"""B94C5419396CCEC2_08EEB137E7620DD9_6035_UN""","""O(C13C(CCC2=C1C=C(C=C2)Br)C3(F)F)C4=CN=CN=C4""",21,"""6E80E0E6E82D775C"""
+"""1268C0D35C8BDDFD_C49B27D1D238495B_6043_UN""","""OC14C(CCC2=C1C=C(C=C2)N3CCC[S]3(=O)=O)C4(F)F""",21,"""6E80E0E6E82D775C"""
+"""7727AD51A03F6A39_EBF2699956F8E079_6043_UN""","""OC13C(CCC2=C1C=C(C=C2)N([S](CC)(=O)=O)C)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""7AD8BA8DEE9F4C3B_E18C1587EA3E797A_6043_UN""","""OC14C(CCC2=C1C=C(C=C2)N[S](=O)(=O)C3CC3)C4(F)F""",21,"""6E80E0E6E82D775C"""
+"""324FC3CA7C9E5599_FDCACC315EB29B50_6043_UN""","""OC13C(CCC2=C1C=C(C=C2)N(CC)[S](=O)(=O)C)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""0C67DA8D44C6A167_8191F775A5189F7D_6043_UN""","""OC13C(CCC2=C1C=C(C=C2)N[S](=O)(=O)CC=C)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""57D8E7B1BFB4B729_F4613C8241522C22_6043_UN""","""OC13C(CCC2=C1C=C(C=C2)N[S](=O)(=O)CC#N)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""975B0E7152F46D6D_1E8A463580505B2E_6043_UN""","""OC13C(CCC2=C1C=C(C=C2)N[S](C(C)=C)(=O)=O)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""32142ECB860C4C22_B1C499D7813DC866_6043_UN""","""OC13C(CCC2=C1C=C(C=C2)N(C)[S](=O)(=O)C=C)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""9BC3FC258B9ED340_7C8EBEDE1520A923_6043_UN""","""OC13C(CCC2=C1C=C(C=C2)N[S](=O)(=O)CCO)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""FFCFBF3CAC1E88EB_5A652065E9AC1CBB_6043_UN""","""OC14C(CCC2=C1C=C(C=C2)N3[S](=O)(=O)C=CC3)C4(F)F""",21,"""6E80E0E6E82D775C"""
+"""9BC3FC258B9ED340_1170A86CF85EEEE6_6043_DP""","""OC13C(CCC2=C1C=C(C=C2)N[S](CCO)(=O)=O)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""6CD5D727D8B3C149_A8084C5934BE4CD5_6043_UN""","""OC13C(CCC2=C1C=C(C=C2)N[S](CCC)(=O)=O)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""40D90FA2EBDE9AAE_2022AEE3AB694FA8_6043_UN""","""OC13C(CCC2=C1C=C(C=C2)N[S](C(C)C)(=O)=O)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""2E2E5C9739AB2A4E_AAA597CF1D3513DA_6043_UN""","""OC13C(CCC2=C1C=C(C=C2)N[S](=O)(=O)CCCl)C3(F)F""",21,"""6E80E0E6E82D775C"""
+"""38141CC180D7D2BC_2734FA6388C8DA4C_6043_UN""","""OC14C(CCC2=C1C=C(C=C2)N3CC(C)[S]3(=O)=O)C4(F)F""",21,"""6E80E0E6E82D775C"""
+"""8D9C2D45BD86693D_6E64C2A438EF89C0_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=CC=C2)OC3CCCC3""",21,"""6F9493F0C974701C"""
+"""66D6FC1DAFB319B5_C1133A88C3FF253C_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=C(OCC)C=C2)OCC""",21,"""6F9493F0C974701C"""
+"""E660D184655FBDC3_3D134D4F5C14D216_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=CC(=C2)OCCC(C)C""",21,"""6F9493F0C974701C"""
+"""C8C0A4B609FB9BF6_6129B519CF38E412_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""6F9493F0C974701C"""
+"""2F1723AB0E7F3131_5201DAD8485612BA_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=C(C=C2)OC3CCOC3""",21,"""6F9493F0C974701C"""
+"""350E0A6C7B2C7C50_99E03EAC9021E649_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""6F9493F0C974701C"""
+"""28BF5AEAE6A7614A_418F1AA0C4E5F7C1_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=CC(=C2)COCCOC""",21,"""6F9493F0C974701C"""
+"""55D42604008807C4_C8E297A1CA59FCAD_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""6F9493F0C974701C"""
+"""F519DD4102E11579_D7F98342FD131BC8_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=CC(=C2)OC(COC)C""",21,"""6F9493F0C974701C"""
+"""D8719F75A1638D87_85B87B7676A6BBE4_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""6F9493F0C974701C"""
+"""DFEE1D325DF2D5A3_90419D42EDDB1AA6_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""6F9493F0C974701C"""
+"""01A17A8699DB51CB_E9FAF26E1AE126DB_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=CC=C2)CN3CCCC3""",21,"""6F9493F0C974701C"""
+"""49635F35FB2CFCFB_F0DED66C728DC95B_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""6F9493F0C974701C"""
+"""DFF622EB353961D6_8D2A898EF59B7832_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=CC(=C2)OCCN(C)C""",21,"""6F9493F0C974701C"""
+"""57CBF6C631431F6B_7AF7454C64F9DB09_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""6F9493F0C974701C"""
+"""B16FF2389494D21D_4DD07DC89393D8BD_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""6F9493F0C974701C"""
+"""56663EB499397329_9F1C834CB99CF20E_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""6F9493F0C974701C"""
+"""63485368CFD8BC02_4FC94DC44CC6C61D_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""6F9493F0C974701C"""
+"""7FC10C45CE3704E5_605C798B5FE1A4D8_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""6F9493F0C974701C"""
+"""8A5662CE368D7CE0_6567872E83D176F1_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""6F9493F0C974701C"""
+"""892931BF62875238_A09C21D9E351EAC5_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""6F9493F0C974701C"""
+"""32B4232BF06FF162_B0B0B1883CBF5E31_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""6F9493F0C974701C"""
+"""074AABE55C97614A_6DA3E8B1921CAA4B_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""6F9493F0C974701C"""
+"""320F860EC2AE3AB3_FDD00CCB0BE1209E_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""6F9493F0C974701C"""
+"""910FB6B10352C0CA_D8F1BC78EBEEEE45_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""6F9493F0C974701C"""
+"""731E9C2AA790C603_BE0C0C39C2675F25_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=C(OCCC(C)C)C=C2""",21,"""6F9493F0C974701C"""
+"""C51DA660E67B8949_43616F2F3C2DCF75_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=C(C=C2)OC3CCCC3""",21,"""6F9493F0C974701C"""
+"""4F6AF40F29C637A0_C257B6D18BD6A7A1_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""6F9493F0C974701C"""
+"""DD739E89E5847F77_B728D4E3F1FA0316_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""6F9493F0C974701C"""
+"""102B912E09B3FE23_48CF136F26FBFDFB_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""6F9493F0C974701C"""
+"""206D92F332D1B544_BF48FA9A0D82D0E5_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""6F9493F0C974701C"""
+"""F9DB12E586F0AA8B_C943D486C5EED78E_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""6F9493F0C974701C"""
+"""214A5B9B59FECC4B_0C7345BC5C0ABEF1_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""6F9493F0C974701C"""
+"""F085ABEFE655115E_6617709AA33CB591_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""6F9493F0C974701C"""
+"""6F7BF8F42163C398_172CC2EFB2373B62_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""6F9493F0C974701C"""
+"""B8200CB21261ED7D_A5E72E9A707E3220_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""6F9493F0C974701C"""
+"""CD01AF0AC9DEB667_D029BC124AD2A212_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""6F9493F0C974701C"""
+"""8A66C69FBE56906E_83D5E44B74A00303_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(C=CC=C2)CN3CCCC3""",21,"""6F9493F0C974701C"""
+"""65041F12C5D50F44_1B01B4CAC812E0B9_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=CC(=N[N]2C3CCCCO3)C""",21,"""6F9493F0C974701C"""
+"""FA7A36ACFACD6430_11069EC9916F0444_6005_UN""","""FC1=C(C(=C(N=C1)F)F)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""6F9493F0C974701C"""
+"""FDE0293C27150AC5_71FB9C3611848245_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=CC(=CC=C2)OC3CCCC3""",21,"""700BCD62E01F7B99"""
+"""A6CA8D9ECBF069B8_DE8C641AEA942EB9_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=CC(=C(OCC)C=C2)OCC""",21,"""700BCD62E01F7B99"""
+"""01A62BF88A343AC5_228C13DD757FD993_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=CC=CC(=C2)OCCC(C)C""",21,"""700BCD62E01F7B99"""
+"""2F175459C3D77B18_7EB6EB8BE653EF97_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""700BCD62E01F7B99"""
+"""4E798E978388475F_4D9E844A613D193F_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=CC=C(C=C2)OC3CCOC3""",21,"""700BCD62E01F7B99"""
+"""94991A5CDBBD065F_867F603EB94AEDCC_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""700BCD62E01F7B99"""
+"""27650E6552F446C8_5E104432ED8EFC44_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=CC=CC(=C2)COCCOC""",21,"""700BCD62E01F7B99"""
+"""26CE1DC428C6550E_D77DC933E332F728_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""700BCD62E01F7B99"""
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+"""628E774A28BC920F_A0D7A40824E9DB60_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""700BCD62E01F7B99"""
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+"""DEAD5BB3705EE828_08B39C7D9B5C30E7_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""700BCD62E01F7B99"""
+"""D32F33F90B93FE03_BA787008591539A5_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""700BCD62E01F7B99"""
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+"""C1A616CDF1A861E8_9C4ABAD95DCB0886_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=C(C=CC=C2)CN3CCCC3""",21,"""700BCD62E01F7B99"""
+"""421EBCA275D228B3_049EEA58E179EB3C_6004_UN""","""Cl[S](=O)(=O)C1=CC(=CS1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""700BCD62E01F7B99"""
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+"""98935E99C471A771_22C4D27D2AF31A05_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""70430CC2BF93B80F"""
+"""DC63B99D6C3C136B_7EFE2A2BB9DF2C01_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""70430CC2BF93B80F"""
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+"""A109690C29730A5A_8637A19EE6C62E5A_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""70430CC2BF93B80F"""
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+"""1546589DA95A6449_C82E1C708BF4D3DB_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""70430CC2BF93B80F"""
+"""C77081ABA5A91AE0_9A6FE444004173F7_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""70430CC2BF93B80F"""
+"""26A6364A4F52E101_8F9602709B3CD2B5_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""70430CC2BF93B80F"""
+"""A345C7C74C4B275B_F62D6D5C6C06EEC8_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""70430CC2BF93B80F"""
+"""7B19B0F39A19CB58_EF09495E046A0148_6005_UN""","""NC(=O)C1=CC=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""70430CC2BF93B80F"""
+"""FFFF9E0560D0D209_92FD16BC837CB021_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""70430CC2BF93B80F"""
+"""2222FFA4B1D0757A_6520DA7E121E131A_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""70430CC2BF93B80F"""
+"""2004BE7B0702D0C9_5207E2FAE57410AE_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""70430CC2BF93B80F"""
+"""FE596805FDCEDC13_80CB1C7ECF7B3A1D_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""70430CC2BF93B80F"""
+"""342B01EEC3AC448D_501ED2F63A210E0E_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""70430CC2BF93B80F"""
+"""6EF8A54C48E0D39C_7F8BE6B929066CCB_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""70430CC2BF93B80F"""
+"""218789906AD71CFC_7AB0181CF536BEE2_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""70430CC2BF93B80F"""
+"""575016DE21597811_BF4BBEEB95B622D6_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""70430CC2BF93B80F"""
+"""CE0AB39BD5E211A9_AF672EBA4A589622_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""70430CC2BF93B80F"""
+"""69A12715F29DB8A4_72747783E4FB6258_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""70430CC2BF93B80F"""
+"""F4BB899A801ADFC5_E20793F97D06E88D_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""70430CC2BF93B80F"""
+"""17EF4426838F8D7B_C726234A9D092656_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""70430CC2BF93B80F"""
+"""B9FE50C9637FF2B4_A1DB930BB4809736_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""70430CC2BF93B80F"""
+"""DA8E6D86D6609B65_5CB6F01D4ACA0766_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""70430CC2BF93B80F"""
+"""A786FBF78DBC61AC_DD8029E3FD316FB2_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""70430CC2BF93B80F"""
+"""D135917AE09C663D_A8FF4BD1871DCB05_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""70430CC2BF93B80F"""
+"""4FEF780F93D3FEC2_57188C5D501C35E8_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""70430CC2BF93B80F"""
+"""A9697D4AD22BDC88_A09F65A87B6518F6_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""70430CC2BF93B80F"""
+"""9B4D9CB5CFF0A2AD_D6944BB4B3091F9D_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""70430CC2BF93B80F"""
+"""529207666F20AA58_13A4DA8E2AED76E2_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""70430CC2BF93B80F"""
+"""5196DDE48CF05892_79C0EFA8D5DB7D82_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""70430CC2BF93B80F"""
+"""55C7192126FC4E6A_08FB5DDDC4D0F371_6005_UN""","""NC(=O)C1=CC=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""70430CC2BF93B80F"""
+"""3E104F91E6B15987_BA30B1A80699FA33_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""70430CC2BF93B80F"""
+"""1C334244CE2F8D77_CFFE23203C356A01_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""70430CC2BF93B80F"""
+"""823CD9557E2FA6A2_9C027B790247CB10_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""70430CC2BF93B80F"""
+"""D9776959CF8F77DF_04D62BF8BEF528AA_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""70430CC2BF93B80F"""
+"""A91E1462DE7F0C4E_0ED101FBE788CC57_6005_UN""","""NC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""70430CC2BF93B80F"""
+"""241D22229E0B8339_71BB63B40BC4E41F_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=CC=C3)OC4CCCC4""",21,"""704B32E0FA5F1DC3"""
+"""3533A6906D09AB18_DECC9B98F0D448E3_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=C(OCC)C=C3)OCC""",21,"""704B32E0FA5F1DC3"""
+"""26E13C3421BAF151_22CCEC5F6F3FBFC9_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=CC(=C3)OCCC(C)C""",21,"""704B32E0FA5F1DC3"""
+"""89CBF075BB47272E_7EF61409FC1389CD_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""704B32E0FA5F1DC3"""
+"""D79B1749F8B95562_4DDE7BC87B7D7F65_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=C(C=C3)OC4CCOC4""",21,"""704B32E0FA5F1DC3"""
+"""B1B6657540D45773_863F9FBCA30A8B96_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""704B32E0FA5F1DC3"""
+"""F9655DF500D679FA_5E50BBB0F7CE9A1E_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=CC(=C3)COCCOC""",21,"""704B32E0FA5F1DC3"""
+"""7BF989CD893B55CD_D73D36B1F9729172_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""704B32E0FA5F1DC3"""
+"""8A7704470804C3AA_C8262252CE387617_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=CC(=C3)OC(COC)C""",21,"""704B32E0FA5F1DC3"""
+"""25A04C5616940D90_9A67DA66458DD63B_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""704B32E0FA5F1DC3"""
+"""06B55D8789B6B711_8F9E3C52DEF07779_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""704B32E0FA5F1DC3"""
+"""2FCFE5ADAEEF6C4A_F625537E29CA4B04_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=CC=C3)CN4CCCC4""",21,"""704B32E0FA5F1DC3"""
+"""999B4B18415CBF5D_EF01777C41A6A484_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""704B32E0FA5F1DC3"""
+"""B6322025D8C1765A_92F5289EC6B015ED_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=CC(=C3)OCCN(C)C""",21,"""704B32E0FA5F1DC3"""
+"""0C4BF189279C5754_6528E45C57D2B6D6_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""704B32E0FA5F1DC3"""
+"""2A6FE198081104C2_520FDCD8A0B8B562_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""704B32E0FA5F1DC3"""
+"""46E25F7F322046F9_80C3225C8AB79FD1_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""704B32E0FA5F1DC3"""
+"""20C7214937A8F019_5016ECD47FEDABC2_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""704B32E0FA5F1DC3"""
+"""218D0266853EAC0F_7F83D89B6CCAC907_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""704B32E0FA5F1DC3"""
+"""72B9F8171477F2D0_7AB8263EB0FA1B2E_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""704B32E0FA5F1DC3"""
+"""5D0B3E79F885D9A2_BF4380C9D07A871A_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""704B32E0FA5F1DC3"""
+"""99304AF875D43CAA_AF6F10980F9433EE_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""704B32E0FA5F1DC3"""
+"""ABACFC96907F529E_727C49A1A137C794_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""704B32E0FA5F1DC3"""
+"""75B9A20E5849BAC3_E20FADDB38CA4D41_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""704B32E0FA5F1DC3"""
+"""AD9C92A6463FC2B5_C72E1D68D8C5839A_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""704B32E0FA5F1DC3"""
+"""0C456E8F3FB1790A_A1D3AD29F14C32FA_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=C(OCCC(C)C)C=C3""",21,"""704B32E0FA5F1DC3"""
+"""BD13F3C1B954C114_5CBECE3F0F06A2AA_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=C(C=C3)OC4CCCC4""",21,"""704B32E0FA5F1DC3"""
+"""479DBAC52CC1999B_DD8817C1B8FDCA7E_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""704B32E0FA5F1DC3"""
+"""7BC6884518CB20DC_A8F775F3C2D16EC9_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""704B32E0FA5F1DC3"""
+"""9828B9A63859C854_5710B27F15D09024_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""704B32E0FA5F1DC3"""
+"""FF2F7E9DBC90E271_A0975B8A3EA9BD3A_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""704B32E0FA5F1DC3"""
+"""52ED0212BC4C6920_D69C7596F6C5BA51_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""704B32E0FA5F1DC3"""
+"""C60EB76672441904_13ACE4AC6F21D32E_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""704B32E0FA5F1DC3"""
+"""B8EADAF08361FF52_79C8D18A9017D84E_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""704B32E0FA5F1DC3"""
+"""B88000282F97EE74_08F363FF811C56BD_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""704B32E0FA5F1DC3"""
+"""06D52AF0765BBFBD_BA388F8A43555FFF_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""704B32E0FA5F1DC3"""
+"""259CC396129CEAEF_CFF61D0279F9CFCD_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""704B32E0FA5F1DC3"""
+"""A46FE5E11766AA00_9C0A455B478B6EDC_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(C=CC=C3)CN4CCCC4""",21,"""704B32E0FA5F1DC3"""
+"""77FBD0C7068D9E1B_04DE15DAFB398D66_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""704B32E0FA5F1DC3"""
+"""99BD497EBA3CC68B_0ED93FD9A244699B_6005_UN""","""C2(=C1[NH]C=NC1=NC=N2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""704B32E0FA5F1DC3"""
+"""9A924534389CAE14_FBE2978A4C154229_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CN=C(OC)C=C3""",21,"""70D96FF0E7F9454E"""
+"""9967639A40D59EA7_F933F5EBBEC6B718_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CC(=C(N=C3)O)C""",21,"""70D96FF0E7F9454E"""
+"""7F72A9408770055F_25353E75CEA36B54_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C=CC=C3F)F""",21,"""70D96FF0E7F9454E"""
+"""CB2E40244DF10DD0_09123B320D222F71_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C=CC(=C3)C)C""",21,"""70D96FF0E7F9454E"""
+"""FD2430C180E79EEE_5FC795B23BA7CD8D_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CC=C(SC)C=C3""",21,"""70D96FF0E7F9454E"""
+"""B5B016B31F6D2027_B828C37315313A69_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C(=CC=C3)Cl)Cl""",21,"""70D96FF0E7F9454E"""
+"""5692F9823487975C_0FAE15F3A667EF85_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(N=C(C=C3)O)F""",21,"""70D96FF0E7F9454E"""
+"""C44C8539B3C888A0_481DE1FA9059543B_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C)C=NC(=C3)F""",21,"""70D96FF0E7F9454E"""
+"""308ABC5BA8CFA741_2278AE4816AC6F37_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CC(=C(C=C3)F)F""",21,"""70D96FF0E7F9454E"""
+"""9A50AAFCC8482C23_0BC1EF52B04FE1E1_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CC(=C(C)C=C3)C""",21,"""70D96FF0E7F9454E"""
+"""F56EF08CAE276F42_DBD3882BC4CC3B8D_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(SC)C=CC=C3""",21,"""70D96FF0E7F9454E"""
+"""5100289A83B6D2CF_71A89A8F0C8EB919_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C)C=CC=C3C""",21,"""70D96FF0E7F9454E"""
+"""CE41D5C303AA62EA_FED82E6415307BD0_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C)C(=NC=C3)F""",21,"""70D96FF0E7F9454E"""
+"""F6D15993D7A9C0B7_C151ABD4DF90F508_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CSC=C3C(F)F""",21,"""70D96FF0E7F9454E"""
+"""B49DB6283A8D9C39_E2D0BA838570376F_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C(=CC=C3)Cl)F""",21,"""70D96FF0E7F9454E"""
+"""F3D2DA0C4CABC406_27D2E91C1805CC1A_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CC(=C(C=C3)F)Cl""",21,"""70D96FF0E7F9454E"""
+"""C5E73C9E3F5A89BD_66389A1BC797DA2C_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CC(=CC=C3)CF""",21,"""70D96FF0E7F9454E"""
+"""980278C9428C0E46_7704B0D19F2BC658_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CC=C(C=C3)CF""",21,"""70D96FF0E7F9454E"""
+"""55219AB8BC907340_1026EF557EBA79EE_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C)C=C(C=C3)F""",21,"""70D96FF0E7F9454E"""
+"""43DBCC346B6EBAB9_A358CBAAC2893FAD_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(CC)C=CC=C3""",21,"""70D96FF0E7F9454E"""
+"""5CF2D8B9F69826DC_711C258370A47B71_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C=CC(=C3)F)F""",21,"""70D96FF0E7F9454E"""
+"""6AF7248F97E50307_DC9CFED72C89D98E_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(OC)N=CC=C3""",21,"""70D96FF0E7F9454E"""
+"""BB7B30CD2C7B63F7_B1239530282BDB18_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CC(=NC=C3)OC""",21,"""70D96FF0E7F9454E"""
+"""163DAD7E8DD646BA_D6825E61B32720C8_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C=C(C)C=C3)F""",21,"""70D96FF0E7F9454E"""
+"""74A45F0599C36180_FD943951CDB7D395_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C(=CC=C3)Br)F""",21,"""70D96FF0E7F9454E"""
+"""D67895E0AD0D956F_E9536E1E095C33D6_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C=C(C)C=C3)C""",21,"""70D96FF0E7F9454E"""
+"""4AA4C71CC98234BD_512C18ED9CC50D47_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CC=CC(=C3)CC""",21,"""70D96FF0E7F9454E"""
+"""4F66913FB69B373B_933444B0431D21CA_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C([N](C)N=C3)C#N""",21,"""70D96FF0E7F9454E"""
+"""4C0BE7C566B27624_7512C18B23B1EB55_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=C(C)C=CC(=C3)F""",21,"""70D96FF0E7F9454E"""
+"""B0B21F3D947B23E4_7099484BA6ACBBC9_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CC(=C(C=C3)Cl)F""",21,"""70D96FF0E7F9454E"""
+"""522976646160566F_6CA4A34ECA5D4238_6006_UN""","""FC2=C(C(=C1CCCC(C1=C2)=O)F)C3=CN=C(NC)C=C3""",21,"""70D96FF0E7F9454E"""
+"""12FAFC0803D4C63E_D0DC7F1502994C69_2201_UN""","""FC3=C(C(=C2CCC1=CC4=C(N=C1C2=C3)N=CC=C4)F)Cl""",21,"""70D96FF0E7F9454E"""
+"""15C841EF9F17FB8C_6641823E66EE9B80_2201_UN""","""FC3=C(C(=C2CCC1=CC4=C(N=C1C2=C3)C=CN=C4)F)Cl""",21,"""70D96FF0E7F9454E"""
+"""805F1E84BB02E311_BC0DCABB153162F3_2201_UN""","""FC4=C(C(=C3CCC2=C(C)C1=NON=C1N=C2C3=C4)F)Cl""",21,"""70D96FF0E7F9454E"""
+"""AB857B0A70954F7B_51E9FBF1F81623CA_2201_UN""","""FC4=C(C(=C3CCC2=C(C)C1=C(SC=C1)N=C2C3=C4)F)Cl""",21,"""70D96FF0E7F9454E"""
+"""6C6D4C0CDB349C37_59D4014E1B66B224_2201_UN""","""FC4=C(C(=C3CCC2=CC1=C([N](C)N=C1)N=C2C3=C4)F)Cl""",21,"""70D96FF0E7F9454E"""
+"""694DDB783F6B7DDE_A553DC01FCF74CF1_2201_UN""","""FC3=C(C(=C2CCC1=CC4=C(N=C1C2=C3)C=NC=C4)F)Cl""",21,"""70D96FF0E7F9454E"""
+"""BE53ED50F6F208C4_7A0C01F933782CE6_2201_UN""","""FC4=C(C(=C3CCC2=CC1=C(ON=C1C)N=C2C3=C4)F)Cl""",21,"""70D96FF0E7F9454E"""
+"""165A3DE1E1822101_3CD2C38A2F840F29_2201_UN""","""FC4=C(C(=C3CCC2=CC1=C(C)[NH]N=C1N=C2C3=C4)F)Cl""",21,"""70D96FF0E7F9454E"""
+"""C3BC8A38FE8B63BC_AE74503F65AD4DCA_2201_UN""","""FC3=C(C(=C2CCC1=CC4=C(N=C1C2=C3)N=CN=C4)F)Cl""",21,"""70D96FF0E7F9454E"""
+"""702D65D2331E094B_8F5B2E69E1D1CA6C_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](CCN)(=O)=O)C3CC3""",21,"""719350863F2AA774"""
+"""D6A4735B36FA6A52_1422FEE34C72C5C2_6036_UN""","""NCCN1C2CCC1CC(C2)N(C(C)C)[S](=O)(=O)CCN""",21,"""719350863F2AA774"""
+"""93B17226B29E7141_43AD1256A232E69E_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](C)(=O)=O)CCN=C=S""",21,"""719350863F2AA774"""
+"""400A538B71400C37_5EBB13EEEC9A9F56_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](CC)(=O)=O)CCCN""",21,"""719350863F2AA774"""
+"""86B863B8E67A3727_D464B6031A4EAA77_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""719350863F2AA774"""
+"""18887863AC7603E1_92BEBE042A7B28F6_6036_UN""","""NCCN1C2CCC1CC(C2)N(CCCN)[S](=O)(=O)CCl""",21,"""719350863F2AA774"""
+"""0F41BF99A8E362E1_675F3242F8E9BDB7_6036_UN""","""NCCN1C2CCC1CC(C2)N(C)[S](=O)(=O)C3CNCC3""",21,"""719350863F2AA774"""
+"""3E0A1AE5A74491A4_D907395547061873_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](CC)(=O)=O)CCCBr""",21,"""719350863F2AA774"""
+"""A73BB4F1F1397FEB_6DDDB855E2089BFD_6036_UN""","""NCCN1C2CCC1CC(C2)N(CCCNC)[S](=O)(=O)C""",21,"""719350863F2AA774"""
+"""F035B2A2B52DBF6B_88B0B0336BC181A5_6036_UN""","""NCCN1C2CCC1CC(C2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""719350863F2AA774"""
+"""D4B1FE61399A1CB6_DAFBDA2837FE526D_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](=O)(=O)CC#N)C3CC3""",21,"""719350863F2AA774"""
+"""D090F0C61B50D452_592FB15EDF58107A_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](C)(=O)=O)C(=O)CCN""",21,"""719350863F2AA774"""
+"""8150E3B440250689_9F29E6AE3B06A489_6036_UN""","""NCCN1C2CCC1CC(C2)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""719350863F2AA774"""
+"""44009CF8326DC83C_3D8FBB372B49B6C8_6036_UN""","""NCCN1C2CCC1CC(C2)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""719350863F2AA774"""
+"""D75CBC2702E546C3_F0E8E07EF4079697_6036_UN""","""NCCN1C2CCC1CC(C2)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""719350863F2AA774"""
+"""9627628059A04218_04954FC93B07C63E_6036_UN""","""NCCN1C2CCC1CC(C2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""719350863F2AA774"""
+"""74889F457753316D_0E61A8C9A77CFE38_6036_UN""","""NCCN1C2CCC1CC(C2)N(CC(CC)N)[S](=O)(=O)C""",21,"""719350863F2AA774"""
+"""8C4E469BC2D21B38_0C4FFDE8A5774E13_6036_UN""","""NCCN1C2CCC1CC(C2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""719350863F2AA774"""
+"""681411602BE00F5F_9F8DE2A47F8F95F7_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""719350863F2AA774"""
+"""F207941B63E9C960_4F3CD50279F291D3_6036_UN""","""NCCN1C2CCC1CC(C2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""719350863F2AA774"""
+"""D17A243C2D931C04_0533B2B3EE3C165E_6036_UN""","""NCCN1C2CCC1CC(C2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""719350863F2AA774"""
+"""C6F154433AE38037_E90E2CD1E416B251_6036_UN""","""NCCN1C2CCC1CC(C2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""719350863F2AA774"""
+"""6E88F159EA868062_E0E398B54F439FEB_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](=O)(=O)C3CC3)CC#C""",21,"""719350863F2AA774"""
+"""852917B2AD175D71_B4E3823EA84D5A2D_6036_UN""","""NCCN1C2CCC1CC(C2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""719350863F2AA774"""
+"""2126408C8012090A_9C88CDC38D4916C5_6036_UN""","""NCCN1C2CCC1CC(C2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""719350863F2AA774"""
+"""BD3A3AA772CE6512_57A13697048FDDD6_6036_UN""","""NCCN1C2CCC1CC(C2)N3CCCC(CC)[S]3(=O)=O""",21,"""719350863F2AA774"""
+"""F3B4A2A5E618621D_66C8464D61366B79_6036_UN""","""NCCN1C2CCC1CC(C2)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""719350863F2AA774"""
+"""190CCCF30F1B5AA1_B9D621E31B3E5257_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""719350863F2AA774"""
+"""2FF8499A05853486_12EEEF7ACFAECF7B_6036_UN""","""NCCN1C2CCC1CC(C2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""719350863F2AA774"""
+"""2D547E79A6C53AC6_52825F2ACA9416C5_6036_UN""","""NCCN1C2CCC1CC(C2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""719350863F2AA774"""
+"""EE407C7211B9D70D_FACDC5FE318909AD_6036_UN""","""NCCN1C2CCC1CC(C2)N3[S](CCN(C)CC3)(=O)=O""",21,"""719350863F2AA774"""
+"""D8700BB815B31111_765AE3735920E24E_6036_UN""","""NCCN1C2CCC1CC(C2)N3CC(=O)NCC[S]3(=O)=O""",21,"""719350863F2AA774"""
+"""C2F2C4CF4A66B2F4_23A1FE7AF48525DA_6036_UN""","""NCCN1C2CCC1CC(C2)N3[S](CCCCC3C)(=O)=O""",21,"""719350863F2AA774"""
+"""20F6D9F7DDA5116A_5909BBB65A65CA24_6036_UN""","""NCCN1C2CCC1CC(C2)N(CCN)[S](=O)(=O)C3CC3""",21,"""719350863F2AA774"""
+"""88CF756194486E46_3FF39D77FE4958D3_6036_UN""","""NCCN1C2CCC1CC(C2)N(CCN)[S](=O)(=O)C(F)F""",21,"""719350863F2AA774"""
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+"""D763310FBD786C35_DEB3475230C27934_6005_UN""","""NCC1=CC(=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C)Cl""",21,"""737062737260AE89"""
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+"""2140B6F174E156DB_A3AC0B19B6960E70_6005_UN""","""NCC1=CC(=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)Cl""",21,"""737062737260AE89"""
+"""074D3AB180858F65_D5A725057EFA091B_6005_UN""","""NCC1=CC(=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2)Cl""",21,"""737062737260AE89"""
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+"""D5360CAC46809C2D_7AF3811918286B04_6005_UN""","""NCC1=CC(=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)Cl""",21,"""737062737260AE89"""
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+"""B5DF3B35408D8B16_B903DF19CB6AECB5_6005_UN""","""NCC1=CC(=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)Cl""",21,"""737062737260AE89"""
+"""C019FDFBF9A584EB_CCCD4D91F1C67C87_6005_UN""","""NCC1=CC(=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3)Cl""",21,"""737062737260AE89"""
+"""294B99D6C4382E5D_9F3115C8CFB4DD96_6005_UN""","""NCC1=CC(=C(C=C1)C2=C(C=CC=C2)CN3CCCC3)Cl""",21,"""737062737260AE89"""
+"""03BB99A91A301B25_07E5454973063E2C_6005_UN""","""NCC1=CC(=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C)Cl""",21,"""737062737260AE89"""
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+"""E3D72DA0D0F7124B_F896EF48AA1C9C87_6006_UN""","""CC2=C(C(=C1C(CCOC1=C2)=O)C)C3=CN=C(OC)C=C3""",21,"""73AD173201F09BE0"""
+"""3F0417ED4E6ACBC4_FA478D2958CF69B6_6006_UN""","""CC2=C(C(=C1C(CCOC1=C2)=O)C)C3=CC(=C(N=C3)O)C""",21,"""73AD173201F09BE0"""
+"""0A791C62A31BB593_264146B728AAB5FA_6006_UN""","""CC2=C(C(=C1C(CCOC1=C2)=O)C)C3=C(C=CC=C3F)F""",21,"""73AD173201F09BE0"""
+"""8E5A6E63548DB8BC_0A6643F0EB2BF1DF_6006_UN""","""CC2=C(C(=C1C(CCOC1=C2)=O)C)C3=C(C=CC(=C3)C)C""",21,"""73AD173201F09BE0"""
+"""3F4566BD06D9CC24_5CB3ED70DDAE1323_6006_UN""","""CC2=C(C(=C1C(CCOC1=C2)=O)C)C3=CC=C(SC)C=C3""",21,"""73AD173201F09BE0"""
+"""5E17E0B4E834A08B_BB5CBBB1F338E4C7_6006_UN""","""CC2=C(C(=C1C(CCOC1=C2)=O)C)C3=C(C(=CC=C3)Cl)Cl""",21,"""73AD173201F09BE0"""
+"""EE808A3B146A2DEA_0CDA6D31406E312B_6006_UN""","""CC2=C(C(=C1C(CCOC1=C2)=O)C)C3=C(N=C(C=C3)O)F""",21,"""73AD173201F09BE0"""
+"""78865B529F93B021_4B69993876508A95_6006_UN""","""CC2=C(C(=C1C(CCOC1=C2)=O)C)C3=C(C)C=NC(=C3)F""",21,"""73AD173201F09BE0"""
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+"""2E5A615089818A3D_65615FEDFE71EFF6_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(C)[S](=O)(=O)C2CNCC2""",21,"""73AD3D2939B2F535"""
+"""3EDE9401C1CA142C_DB3954FA419E4A32_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N([S](CC)(=O)=O)CCCBr""",21,"""73AD3D2939B2F535"""
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+"""08EB4BAAE3738378_8A8EDD9C6D59D3E4_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""73AD3D2939B2F535"""
+"""ABEAAB988ABBA711_D8C5B7873166002C_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N([S](=O)(=O)CC#N)C2CC2""",21,"""73AD3D2939B2F535"""
+"""E676BE4549484BA1_5B11DCF1D9C0423B_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""73AD3D2939B2F535"""
+"""E54B04756BCE732D_9D178B013D9EF6C8_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""73AD3D2939B2F535"""
+"""D72DA4445CD38006_3FB1D6982DD1E489_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""73AD3D2939B2F535"""
+"""26BD788BD0F3833F_F2D68DD1F29FC4D6_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""73AD3D2939B2F535"""
+"""B230C2D12A99F54D_06AB22663D9F947F_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""73AD3D2939B2F535"""
+"""8D33543CC06DEE21_0C5FC566A1E4AC79_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""73AD3D2939B2F535"""
+"""B654780E2DD4C317_0E719047A3EF1C52_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""73AD3D2939B2F535"""
+"""6446E724D62BDC9A_9DB38F0B7917C7B6_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""73AD3D2939B2F535"""
+"""DD2F39D7903A730B_4D02B8AD7F6AC392_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""73AD3D2939B2F535"""
+"""58993BDD2E56CF27_070DDF1CE8A4441F_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""73AD3D2939B2F535"""
+"""2FF01EE6AECB2F03_EB30417EE28EE010_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""73AD3D2939B2F535"""
+"""42374A70ACE2991B_E2DDF51A49DBCDAA_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N([S](=O)(=O)C2CC2)CC#C""",21,"""73AD3D2939B2F535"""
+"""0512BC0455E82224_B6DDEF91AED5086C_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""73AD3D2939B2F535"""
+"""DC93BCEE29D7AA6F_9EB6A06C8BD14484_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N2CCCC(C)(C)[S]2(=O)=O""",21,"""73AD3D2939B2F535"""
+"""5286C9D39F692BFA_559F5B3802178F97_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N2CCCC(CC)[S]2(=O)=O""",21,"""73AD3D2939B2F535"""
+"""8929CB78AA910AB2_64F62BE267AE3938_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""73AD3D2939B2F535"""
+"""DCA41F4F54C11823_BBE84C4C1DA60016_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""73AD3D2939B2F535"""
+"""88E909E40160D0B7_10D082D5C9369D3A_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""73AD3D2939B2F535"""
+"""0D74FFE2619FB2EE_50BC3285CC0C4484_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""73AD3D2939B2F535"""
+"""89364B1CE2070D94_F8F3A85137115BEC_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N2[S](CCN(C)CC2)(=O)=O""",21,"""73AD3D2939B2F535"""
+"""3409FC6C3BE09972_74648EDC5FB8B00F_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N2CC(=O)NCC[S]2(=O)=O""",21,"""73AD3D2939B2F535"""
+"""958795979A6B6203_219F93D5F21D779B_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N2[S](CCCCC2C)(=O)=O""",21,"""73AD3D2939B2F535"""
+"""1A9E7BD3CDA37D32_5B37D6195CFD9865_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(CCN)[S](=O)(=O)C2CC2""",21,"""73AD3D2939B2F535"""
+"""4A0F82EA34766012_3DCDF0D8F8D10A92_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(CCN)[S](=O)(=O)C(F)F""",21,"""73AD3D2939B2F535"""
+"""66793271703DD8BE_9DC86CBDC6DAF470_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N([S](CC)(=O)=O)C2CNC2""",21,"""73AD3D2939B2F535"""
+"""D785254B14A7025C_AF51B8815133A00D_6036_DP""","""C(C1CCCNC1)(C(F)(F)F)N3CC2(CNC2)C[S]3(=O)=O""",21,"""73AD3D2939B2F535"""
+"""C06FA13666D504CB_1524C11388F0E467_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""73AD3D2939B2F535"""
+"""305841E63028339D_E9CF59438192F4D7_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""73AD3D2939B2F535"""
+"""A5F260C8CF5FB073_D7AE3EF44CAC3C4C_6036_UN""","""C(C1CCCNC1)(C(F)(F)F)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""73AD3D2939B2F535"""
+"""6A59A5BE41F6CD6B_720F46457D6F6F82_6004_DP""","""NC1=C(ON=C1C2=CC(=CC=C2)OC3CCCC3)C4CC4""",21,"""73FF17118CF4965E"""
+"""F2426313733A014E_DD78BE69867FC37E_6004_DP""","""NC1=C(ON=C1C2=CC(=C(OCC)C=C2)OCC)C3CC3""",21,"""73FF17118CF4965E"""
+"""4CC52710B033A68F_2178C9AE19943454_6004_DP""","""NC1=C(ON=C1C2=CC=CC(=C2)OCCC(C)C)C3CC3""",21,"""73FF17118CF4965E"""
+"""C1ECA28F0D3FD6EA_7D4231F88AB80250_6004_DP""","""NC1=C(ON=C1C2=CC=C(C=C2)C[N]3C=CN=C3)C4CC4""",21,"""73FF17118CF4965E"""
+"""393931BADE78CE4D_4E6A5E390DD6F4F8_6004_DP""","""NC1=C(ON=C1C2=CC=C(C=C2)OC3CCOC3)C4CC4""",21,"""73FF17118CF4965E"""
+"""04D566AF6506A446_858BBA4DD5A1000B_6004_DP""","""NC1=C(ON=C1C2=CC(=C(OC)C=C2)CN(C)C)C3CC3""",21,"""73FF17118CF4965E"""
+"""B9903292274E4295_5DE49E4181651183_6004_DP""","""NC1=C(ON=C1C2=CC=CC(=C2)COCCOC)C3CC3""",21,"""73FF17118CF4965E"""
+"""20ACAAD4BD3D329F_D48913408FD91AEF_6004_DP""","""NC1=C(ON=C1C2=CC=CC(=C2)CN(C)C3CC3)C4CC4""",21,"""73FF17118CF4965E"""
+"""91C9F8B3187AF83E_CB9207A3B893FD8A_6004_DP""","""NC1=C(ON=C1C2=CC=CC(=C2)OC(COC)C)C3CC3""",21,"""73FF17118CF4965E"""
+"""DD841BEE7BADAC10_99D3FF9733265DA6_6004_DP""","""NC1=C(ON=C1C2=CC(=C(C(NOC)=O)C=C2)F)C3CC3""",21,"""73FF17118CF4965E"""
+"""49422CC658CA1775_8C2A19A3A85BFCE4_6004_DP""","""NC1=C(ON=C1C2=C(OC)N=C(C=C2)C(F)(F)F)C3CC3""",21,"""73FF17118CF4965E"""
+"""6C4F4FFA87DDCD22_F591768F5F61C099_6004_DP""","""NC1=C(ON=C1C2=CC(=CC=C2)CN3CCCC3)C4CC4""",21,"""73FF17118CF4965E"""
+"""B700E46BD072916A_ECB5528D370D2F19_6004_DP""","""NC1=C(ON=C1C3=CC=C([N]2C=C(C)C=N2)C=C3)C4CC4""",21,"""73FF17118CF4965E"""
+"""19D39CC0BBAED1E8_91410D6FB01B9E70_6004_DP""","""NC1=C(ON=C1C2=CC=CC(=C2)OCCN(C)C)C3CC3""",21,"""73FF17118CF4965E"""
+"""5E8DF0CFC323A94F_669CC1AD21793D4B_6004_DP""","""NC1=C(ON=C1C2=C(C=C(C(C)C)C=C2)C(C)C)C3CC3""",21,"""73FF17118CF4965E"""
+"""B1C1064324741651_51BBF929D6133EFF_6004_DP""","""NC1=C(ON=C1C2=CC=C(C=C2)C3=CC=CC=C3)C4CC4""",21,"""73FF17118CF4965E"""
+"""C615CF62C600F4A7_837707ADFC1C144C_6004_DP""","""NC1=C(ON=C1C2=C(C=CC=C2F)OC(F)(F)F)C3CC3""",21,"""73FF17118CF4965E"""
+"""193442833BE046C0_53A2C9250946205F_6004_DP""","""NC1=C(ON=C1C2=CC(=C(C=C2)Cl)OC(F)(F)F)C3CC3""",21,"""73FF17118CF4965E"""
+"""2202F56AE1A68057_7C37FD6A1A61429A_6004_DP""","""NC1=C(ON=C1C2=C(C=C(OC)C=C2)C(F)(F)F)C3CC3""",21,"""73FF17118CF4965E"""
+"""39C8C43DABBA1FD6_790C03CFC65190B3_6004_DP""","""NC1=C(ON=C1C2=CC=CC(=C2F)C(N(C)C)=O)C3CC3""",21,"""73FF17118CF4965E"""
+"""43CB751CAF9401F1_BCF7A538A6D10C87_6004_DP""","""NC1=C(ON=C1C2=CC(=C(OC)C=C2)C(F)(F)F)C3CC3""",21,"""73FF17118CF4965E"""
+"""E83D69CAF463BCFE_ACDB3569793FB873_6004_DP""","""NC1=C(ON=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)C3CC3""",21,"""73FF17118CF4965E"""
+"""DD6464E61C10DF7B_71C86C50D79C4C09_6004_DP""","""NC1=C(ON=C1C2=CC(=CC=C2)C3=CC=CC=C3)C4CC4""",21,"""73FF17118CF4965E"""
+"""AB066F42499C4AD3_E1BB882A4E61C6DC_6004_DP""","""NC1=C(ON=C1C2=C(OC)C=C(C=C2)C(F)(F)F)C3CC3""",21,"""73FF17118CF4965E"""
+"""4B8BA13FDA3BD8F9_C49A3899AE6E0807_6004_DP""","""NC1=C(ON=C1C2=C(C)C=C(C=C2)OC(F)(F)F)C3CC3""",21,"""73FF17118CF4965E"""
+"""5A8961540E45BA38_A26788D887E7B967_6004_DP""","""NC1=C(ON=C1C2=CC=C(OCCC(C)C)C=C2)C3CC3""",21,"""73FF17118CF4965E"""
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+"""E77C918FC179FD68_DE3C3230CE5641E3_6004_DP""","""NC1=C(ON=C1C2=C(C=C(OC)C=C2)CN(C)C)C3CC3""",21,"""73FF17118CF4965E"""
+"""0EFF64BE25003568_AB435002B47AE554_6004_DP""","""NC1=C(ON=C1C2=CC(=C(N=C2)C(F)(F)F)OC)C3CC3""",21,"""73FF17118CF4965E"""
+"""332BBEA633A253B8_54A4978E637B1BB9_6004_DP""","""NC1=C(ON=C1C2=C(C)C=C(C=C2)OCC3CC3)C4CC4""",21,"""73FF17118CF4965E"""
+"""5A3B13C51F27667C_A3237E7B480236A7_6004_DP""","""NC1=C(ON=C1C2=C(C=CC(=C2)C3(CC3)C#N)F)C4CC4""",21,"""73FF17118CF4965E"""
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+"""87DD724B26557FD5_0B47460EF7B7DD20_6004_DP""","""NC1=C(ON=C1C3=CC2=C(C=C(OC)C=C2)C=C3)C4CC4""",21,"""73FF17118CF4965E"""
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+"""5BE855A8D269EA08_0D6D1A28D4EFE206_6004_DP""","""NC1=C(ON=C1C2=C(C=C(C=C2)OC(F)(F)F)F)C3CC3""",21,"""73FF17118CF4965E"""
+"""DE653D56EC071AB5_75DD1C40A4343B79_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=CC=C2)OC3CCCC3)Br""",21,"""742D4D1455AFC2A5"""
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+"""30B9D12A4FFD6419_8259E0480CFA54F0_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C)Br""",21,"""742D4D1455AFC2A5"""
+"""FE95D988AFB0A987_5A36C444583E4578_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=CC(=C2)COCCOC)Br""",21,"""742D4D1455AFC2A5"""
+"""B43D4E6C14150BFD_D35B494556824E14_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3)Br""",21,"""742D4D1455AFC2A5"""
+"""CADFA4EE5BD8BF29_CC405DA661C8A971_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=CC(=C2)OC(COC)C)Br""",21,"""742D4D1455AFC2A5"""
+"""E56A13D54E087887_9E01A592EA7D095D_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F)Br""",21,"""742D4D1455AFC2A5"""
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+"""D05F4A7F876EFE4F_EB670888EE567BE2_6005_UN""","""COC1=C(C=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)Br""",21,"""742D4D1455AFC2A5"""
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+"""CEBED64C5F86B5D2_614E9BA8F82269B0_6005_UN""","""COC1=C(C=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)Br""",21,"""742D4D1455AFC2A5"""
+"""415AAEB22DB2CA13_5669A32C0F486A04_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)Br""",21,"""742D4D1455AFC2A5"""
+"""CCB7E6BE1991ED46_84A55DA8254740B7_6005_UN""","""COC1=C(C=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F)Br""",21,"""742D4D1455AFC2A5"""
+"""9C75437912467DD9_54709320D01D74A4_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Br""",21,"""742D4D1455AFC2A5"""
+"""2C93996A38E4B5C0_7BE5A76FC33A1661_6005_UN""","""COC1=C(C=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)Br""",21,"""742D4D1455AFC2A5"""
+"""841A9219128D52FE_7EDE59CA1F0AC448_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O)Br""",21,"""742D4D1455AFC2A5"""
+"""C080F5C7D484A1D1_BB25FF3D7F8A587C_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)Br""",21,"""742D4D1455AFC2A5"""
+"""A376D7D9B00610DF_AB096F6CA064EC88_6005_UN""","""COC1=C(C=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Br""",21,"""742D4D1455AFC2A5"""
+"""F686512E30BB2665_761A36550EC718F2_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3)Br""",21,"""742D4D1455AFC2A5"""
+"""C4A24F44D1E3626F_E669D22F973A9227_6005_UN""","""COC1=C(C=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)Br""",21,"""742D4D1455AFC2A5"""
+"""C5E88C77C18388DB_C348629C77355CFC_6005_UN""","""COC1=C(C=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)Br""",21,"""742D4D1455AFC2A5"""
+"""D73A6B11EA498F6D_A5B5D2DD5EBCED9C_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=C(OCCC(C)C)C=C2)Br""",21,"""742D4D1455AFC2A5"""
+"""9E3679C334A94D73_58D8B1CBA0F67DCC_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=C(C=C2)OC3CCCC3)Br""",21,"""742D4D1455AFC2A5"""
+"""EC6C8BD5E77359D5_D9EE6835170D1518_6005_UN""","""COC1=C(C=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C)Br""",21,"""742D4D1455AFC2A5"""
+"""1883D620C4FA5721_AC910A076D21B1AF_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)Br""",21,"""742D4D1455AFC2A5"""
+"""9451058537C3FE91_5376CD8BBA204F42_6005_UN""","""COC1=C(C=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3)Br""",21,"""742D4D1455AFC2A5"""
+"""4A0893A2574FC6B0_A4F1247E9159625C_6005_UN""","""COC1=C(C=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)Br""",21,"""742D4D1455AFC2A5"""
+"""A0276442B860574E_D2FA0A6259356537_6005_UN""","""COC1=C(C=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2)Br""",21,"""742D4D1455AFC2A5"""
+"""BEA0C99E9650D2F8_17CA9B58C0D10C48_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)Br""",21,"""742D4D1455AFC2A5"""
+"""F3EE565B1D3F0F8F_7DAEAE7E3FE70728_6005_UN""","""COC1=C(C=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)Br""",21,"""742D4D1455AFC2A5"""
+"""4D5895A533960C00_0C951C0B2EEC89DB_6005_UN""","""COC1=C(C=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)Br""",21,"""742D4D1455AFC2A5"""
+"""5E1E74760DE6248B_BE5EF07EECA58099_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)Br""",21,"""742D4D1455AFC2A5"""
+"""0EF769EEE23E2F7C_CB9062F6D60910AB_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3)Br""",21,"""742D4D1455AFC2A5"""
+"""CDF43DE73FBEBABC_986C3AAFE87BB1BA_6005_UN""","""COC1=C(C=C(C=C1)C2=C(C=CC=C2)CN3CCCC3)Br""",21,"""742D4D1455AFC2A5"""
+"""5359D47B1A9737B3_00B86A2E54C95200_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C)Br""",21,"""742D4D1455AFC2A5"""
+"""B55DCD3BA8DB00EE_0ABF402D0DB4B6FD_6005_UN""","""COC1=C(C=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)Br""",21,"""742D4D1455AFC2A5"""
+"""71332F63BC9D98A3_750BD7981C92F620_6004_UN""","""NC1=NC(=C(S1)C2=CC(=CC=C2)OC3CCCC3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""85D9BE36EC1B9D2C_DA7C2FB4E7825ADC_6004_UN""","""NC1=NC(=C(S1)C2=CC(=C(OCC)C=C2)OCC)C3CC3""",21,"""74FB86CCED090FFC"""
+"""97CEBD31C372C2CF_267C58737869ADF6_6004_UN""","""NC1=NC(=C(S1)C2=CC=CC(=C2)OCCC(C)C)C3CC3""",21,"""74FB86CCED090FFC"""
+"""0B9367A4A6AAD629_7A46A025EB459BF2_6004_UN""","""NC1=NC(=C(S1)C2=CC=C(C=C2)C[N]3C=CN=C3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""3A665C1728B217A0_496ECFE46C2B6D5A_6004_UN""","""NC1=NC(=C(S1)C2=CC=C(C=C2)OC3CCOC3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""DD99847BBC06520F_828F2B90B45C99A9_6004_UN""","""NC1=NC(=C(S1)C2=CC(=C(OC)C=C2)CN(C)C)C3CC3""",21,"""74FB86CCED090FFC"""
+"""C266792677079A50_5AE00F9CE0988821_6004_UN""","""NC1=NC(=C(S1)C2=CC=CC(=C2)COCCOC)C3CC3""",21,"""74FB86CCED090FFC"""
+"""96B8ACDD341DCF97_D38D829DEE24834D_6004_UN""","""NC1=NC(=C(S1)C2=CC=CC(=C2)CN(C)C3CC3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""9C2DFEC2B01E04AA_CC96967ED96E6428_6004_UN""","""NC1=NC(=C(S1)C2=CC=CC(=C2)OC(COC)C)C3CC3""",21,"""74FB86CCED090FFC"""
+"""C4A1FB8449DD23AC_9ED76E4A52DBC404_6004_UN""","""NC1=NC(=C(S1)C2=CC(=C(C(NOC)=O)C=C2)F)C3CC3""",21,"""74FB86CCED090FFC"""
+"""DA083CE3518DDB3E_8B2E887EC9A66546_6004_UN""","""NC1=NC(=C(S1)C2=C(OC)N=C(C=C2)C(F)(F)F)C3CC3""",21,"""74FB86CCED090FFC"""
+"""E95BD279A734EC76_F295E7523E9C593B_6004_UN""","""NC1=NC(=C(S1)C2=CC(=CC=C2)CN3CCCC3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""894378B1BFAD9320_EBB1C35056F0B6BB_6004_UN""","""NC1=NC(=C(S1)C3=CC=C([N]2C=C(C)C=N2)C=C3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""382324B463D2AC6D_96459CB2D1E607D2_6004_UN""","""NC1=NC(=C(S1)C2=CC=CC(=C2)OCCN(C)C)C3CC3""",21,"""74FB86CCED090FFC"""
+"""18ABFC0F21EB60F7_619850704084A4E9_6004_UN""","""NC1=NC(=C(S1)C2=C(C=C(C(C)C)C=C2)C(C)C)C3CC3""",21,"""74FB86CCED090FFC"""
+"""6D029BDF5AAC5AAD_56BF68F4B7EEA75D_6004_UN""","""NC1=NC(=C(S1)C2=CC=C(C=C2)C3=CC=CC=C3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""7801C80ABEF46DAA_847396709DE18DEE_6004_UN""","""NC1=NC(=C(S1)C2=C(C=CC=C2F)OC(F)(F)F)C3CC3""",21,"""74FB86CCED090FFC"""
+"""3F933376E581B232_54A658F868BBB9FD_6004_UN""","""NC1=NC(=C(S1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)C3CC3""",21,"""74FB86CCED090FFC"""
+"""598DE1C0EF029B87_7B336CB77B9CDB38_6004_UN""","""NC1=NC(=C(S1)C2=C(C=C(OC)C=C2)C(F)(F)F)C3CC3""",21,"""74FB86CCED090FFC"""
+"""627380D0D4C5B92F_7E089212A7AC0911_6004_UN""","""NC1=NC(=C(S1)C2=CC=CC(=C2F)C(N(C)C)=O)C3CC3""",21,"""74FB86CCED090FFC"""
+"""63D269E5369DACB2_BBF334E5C72C9525_6004_UN""","""NC1=NC(=C(S1)C2=CC(=C(OC)C=C2)C(F)(F)F)C3CC3""",21,"""74FB86CCED090FFC"""
+"""883A51C1FEE6C693_ABDFA4B418C221D1_6004_UN""","""NC1=NC(=C(S1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)C3CC3""",21,"""74FB86CCED090FFC"""
+"""90C92A59214FACF4_76CCFD8DB661D5AB_6004_UN""","""NC1=NC(=C(S1)C2=CC(=CC=C2)C3=CC=CC=C3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""CA7DCEE4ED2BB84E_E6BF19F72F9C5F7E_6004_UN""","""NC1=NC(=C(S1)C2=C(OC)C=C(C=C2)C(F)(F)F)C3CC3""",21,"""74FB86CCED090FFC"""
+"""19EB72DFF45FA825_C39EA944CF9391A5_6004_UN""","""NC1=NC(=C(S1)C2=C(C)C=C(C=C2)OC(F)(F)F)C3CC3""",21,"""74FB86CCED090FFC"""
+"""B7A3E6F7FCABD29F_A5631905E61A20C5_6004_UN""","""NC1=NC(=C(S1)C2=CC=C(OCCC(C)C)C=C2)C3CC3""",21,"""74FB86CCED090FFC"""
+"""B0E555E7A2B7B6F0_580E7A131850B095_6004_UN""","""NC1=NC(=C(S1)C2=CC=C(C=C2)OC3CCCC3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""7C18E077936C87ED_D938A3EDAFABD841_6004_UN""","""NC1=NC(=C(S1)C2=C(C=C(OC)C=C2)CN(C)C)C3CC3""",21,"""74FB86CCED090FFC"""
+"""6DF72D9B4894E530_AC47C1DFD5877CF6_6004_UN""","""NC1=NC(=C(S1)C2=CC(=C(N=C2)C(F)(F)F)OC)C3CC3""",21,"""74FB86CCED090FFC"""
+"""DEDCB6048329F848_53A006530286821B_6004_UN""","""NC1=NC(=C(S1)C2=C(C)C=C(C=C2)OCC3CC3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""424D91689455E1A8_A427EFA629FFAF05_6004_UN""","""NC1=NC(=C(S1)C2=C(C=CC(=C2)C3(CC3)C#N)F)C4CC4""",21,"""74FB86CCED090FFC"""
+"""216C6AD34BC17C8A_D22CC1BAE193A86E_6004_UN""","""NC1=NC(=C(S1)C2=C(OCC(C)(C)C)N=CC=C2)C3CC3""",21,"""74FB86CCED090FFC"""
+"""2DC937F066AA7DEF_171C50807877C111_6004_UN""","""NC1=NC(=C(S1)C2=CC=C(C=C2)C[N]3C=NC=N3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""10E9F61DA91703A4_7D7865A68741CA71_6004_UN""","""NC1=NC(=C(S1)C2=C(OCC)C=CC(=C2)[N](=O)=O)C3CC3""",21,"""74FB86CCED090FFC"""
+"""16D4700EE42C4553_0C43D7D3964A4482_6004_UN""","""NC1=NC(=C(S1)C3=CC2=C(C=C(OC)C=C2)C=C3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""CE3CCB000C6DC07A_BE883BA654034DC0_6004_UN""","""NC1=NC(=C(S1)C2=CC(=C(C=C2C3CC3)Cl)OC)C4CC4""",21,"""74FB86CCED090FFC"""
+"""98BFBB646C7BC6F1_CB46A92E6EAFDDF2_6004_UN""","""NC1=NC(=C(S1)C2=CC(=CC=C2)C3=CC=NC=C3)C4CC4""",21,"""74FB86CCED090FFC"""
+"""5171BE0F3C3E237C_98BAF17750DD7CE3_6004_UN""","""NC1=NC(=C(S1)C2=C(C=CC=C2)CN3CCCC3)C4CC4""",21,"""74FB86CCED090FFC"""
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+"""0AC518F0EDA69556_594FF83B128DAD58_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC=CC(=C2)COCCOC""",21,"""7754716B1F1C2A85"""
+"""5CBD2FDAD01EFBB4_D022753A1C31A634_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""7754716B1F1C2A85"""
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+"""45011CA8BEF4738A_9D7899EDA0CEE17D_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""7754716B1F1C2A85"""
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+"""1672C9DEFE7CCF74_F13A10F5CC897C42_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC(=CC=C2)CN3CCCC3""",21,"""7754716B1F1C2A85"""
+"""C62F0897B84576D1_E81E34F7A4E593C2_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""7754716B1F1C2A85"""
+"""436A433106FE39FC_95EA6B1523F322AB_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC=CC(=C2)OCCN(C)C""",21,"""7754716B1F1C2A85"""
+"""D297F816E09C2D40_6237A7D7B2918190_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""7754716B1F1C2A85"""
+"""03939C2AAC4894DA_55109F5345FB8224_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""7754716B1F1C2A85"""
+"""84F519B2E0E07200_87DC61D76FF4A897_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""7754716B1F1C2A85"""
+"""3DE43A190A9317D0_5709AF5F9AAE9C84_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""7754716B1F1C2A85"""
+"""5181AA371BD2D796_EC861F4F4021742A_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""7754716B1F1C2A85"""
+"""D6D8DB8F80F7396B_789C9B108989FE41_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""7754716B1F1C2A85"""
+"""09F9612B2CC20954_7DA765B555B92C68_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""7754716B1F1C2A85"""
+"""2F0BC414FBF96551_B85CC3423539B05C_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""7754716B1F1C2A85"""
+"""5DE6D55FFB555532_A8705313EAD704A8_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""7754716B1F1C2A85"""
+"""D2FDBB6F1EA75CA7_75630A2A4474F0D2_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""7754716B1F1C2A85"""
+"""75C0E9D2FF953109_E510EE50DD897A07_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""7754716B1F1C2A85"""
+"""78B5D26255604FAA_C0315EE33D86B4DC_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""7754716B1F1C2A85"""
+"""9CE9383B9C6BE149_A6CCEEA2140F05BC_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC=C(OCCC(C)C)C=C2""",21,"""7754716B1F1C2A85"""
+"""9375CF5AD4CF6FC5_5BA18DB4EA4595EC_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC=C(C=C2)OC3CCCC3""",21,"""7754716B1F1C2A85"""
+"""0BF5F0162F27233A_DA97544A5DBEFD38_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""7754716B1F1C2A85"""
+"""3A00B65BFAF325AB_AFE836782792598F_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""7754716B1F1C2A85"""
+"""D9726293AEF40238_500FF1F4F093A762_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""7754716B1F1C2A85"""
+"""593759BD19D4BF54_A7881801DBEA8A7C_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""7754716B1F1C2A85"""
+"""2F3B50B2974B584F_D183361D13868D17_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""7754716B1F1C2A85"""
+"""C1F52F20ECA3210F_14B3A7278A62E468_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""7754716B1F1C2A85"""
+"""D24582489B340745_7ED792017554EF08_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""7754716B1F1C2A85"""
+"""AEBD22E97B3FAB2A_0FEC2074645F61FB_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""7754716B1F1C2A85"""
+"""050F6043B5E66A69_BD27CC01A61668B9_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""7754716B1F1C2A85"""
+"""A4BFF6738396ADA1_C8E95E899CBAF88B_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""7754716B1F1C2A85"""
+"""F5BEE1A8DF208DBF_9B1506D0A2C8599A_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(C=CC=C2)CN3CCCC3""",21,"""7754716B1F1C2A85"""
+"""60063609E99355BD_09C67C5247075EDD_6025_UN""","""C1(=NC(=CC(=N1)Cl)CCl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""7754716B1F1C2A85"""
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+"""FE15882F0FFED619_D251DEE2E8A3C2AC_6036_UN""","""C(CNCCC1=CC=CC=C1)N([S](C)(=O)=O)C2CC(C2)N""",21,"""77A63867CDC7CFAF"""
+"""D0DE3C34FC3B303C_948BD6E5D896402D_6036_UN""","""C(CNCCC1=CC=CC=C1)N(CCCN)[S](=O)(=O)CCl""",21,"""77A63867CDC7CFAF"""
+"""98061E1C425D1073_616A5AA30A04D56C_6036_UN""","""C(CNCCC1=CC=CC=C1)N(C)[S](=O)(=O)C2CNCC2""",21,"""77A63867CDC7CFAF"""
+"""EC6EAF013BD37AF2_DF3251B4B5EB70A8_6036_UN""","""C(CNCCC1=CC=CC=C1)N([S](CC)(=O)=O)CCCBr""",21,"""77A63867CDC7CFAF"""
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+"""B7DDB2F9E9B733A1_8E85D8D2992CE97E_6036_UN""","""C(CNCCC1=CC=CC=C1)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""77A63867CDC7CFAF"""
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+"""1B851A15F86951F0_991C8E4FC9EBCC52_6036_UN""","""C(CNCCC1=CC=CC=C1)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""77A63867CDC7CFAF"""
+"""5715D4721F09D30F_3BBAD3D6D9A4DE13_6036_UN""","""C(CNCCC1=CC=CC=C1)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""77A63867CDC7CFAF"""
+"""2319AC28EA7D0DBA_F6DD889F06EAFE4C_6036_UN""","""C(CNCCC1=CC=CC=C1)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""77A63867CDC7CFAF"""
+"""641530A2D1B923F1_02A02728C9EAAEE5_6036_UN""","""C(CNCCC1=CC=CC=C1)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""77A63867CDC7CFAF"""
+"""F7F389DABF11D442_0854C028559196E3_6036_UN""","""C(CNCCC1=CC=CC=C1)N(CC(CC)N)[S](=O)(=O)C""",21,"""77A63867CDC7CFAF"""
+"""17FE59B6BA68EDEC_0A7A9509579A26C8_6036_UN""","""C(CNCCC1=CC=CC=C1)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""77A63867CDC7CFAF"""
+"""EBF5105535986929_99B88A458D62FD2C_6036_UN""","""C(CNCCC1=CC=CC=C1)N([S](C)(=O)=O)CCN=[N]#N""",21,"""77A63867CDC7CFAF"""
+"""A2986E43AFD799F3_4909BDE38B1FF908_6036_UN""","""C(CNCCC1=CC=CC=C1)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""77A63867CDC7CFAF"""
+"""E7DA4251C0D642D4_0306DA521CD17E85_6036_UN""","""C(CNCCC1=CC=CC=C1)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""77A63867CDC7CFAF"""
+"""50AACA34A20CAE84_EF3B443016FBDA8A_6036_UN""","""C(CNCCC1=CC=CC=C1)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""77A63867CDC7CFAF"""
+"""72D84130A95912C5_E6D6F054BDAEF730_6036_UN""","""C(CNCCC1=CC=CC=C1)N([S](=O)(=O)C2CC2)CC#C""",21,"""77A63867CDC7CFAF"""
+"""90532D4DDF1A333C_B2D6EADF5AA032F6_6036_UN""","""C(CNCCC1=CC=CC=C1)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""77A63867CDC7CFAF"""
+"""4200001967F03071_9ABDA5227FA47E1E_6036_UN""","""C(CNCCC1=CC=CC=C1)N2CCCC(C)(C)[S]2(=O)=O""",21,"""77A63867CDC7CFAF"""
+"""B912FDFBBDF8A08D_51945E76F662B50D_6036_UN""","""C(CNCCC1=CC=CC=C1)N2CCCC(CC)[S]2(=O)=O""",21,"""77A63867CDC7CFAF"""
+"""B65912729442E4D0_60FD2EAC93DB03A2_6036_UN""","""C(CNCCC1=CC=CC=C1)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""77A63867CDC7CFAF"""
+"""E7D3CFC78181B3AE_BFE34902E9D33A8C_6036_UN""","""C(CNCCC1=CC=CC=C1)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""77A63867CDC7CFAF"""
+"""55F77995E3B899BE_14DB879B3D43A7A0_6036_UN""","""C(CNCCC1=CC=CC=C1)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""77A63867CDC7CFAF"""
+"""BAF9DFF189BB088B_54B737CB38797E1E_6036_UN""","""C(CNCCC1=CC=CC=C1)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""77A63867CDC7CFAF"""
+"""1301C4B481491603_FCF8AD1FC3646176_6036_UN""","""C(CNCCC1=CC=CC=C1)N2[S](CCN(C)CC2)(=O)=O""",21,"""77A63867CDC7CFAF"""
+"""AA6842002A309C2F_706F8B92ABCD8A95_6036_UN""","""C(CNCCC1=CC=CC=C1)N2CC(=O)NCC[S]2(=O)=O""",21,"""77A63867CDC7CFAF"""
+"""DAF32F1E36C6FF87_2594969B06684D01_6036_UN""","""C(CNCCC1=CC=CC=C1)N2[S](CCCCC2C)(=O)=O""",21,"""77A63867CDC7CFAF"""
+"""F3A2F5C96F88452F_5F3CD357A888A2FF_6036_UN""","""C(CNCCC1=CC=CC=C1)N(CCN)[S](=O)(=O)C2CC2""",21,"""77A63867CDC7CFAF"""
+"""08FED4FAF8FCC5F6_39C6F5960CA43008_6036_UN""","""C(CNCCC1=CC=CC=C1)N(CCN)[S](=O)(=O)C(F)F""",21,"""77A63867CDC7CFAF"""
+"""9F07522850C7FD49_99C369F332AFCEEA_6036_UN""","""C(CNCCC1=CC=CC=C1)N([S](CC)(=O)=O)C2CNC2""",21,"""77A63867CDC7CFAF"""
+"""B5D5F204F35DB1B3_AB5ABDCFA5469A97_6036_DP""","""C(CNCCC1=CC=CC=C1)N3CC2(CNC2)C[S]3(=O)=O""",21,"""77A63867CDC7CFAF"""
+"""28BF231DCD3754F3_112FC45D7C85DEFD_6036_UN""","""C(CNCCC1=CC=CC=C1)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""77A63867CDC7CFAF"""
+"""28F76847235F1016_EDC45C0D75E7CE4D_6036_UN""","""C(CNCCC1=CC=CC=C1)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""77A63867CDC7CFAF"""
+"""D184E19549C0F3B9_D3A53BBAB8D906D6_6036_UN""","""C(CNCCC1=CC=CC=C1)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""77A63867CDC7CFAF"""
+"""B4BECC29382C3D7F_789AB003E1AE8984_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=CC=C2)OC3CCCC3)Cl""",21,"""796AE15710357058"""
+"""DFCC5473A77A8BB7_D7ED482F1ABE2578_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(OCC)C=C2)OCC)Cl""",21,"""796AE15710357058"""
+"""FA182F5429482697_2BED3FE88555D252_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)OCCC(C)C)Cl""",21,"""796AE15710357058"""
+"""7E95E6D142335AC2_77D7C7BE1679E456_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)Cl""",21,"""796AE15710357058"""
+"""8971B07E3B5AAC55_44FFA87F911712FE_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)OC3CCOC3)Cl""",21,"""796AE15710357058"""
+"""1D12E05A77D8428A_8F1E4C0B4960E60D_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C)Cl""",21,"""796AE15710357058"""
+"""AB9CA84D01095D95_577168071DA4F785_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)COCCOC)Cl""",21,"""796AE15710357058"""
+"""CAAFDFF0D3D41611_DE1CE5061318FCE9_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3)Cl""",21,"""796AE15710357058"""
+"""1BD5A19EEA359021_C107F1E524521B8C_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)OC(COC)C)Cl""",21,"""796AE15710357058"""
+"""40BC7B2EC2F74FA3_934609D1AFE7BBA0_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F)Cl""",21,"""796AE15710357058"""
+"""78059DBEBAB6A4A9_86BFEFE5349A1AE2_6005_UN""","""COC1=CC(=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)Cl""",21,"""796AE15710357058"""
+"""E5525A0FA6F3B8BC_FF0480C9C3A0269F_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=CC=C2)CN3CCCC3)Cl""",21,"""796AE15710357058"""
+"""10BF2B261842B85A_E620A4CBABCCC91F_6005_UN""","""COC1=CC(=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)Cl""",21,"""796AE15710357058"""
+"""FEB07072E7F8999C_9BD4FB292CDA7876_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)OCCN(C)C)Cl""",21,"""796AE15710357058"""
+"""96A2B07B20972BB2_6C0937EBBDB8DB4D_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)Cl""",21,"""796AE15710357058"""
+"""7EAE54532BD786B4_5B2E0F6F4AD2D8F9_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)Cl""",21,"""796AE15710357058"""
+"""F77743954D68ACBC_89E2F1EB60DDF24A_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F)Cl""",21,"""796AE15710357058"""
+"""5174062B59301A45_59373F639587C659_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Cl""",21,"""796AE15710357058"""
+"""A6861ADB14C61DA9_76A20B2C86A0A49C_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)Cl""",21,"""796AE15710357058"""
+"""F29770629E90C3C4_7399F5895A9076B5_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O)Cl""",21,"""796AE15710357058"""
+"""046F69E2630C4E61_B662537E3A10EA81_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)Cl""",21,"""796AE15710357058"""
+"""94ABBE0CED250C1E_A64EC32FE5FE5E75_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Cl""",21,"""796AE15710357058"""
+"""19A0E965ED2A906E_7B5D9A164B5DAA0F_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3)Cl""",21,"""796AE15710357058"""
+"""645669DAC9BBC721_EB2E7E6CD2A020DA_6005_UN""","""COC1=CC(=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)Cl""",21,"""796AE15710357058"""
+"""754B91B6FDC78815_CE0FCEDF32AFEE01_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)Cl""",21,"""796AE15710357058"""
+"""1C2CA34916770EBD_A8F27E9E1B265F61_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(OCCC(C)C)C=C2)Cl""",21,"""796AE15710357058"""
+"""3A290C32E11D2D00_559F1D88E56CCF31_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)OC3CCCC3)Cl""",21,"""796AE15710357058"""
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+"""0E647B7F70755C01_E3A2A33191F7D9EA_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1=C[NH]N=C1)C2=CC=C(C=C2)F""",21,"""79C0C75B29D7D808"""
+"""A97E6DA183CA2A41_DDC3C4865CC91171_6036_UN""","""NC(CCN(C(C)(C)CN)[S](=O)(=O)C)C1=CC=C(C=C1)F""",21,"""79C0C75B29D7D808"""
+"""9881012288B5230A_783960FAD9E1D134_6005_UN""","""FC1=C(C=C(C=C1)C2=CC(=CC=C2)OC3CCCC3)CBr""",21,"""79C931AE287A28E8"""
+"""B2CAE46E932FD36D_D74E98D622F17DC8_6005_UN""","""FC1=C(C=C(C=C1)C2=CC(=C(OCC)C=C2)OCC)CBr""",21,"""79C931AE287A28E8"""
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+"""B1BF3D37976A752C_777417472E36BCE6_6005_UN""","""FC1=C(C=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)CBr""",21,"""79C931AE287A28E8"""
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+"""10E3C8F0799E8220_C274C6668588FDF0_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC=CC(=C2)OC(COC)C""",21,"""7A19D6D4B1EF9624"""
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+"""D8185C91791B0E32_85CCD8669540FC9E_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""7A19D6D4B1EF9624"""
+"""FA1A4755FC50FB36_FC77B74A627AC0E3_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC(=CC=C2)CN3CCCC3""",21,"""7A19D6D4B1EF9624"""
+"""DEEF8A6CC9C18958_E55393480A162F63_6004_UN""","""CC(N)C1=NC=C(C=N1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""7A19D6D4B1EF9624"""
+"""788FA2E0A64D6BF8_98A7CCAA8D009E0A_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC=CC(=C2)OCCN(C)C""",21,"""7A19D6D4B1EF9624"""
+"""A0112F79AC7D98D7_6F7A00681C623D31_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""7A19D6D4B1EF9624"""
+"""48F40CFA34F0474D_585D38ECEB083E85_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""7A19D6D4B1EF9624"""
+"""97A51D0AD75ADB6D_8A91C668C1071436_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""7A19D6D4B1EF9624"""
+"""F04BA06DE7E5E81A_5A4408E0345D2025_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""7A19D6D4B1EF9624"""
+"""DB5F3815DECC64FF_75D13CAF277A42E0_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""7A19D6D4B1EF9624"""
+"""B091C4E7BDFE3A0F_70EAC20AFB4A90C9_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""7A19D6D4B1EF9624"""
+"""4F30C38F26C65EFE_B51164FD9BCA0CFD_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""7A19D6D4B1EF9624"""
+"""11CB61165D8497D6_A53DF4AC4424B809_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""7A19D6D4B1EF9624"""
+"""8A902753867E2C78_782EAD95EA874C73_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""7A19D6D4B1EF9624"""
+"""1B0E8A51BAA1346B_E85D49EF737AC6A6_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""7A19D6D4B1EF9624"""
+"""460ACC0D842C090E_CD7CF95C9375087D_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""7A19D6D4B1EF9624"""
+"""250BD01F8BE11A57_AB81491DBAFCB91D_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC=C(OCCC(C)C)C=C2""",21,"""7A19D6D4B1EF9624"""
+"""89B3CE8A4CF38B97_56EC2A0B44B6294D_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC=C(C=C2)OC3CCCC3""",21,"""7A19D6D4B1EF9624"""
+"""2C7D728B59D4E336_D7DAF3F5F34D4199_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""7A19D6D4B1EF9624"""
+"""A376B8AEEC8B33DD_A2A591C78961E52E_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""7A19D6D4B1EF9624"""
+"""67B64D591693EDE4_5D42564B5E601BC3_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""7A19D6D4B1EF9624"""
+"""495576C8A9C5AE9B_AAC5BFBE751936DD_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""7A19D6D4B1EF9624"""
+"""BD43B3EB9401E969_DCCE91A2BD7531B6_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""7A19D6D4B1EF9624"""
+"""B64D982D3E01899D_19FE0098249158C9_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""7A19D6D4B1EF9624"""
+"""10AAEDCF343B1700_739A35BEDBA753A9_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""7A19D6D4B1EF9624"""
+"""44B5E8A6236B562D_02A187CBCAACDD5A_6004_UN""","""CC(N)C1=NC=C(C=N1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""7A19D6D4B1EF9624"""
+"""243C4B18C75A937E_B06A6BBE08E5D418_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""7A19D6D4B1EF9624"""
+"""9FA5939301A167CF_C5A4F9363249442A_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""7A19D6D4B1EF9624"""
+"""20B1DF0467FB8849_9658A16F0C3BE53B_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(C=CC=C2)CN3CCCC3""",21,"""7A19D6D4B1EF9624"""
+"""65260B39369CCABB_0E8CF1EEB0890681_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""7A19D6D4B1EF9624"""
+"""D9068C1FAF8401A6_048BDBEDE9F4E27C_6004_UN""","""CC(N)C1=NC=C(C=N1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""7A19D6D4B1EF9624"""
+"""CC56E80D72354398_7BAB324631DED5ED_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC(=CC=C2)OC3CCCC3""",21,"""7A5B6312C0452C31"""
+"""D3145F93B8323A49_D4DCCA6ACACE7911_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC(=C(OCC)C=C2)OCC""",21,"""7A5B6312C0452C31"""
+"""B060B98930ABA85A_28DCBDAD55258E3B_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC=CC(=C2)OCCC(C)C""",21,"""7A5B6312C0452C31"""
+"""EDEC5AF60FAB9645_74E645FBC609B83F_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""7A5B6312C0452C31"""
+"""4B015EC5E5F6F78B_47CE2A3A41674E97_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC=C(C=C2)OC3CCOC3""",21,"""7A5B6312C0452C31"""
+"""B2C1496E2BE48ECF_8C2FCE4E9910BA64_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""7A5B6312C0452C31"""
+"""839534C106E6481F_5440EA42CDD4ABEC_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC=CC(=C2)COCCOC""",21,"""7A5B6312C0452C31"""
+"""98C7B6DCBDE7666C_DD2D6743C368A080_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""7A5B6312C0452C31"""
+"""21170A2A4009874D_C23673A0F42247E5_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC=CC(=C2)OC(COC)C""",21,"""7A5B6312C0452C31"""
+"""636AB859742C46BC_90778B947F97E7C9_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""7A5B6312C0452C31"""
+"""51A41D27BDE226A1_858E6DA0E4EA468B_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""7A5B6312C0452C31"""
+"""D71EFCB41796218B_FC35028C13D07AF6_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC(=CC=C2)CN3CCCC3""",21,"""7A5B6312C0452C31"""
+"""A47ED2239EEC69C7_E511268E7BBC9576_6005_UN""","""NC1=CC(=C(C=C1)C#N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""7A5B6312C0452C31"""
+"""179FAC2D0CB58B48_98E5796CFCAA241F_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC=CC(=C2)OCCN(C)C""",21,"""7A5B6312C0452C31"""
+"""3D2715F36170F20A_6F38B5AE6DC88724_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""7A5B6312C0452C31"""
+"""05F454C9C242649D_581F8D2A9AA28490_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""7A5B6312C0452C31"""
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+"""63CCCC51707C2E24_A2E72401F8CB5F3B_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""7A5B6312C0452C31"""
+"""EBD2135749FE84A7_5D00E38D2FCAA1D6_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""7A5B6312C0452C31"""
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+"""239FC40A2113FCC8_961A14A97D915F2E_6005_UN""","""NC1=CC(=C(C=C1)C#N)C2=C(C=CC=C2)CN3CCCC3""",21,"""7A5B6312C0452C31"""
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+"""363B6019998F5A8A_7B451B5F574D48AB_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""7AB54A0BA6D6B177"""
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+"""5FA5AE7D3EC64944_4720032327F4D3D1_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""7AB54A0BA6D6B177"""
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+"""F7341AF82E101D18_54AEC35BAB4736AA_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC=CC(=C2)COCCOC""",21,"""7AB54A0BA6D6B177"""
+"""AA2072D1F1E6FFDB_DDC34E5AA5FB3DC6_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""7AB54A0BA6D6B177"""
+"""559E758A16F9C448_C2D85AB992B1DAA3_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""7AB54A0BA6D6B177"""
+"""55370A2F2444EC19_9099A28D19047A8F_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""7AB54A0BA6D6B177"""
+"""8BDA672821DC76E7_856044B98279DBCD_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""7AB54A0BA6D6B177"""
+"""E74D13DA48369660_FCDB2B957543E7B0_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""7AB54A0BA6D6B177"""
+"""ACC9531440B1CC18_E5FF0F971D2F0830_6005_UN""","""COC1=CC(=C(C=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""7AB54A0BA6D6B177"""
+"""8E34DFEB90ADA4CD_980B50759A39B959_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""7AB54A0BA6D6B177"""
+"""968545466531644F_6FD69CB70B5B1A62_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""7AB54A0BA6D6B177"""
+"""FD73CF5E03CF9A3B_58F1A433FC3119D6_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""7AB54A0BA6D6B177"""
+"""331C2D8D794B8623_8A3D5AB7D63E3365_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""7AB54A0BA6D6B177"""
+"""800833B6DDC0192B_5AE8943F23640776_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""7AB54A0BA6D6B177"""
+"""E3D34D9EC3A08ADA_757DA070304365B3_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""7AB54A0BA6D6B177"""
+"""94FCC55AF69BC2B6_70465ED5EC73B79A_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""7AB54A0BA6D6B177"""
+"""7171595E7E82FB97_B5BDF8228CF32BAE_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""7AB54A0BA6D6B177"""
+"""0983D4A17CD4DAC0_A5916873531D9F5A_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""7AB54A0BA6D6B177"""
+"""FAE4F47C2A201670_7882314AFDBE6B20_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""7AB54A0BA6D6B177"""
+"""383598449A1A9EAF_E8F1D5306443E1F5_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""7AB54A0BA6D6B177"""
+"""93D4CD18DB6C0A73_CDD06583844C2F2E_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""7AB54A0BA6D6B177"""
+"""DBEC915288E99209_AB2DD5C2ADC59E4E_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""7AB54A0BA6D6B177"""
+"""103CACA79E50D4BF_5640B6D4538F0E1E_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""7AB54A0BA6D6B177"""
+"""0D2F120D2467E6E4_D7766F2AE47466CA_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""7AB54A0BA6D6B177"""
+"""68A56D34BE0DD553_A2090D189E58C27D_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""7AB54A0BA6D6B177"""
+"""82334AD0810C7978_5DEECA9449593C90_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""7AB54A0BA6D6B177"""
+"""4DF1DFE68BAE04D3_AA6923616220118E_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""7AB54A0BA6D6B177"""
+"""FE85AB0C75D0B1E4_DC620D7DAA4C16E5_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""7AB54A0BA6D6B177"""
+"""94671AF916CEE1B9_19529C4733A87F9A_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""7AB54A0BA6D6B177"""
+"""634D36D76DE2FA58_7336A961CC9E74FA_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""7AB54A0BA6D6B177"""
+"""765A7A4662149F59_020D1B14DD95FA09_6005_UN""","""COC1=CC(=C(C=C1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""7AB54A0BA6D6B177"""
+"""18C1CDB0D32288DA_B0C6F7611FDCF34B_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""7AB54A0BA6D6B177"""
+"""6B666C614B8F7FC6_C50865E925706379_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""7AB54A0BA6D6B177"""
+"""284D82D0932EBEFE_96F43DB01B02C268_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(C=CC=C2)CN3CCCC3""",21,"""7AB54A0BA6D6B177"""
+"""3AC38B37DD7E26E3_0E206D31A7B021D2_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=CC(=N[N]2C3CCCCO3)C""",21,"""7AB54A0BA6D6B177"""
+"""8472E86A267B0D00_04274732FECDC52F_6005_UN""","""COC1=CC(=C(C=C1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""7AB54A0BA6D6B177"""
+"""9D4C79F78363AA5A_7AC2A57242F94221_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=CC=C2)OC3CCCC3""",21,"""7B32F426B362BBFD"""
+"""FB7147BBC20E1111_D5B55D5EB9E9EEDD_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=C(OCC)C=C2)OCC""",21,"""7B32F426B362BBFD"""
+"""9AFC70CBC8765D5A_29B52A99260219F7_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=CC(=C2)OCCC(C)C""",21,"""7B32F426B362BBFD"""
+"""E17047B209F21CFE_758FD2CFB52E2FF3_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""7B32F426B362BBFD"""
+"""900CFED81181DEEA_46A7BD0E3240D95B_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=C(C=C2)OC3CCOC3""",21,"""7B32F426B362BBFD"""
+"""3AFEAF92F42CD510_8D46597AEA372DA8_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""7B32F426B362BBFD"""
+"""7C1646D6138D49C0_55297D76BEF33C20_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=CC(=C2)COCCOC""",21,"""7B32F426B362BBFD"""
+"""03FCEB226D16246B_DC44F077B04F374C_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""7B32F426B362BBFD"""
+"""191B2A5B97BA1B7A_C35FE4948705D029_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=CC(=C2)OC(COC)C""",21,"""7B32F426B362BBFD"""
+"""02C5A9DEACE2F804_911E1CA00CB07005_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""7B32F426B362BBFD"""
+"""FC0360D051725AA9_84E7FA9497CDD147_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""7B32F426B362BBFD"""
+"""337B8A5A4BB367C4_FD5C95B860F7ED3A_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=CC=C2)CN3CCCC3""",21,"""7B32F426B362BBFD"""
+"""2042751BF19D6FE4_E478B1BA089B02BA_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""7B32F426B362BBFD"""
+"""E7B95073B40552E9_998CEE588F8DB3D3_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=CC(=C2)OCCN(C)C""",21,"""7B32F426B362BBFD"""
+"""AAE99D43AC9D02FD_6E51229A1EEF10E8_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""7B32F426B362BBFD"""
+"""3A147C9CCFE3F1B1_59761A1EE985135C_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""7B32F426B362BBFD"""
+"""5136B46A756B4FF9_8BBAE49AC38A39EF_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""7B32F426B362BBFD"""
+"""6197ED406315BB5B_5B6F2A1236D00DFC_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""7B32F426B362BBFD"""
+"""7F66B1DD19B03A47_E0E09A02EC5FE552_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""7B32F426B362BBFD"""
+"""53A505C4E1CD5C89_74FA1E5D25F76F39_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""7B32F426B362BBFD"""
+"""9712E9F0FB6B760D_71C1E0F8F9C7BD10_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""7B32F426B362BBFD"""
+"""9138E4F2E1FE7C6D_B43A460F99472124_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""7B32F426B362BBFD"""
+"""DAB03E8A48A326CF_A416D65E46A995D0_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""7B32F426B362BBFD"""
+"""45A9E068B9F68B89_79058F67E80A61AA_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""7B32F426B362BBFD"""
+"""9093589C72DAE1D5_E9766B1D71F7EB7F_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""7B32F426B362BBFD"""
+"""3137FD8224C4898B_CC57DBAE91F825A4_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""7B32F426B362BBFD"""
+"""BBE14B862C110726_AAAA6BEFB87194C4_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=C(OCCC(C)C)C=C2""",21,"""7B32F426B362BBFD"""
+"""5005E344C9106D07_57C708F9463B0494_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=C(C=C2)OC3CCCC3""",21,"""7B32F426B362BBFD"""
+"""F063170C26D4C4E7_D6F1D107F1C06C40_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""7B32F426B362BBFD"""
+"""66EE0565921C3B57_A38EB3358BECC8F7_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""7B32F426B362BBFD"""
+"""53A3953A399BEA36_5C6974B95CED361A_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""7B32F426B362BBFD"""
+"""63CA88F67F2B738A_ABEE9D4C77941B04_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""7B32F426B362BBFD"""
+"""3EB4E47003710179_DDE5B350BFF81C6F_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""7B32F426B362BBFD"""
+"""0615F5D4AB1294CB_18D5226A261C7510_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""7B32F426B362BBFD"""
+"""DF7A30880B2635FA_72B1174CD92A7E70_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""7B32F426B362BBFD"""
+"""DB2CEE6DD8D6C426_038AA539C821F083_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""7B32F426B362BBFD"""
+"""9FB4DFFE6C263C4C_B141494C0A68F9C1_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""7B32F426B362BBFD"""
+"""74DAFBB3010098DC_C48FDBC430C469F3_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""7B32F426B362BBFD"""
+"""E1293B6E280B3BEA_9773839D0EB6C8E2_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(C=CC=C2)CN3CCCC3""",21,"""7B32F426B362BBFD"""
+"""58A6864EB125C52C_05A0F91FEB79CFA5_6025_UN""","""C1(=NC(=C(C(=N1)C)C)O)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""7B32F426B362BBFD"""
+"""82B8FA38463CDF25_80FBF56D9F604277_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](CCN)(=O)=O)C3CC3""",21,"""7E338B82419B2F6F"""
+"""49849B8516D17AD1_1B8225E732C34DD9_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""7E338B82419B2F6F"""
+"""FB849978E1B7487D_4C0DC952DC836E85_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""7E338B82419B2F6F"""
+"""E21F9A930BE89E29_511BC8EA922B174D_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](CC)(=O)=O)CCCN""",21,"""7E338B82419B2F6F"""
+"""B71C99B12FB0ECCA_DBC46D0764FF226C_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](C)(=O)=O)C3CC(C3)N""",21,"""7E338B82419B2F6F"""
+"""1E6EB3ABEDF35981_9D1E650054CAA0ED_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""7E338B82419B2F6F"""
+"""C96A51FCCB733DFA_68FFE946865835AC_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C)[S](=O)(=O)C3CNCC3""",21,"""7E338B82419B2F6F"""
+"""D1EF9B2CDE6067A8_D6A7E25139B79068_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](CC)(=O)=O)CCCBr""",21,"""7E338B82419B2F6F"""
+"""4F891932F80CC0CC_627D63519CB913E6_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(CCCNC)[S](=O)(=O)C""",21,"""7E338B82419B2F6F"""
+"""E4821F083C167D13_87106B37157009BE_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""7E338B82419B2F6F"""
+"""F7000B9C6AD055C8_D55B012C494FDA76_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](=O)(=O)CC#N)C3CC3""",21,"""7E338B82419B2F6F"""
+"""699A3B9BBABD93B6_568F6A5AA1E99861_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""7E338B82419B2F6F"""
+"""331450B86C7ECA46_90893DAA45B72C92_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""7E338B82419B2F6F"""
+"""F9E8CDA5FC1174EB_322F603355F83ED3_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""7E338B82419B2F6F"""
+"""47ECA094A73293FF_FF483B7A8AB61E8C_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""7E338B82419B2F6F"""
+"""A8C60EB347A2E779_0B3594CD45B64E25_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""7E338B82419B2F6F"""
+"""5C8C4F88AAFF5A96_01C173CDD9CD7623_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""7E338B82419B2F6F"""
+"""4E84E8C592F0A257_03EF26ECDBC6C608_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""7E338B82419B2F6F"""
+"""1D6910398ED5750E_902D39A0013E1DEC_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""7E338B82419B2F6F"""
+"""55F0BA6BA4E326BC_409C0E06074319C8_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""7E338B82419B2F6F"""
+"""C5B5B925B1681167_0A9369B7908D9E45_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""7E338B82419B2F6F"""
+"""BE2EA0EC9D19B6ED_E6AEF7D59AA73A4A_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""7E338B82419B2F6F"""
+"""8975D9A7E1F645EB_EF4343B131F217F0_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](=O)(=O)C3CC3)CC#C""",21,"""7E338B82419B2F6F"""
+"""1A8AA315706B0E1F_BB43593AD6FCD236_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""7E338B82419B2F6F"""
+"""8678B9B2CB147459_932816C7F3F89EDE_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N3CCCC(C)(C)[S]3(=O)=O""",21,"""7E338B82419B2F6F"""
+"""826397CF0195C704_5801ED937A3E55CD_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N3CCCC(CC)[S]3(=O)=O""",21,"""7E338B82419B2F6F"""
+"""78594A4523E101D7_69689D491F87E362_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""7E338B82419B2F6F"""
+"""D468C040BDAA8973_B676FAE7658FDA4C_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""7E338B82419B2F6F"""
+"""2D73DF5EC5C5CDBD_1D4E347EB11F4760_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""7E338B82419B2F6F"""
+"""D69CC539ED2E3B2F_5D22842EB4259EDE_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""7E338B82419B2F6F"""
+"""E878319A52CC455A_F56D1EFA4F3881B6_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N3[S](CCN(C)CC3)(=O)=O""",21,"""7E338B82419B2F6F"""
+"""3705BE402195D541_79FA387727916A55_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N3CC(=O)NCC[S]3(=O)=O""",21,"""7E338B82419B2F6F"""
+"""5EE90110480EA975_2C01257E8A34ADC1_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N3[S](CCCCC3C)(=O)=O""",21,"""7E338B82419B2F6F"""
+"""43A41E876FCECB41_56A960B224D4423F_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(CCN)[S](=O)(=O)C3CC3""",21,"""7E338B82419B2F6F"""
+"""617FE4800290E4FE_3053467380F8D0C8_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""7E338B82419B2F6F"""
+"""23CAE869B7CADD79_9056DA16BEF32E2A_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N([S](CC)(=O)=O)C3CNC3""",21,"""7E338B82419B2F6F"""
+"""BF37B4B22687429D_A2CF0E2A291A7A57_6036_DP""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N4CC3(CNC3)C[S]4(=O)=O""",21,"""7E338B82419B2F6F"""
+"""EB50F9694BA2376E_18BA77B8F0D93E3D_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""7E338B82419B2F6F"""
+"""53612C27F01E7800_E451EFE8F9BB2E8D_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""7E338B82419B2F6F"""
+"""1B3EDF2C020BEB5E_DA30885F3485E616_6036_UN""","""C(C1=C[NH]C2=C1C=C(C=C2)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""7E338B82419B2F6F"""
+"""517A93EAB05ACF70_8197275B60FC05A9_6036_UN""","""CCNC(CN([S](CCN)(=O)=O)C1CC1)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""4BA186F14BD2E56E_1AEEF7D1CD5F0A07_6036_UN""","""CCNC(CN(C(C)C)[S](=O)(=O)CCN)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""8746F64DE6A24597_4D611B64231F295B_6036_UN""","""CCNC(CN([S](C)(=O)=O)CCN=C=S)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""0990E2023CEDDA2F_50771ADC6DB75093_6036_UN""","""CCNC(CN([S](CC)(=O)=O)CCCN)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""62D0F9BA9D139F2C_DAA8BF319B6365B2_6036_UN""","""CCNC(CN([S](C)(=O)=O)C1CC(C1)N)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""8B1EBFFD7B0E50FB_9C72B736AB56E733_6036_UN""","""CCNC(CN(CCCN)[S](=O)(=O)CCl)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""22BF3CEFC354E0AE_69933B7079C47272_6036_UN""","""CCNC(CN(C)[S](=O)(=O)C1CNCC1)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""B0D34E384D6F607E_D7CB3067C62BD7B6_6036_UN""","""CCNC(CN([S](CC)(=O)=O)CCCBr)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""6F568E3BF733D565_6311B16763255438_6036_UN""","""CCNC(CN(CCCNC)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""DEC62C13E3A69D66_867CB901EAEC4E60_6036_UN""","""CCNC(CN(C(C)(C)C#N)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""B36AB4E6F5503298_D437D31AB6D39DA8_6036_UN""","""CCNC(CN([S](=O)(=O)CC#N)C1CC1)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""A647A429101A86BA_57E3B86C5E75DFBF_6036_UN""","""CCNC(CN([S](C)(=O)=O)C(=O)CCN)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""F05E42A41CCF0322_91E5EF9CBA2B6B4C_6036_UN""","""CCNC(CN(C)[S](=O)(=O)C1=CC=CS1)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""4232004C8EF08242_3343B205AA64790D_6036_UN""","""CCNC(CN(C(C)(C)C)[S](=O)(=O)CCl)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""A31CA9363462558D_FE24E94C752A5952_6036_UN""","""CCNC(CN(C(C)(C)C)[S](=O)(=O)CBr)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""5BF9C9DB14DFFD61_0A5946FBBA2A09FB_6036_UN""","""CCNC(CN(C(C)(C)C#C)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""E5C530F504F67E5B_00ADA1FB265131FD_6036_UN""","""CCNC(CN(CC(CC)N)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""591972F9BB0E771F_0283F4DA245A81D6_6036_UN""","""CCNC(CN(C)[S](=O)(=O)C1=C[NH]C=N1)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""F99596A23BCC1689_9141EB96FEA25A32_6036_UN""","""CCNC(CN([S](C)(=O)=O)CCN=[N]#N)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""898733625E55DFB7_41F0DC30F8DF5E16_6036_UN""","""CCNC(CN(CC(C)(C)N)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""28E5D54E546B9A45_0BFFBB816F11D99B_6036_UN""","""CCNC(CN1[S](CC(C)(C)C1=O)(=O)=O)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""936C7B9DA861829A_E7C225E3653B7D94_6036_UN""","""CCNC(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)C3=CC=CC=C3""",21,"""7F5F59B4BE0768B1"""
+"""29A8E0E4BC1FFBBA_EE2F9187CE6E502E_6036_UN""","""CCNC(CN([S](=O)(=O)C1CC1)CC#C)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""1D51D9B003E02665_BA2F8B0C296095E8_6036_UN""","""CCNC(CN1[S](=O)(=O)C2(CCC1)CC2)C3=CC=CC=C3""",21,"""7F5F59B4BE0768B1"""
+"""E0DBF20D7948DFB7_9244C4F10C64D900_6036_UN""","""CCNC(CN1CCCC(C)(C)[S]1(=O)=O)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""0121EABEFA1B6101_596D3FA585A21213_6036_UN""","""CCNC(CN1CCCC(CC)[S]1(=O)=O)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""8D799AD9DFAA28EC_68044F7FE01BA4BC_6036_UN""","""CCNC(CN1C(C(N)CC[S]1(=O)=O)=O)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""CAC0DDC6B5571A31_B71A28D19A139D92_6036_UN""","""CCNC(CN([S](C)(=O)=O)[C@@H]1CNCC1)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""51C7FB4F8A2D36F7_1C22E6484E8300BE_6036_UN""","""CCNC(CN1CCCC(Cl)(Cl)[S]1(=O)=O)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""DB56E7B700B6BBC1_5C4E56184BB9D900_6036_UN""","""CCNC(CN([S](C)(=O)=O)[C@H]1CNCC1)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""96B9D229FF2A1332_F401CCCCB0A4C668_6036_UN""","""CCNC(CN1[S](CCN(C)CC1)(=O)=O)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""4B758424CE027FB6_7896EA41D80D2D8B_6036_UN""","""CCNC(CN1CC(=O)NCC[S]1(=O)=O)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""ABF51C31202383D5_2D6DF74875A8EA1F_6036_UN""","""CCNC(CN1[S](CCCCC1C)(=O)=O)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""8A80BB02D0788573_57C5B284DB4805E1_6036_UN""","""CCNC(CN(CCN)[S](=O)(=O)C1CC1)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""D51B31A39E0981D6_313F94457F649716_6036_UN""","""CCNC(CN(CCN)[S](=O)(=O)C(F)F)C1=CC=CC=C1""",21,"""7F5F59B4BE0768B1"""
+"""97B3E5581F9F555D_913A0820416F69F4_6036_UN""","""CCNC(CN([S](CC)(=O)=O)C1CNC1)C2=CC=CC=C2""",21,"""7F5F59B4BE0768B1"""
+"""E1AC53873E90BA89_A3A3DC1CD6863D89_6036_DP""","""CCNC(CN2CC1(CNC1)C[S]2(=O)=O)C3=CC=CC=C3""",21,"""7F5F59B4BE0768B1"""
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+"""3389FF47C41FDE86_39505304D236163A_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC=CC(=C3)OC(COC)C""",21,"""813D43B6E6517DEE"""
+"""E1544AE73E0A4854_6B11AB305983B616_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""813D43B6E6517DEE"""
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+"""219D4B24724DB05A_0753222835C42B29_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC(=CC=C3)CN4CCCC4""",21,"""813D43B6E6517DEE"""
+"""8EDA8F2C8B69D06C_1E77062A5DA8C4A9_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""813D43B6E6517DEE"""
+"""C5286BC213BF7E7E_638359C8DABE75C0_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC=CC(=C3)OCCN(C)C""",21,"""813D43B6E6517DEE"""
+"""6D08A5325062778F_945E950A4BDCD6FB_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""813D43B6E6517DEE"""
+"""BB43CC76C9B267F3_A379AD8EBCB6D54F_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""813D43B6E6517DEE"""
+"""5BAF05203A4CCE95_71B5530A96B9FFFC_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""813D43B6E6517DEE"""
+"""6306A92AF85BD95C_A1609D8263E3CBEF_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""813D43B6E6517DEE"""
+"""235383285C905D2F_8EF5A9CD70C4A92A_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""813D43B6E6517DEE"""
+"""D8AD026CF34906DA_8BCE5768ACF47B03_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""813D43B6E6517DEE"""
+"""9FFADAE8A62B12C1_4E35F19FCC74E737_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""813D43B6E6517DEE"""
+"""5E78050767EFAC57_5E1961CE139A53C3_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""813D43B6E6517DEE"""
+"""542AC18D5DD99E46_830A38F7BD39A7B9_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""813D43B6E6517DEE"""
+"""94F16E6B1BF24694_1379DC8D24C42D6C_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""813D43B6E6517DEE"""
+"""D0B97C4A184A0A2F_36586C3EC4CBE3B7_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""813D43B6E6517DEE"""
+"""583A115BD01EC7E7_50A5DC7FED4252D7_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC=C(OCCC(C)C)C=C3""",21,"""813D43B6E6517DEE"""
+"""A9AE4620F201CEF7_ADC8BF691308C287_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC=C(C=C3)OC4CCCC4""",21,"""813D43B6E6517DEE"""
+"""87916CBFA64EF96F_2CFE6697A4F3AA53_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""813D43B6E6517DEE"""
+"""9F2A38E57B888250_598104A5DEDF0EE4_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""813D43B6E6517DEE"""
+"""160C1A3344B65A06_A666C32909DEF009_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""813D43B6E6517DEE"""
+"""F1B7793F87D7645C_51E12ADC22A7DD17_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""813D43B6E6517DEE"""
+"""AB49CE62A9C2864E_27EA04C0EACBDA7C_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""813D43B6E6517DEE"""
+"""C68062AE506DC4F9_E2DA95FA732FB303_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""813D43B6E6517DEE"""
+"""B52301E217BA70BC_88BEA0DC8C19B863_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""813D43B6E6517DEE"""
+"""491C33E5731BA26C_F98512A99D123690_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""813D43B6E6517DEE"""
+"""3D8A2B30E9E0979E_4B4EFEDC5F5B3FD2_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""813D43B6E6517DEE"""
+"""4E607C3045A0CD9F_3E806C5465F7AFE0_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""813D43B6E6517DEE"""
+"""57FCAA490E9C8E51_6D7C340D5B850EF1_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(C=CC=C3)CN4CCCC4""",21,"""813D43B6E6517DEE"""
+"""61539FAA8BFB43F3_F5A8648CE737ED4B_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""813D43B6E6517DEE"""
+"""A331BAEF00C3998B_FFAF4E8FBE4A09B6_6005_UN""","""C2(=C1C=CC=NC1=N[NH]2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""813D43B6E6517DEE"""
+"""9B110BA99477F305_809077CCD95E7F39_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=CC=C2)OC3CCCC3)C""",21,"""8160269828C586E5"""
+"""737353ADD6AC40A8_2FE78FE0224ED3C5_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=C(OCC)C=C2)OCC)C""",21,"""8160269828C586E5"""
+"""84A591336D90FDC0_D3E7F827BDA524EF_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=CC(=C2)OCCC(C)C)C""",21,"""8160269828C586E5"""
+"""A0DBDE8EFCC7F474_8FDD00712E8912EB_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=C(C=C2)C[N]3C=CN=C3)C""",21,"""8160269828C586E5"""
+"""B5AB3094BB52C041_BCF56FB0A9E7E443_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=C(C=C2)OC3CCOC3)C""",21,"""8160269828C586E5"""
+"""1DFF6A946A4F32E0_77148BC4719010B0_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=C(OC)C=C2)CN(C)C)C""",21,"""8160269828C586E5"""
+"""ED908C8F18DA3DD4_AF7BAFC825540138_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=CC(=C2)COCCOC)C""",21,"""8160269828C586E5"""
+"""A8A0549C54B433C9_261622C92BE80A54_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=CC(=C2)CN(C)C3CC3)C""",21,"""8160269828C586E5"""
+"""FE3C9BA4E2089367_390D362A1CA2ED31_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=CC(=C2)OC(COC)C)C""",21,"""8160269828C586E5"""
+"""3FB27313F646C528_6B4CCE1E97174D1D_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=C(C(NOC)=O)C=C2)F)C""",21,"""8160269828C586E5"""
+"""1F514C80418BB4BA_7EB5282A0C6AEC5F_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(OC)N=C(C=C2)C(F)(F)F)C""",21,"""8160269828C586E5"""
+"""E2D918C691D0163C_070E4706FB50D022_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=CC=C2)CN3CCCC3)C""",21,"""8160269828C586E5"""
+"""50A64EAB0A88B944_1E2A6304933C3FA2_6004_UN""","""CC1=C(N=C(C(=C1)N)C3=CC=C([N]2C=C(C)C=N2)C=C3)C""",21,"""8160269828C586E5"""
+"""3D31023C9686003E_63DE3CE6142A8ECB_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=CC(=C2)OCCN(C)C)C""",21,"""8160269828C586E5"""
+"""AF0C4B529FDB0F1A_9403F02485482DF0_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(C=C(C(C)C)C=C2)C(C)C)C""",21,"""8160269828C586E5"""
+"""97C214638F390838_A324C8A072222E44_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=C(C=C2)C3=CC=CC=C3)C""",21,"""8160269828C586E5"""
+"""0C5309C47624EE28_71E83624582D04F7_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(C=CC=C2F)OC(F)(F)F)C""",21,"""8160269828C586E5"""
+"""9D81878746851B87_A13DF8ACAD7730E4_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=C(C=C2)Cl)OC(F)(F)F)C""",21,"""8160269828C586E5"""
+"""BCD55E72697AC7E5_8EA8CCE3BE505221_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(C=C(OC)C=C2)C(F)(F)F)C""",21,"""8160269828C586E5"""
+"""DE2429DC9FDEDCBA_8B93324662608008_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=CC(=C2F)C(N(C)C)=O)C""",21,"""8160269828C586E5"""
+"""E188B1052FFA8500_4E6894B102E01C3C_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=C(OC)C=C2)C(F)(F)F)C""",21,"""8160269828C586E5"""
+"""0767C6D5FD3922F6_5E4404E0DD0EA8C8_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)C""",21,"""8160269828C586E5"""
+"""408EB7ABCF55C8FF_83575DD973AD5CB2_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=CC=C2)C3=CC=CC=C3)C""",21,"""8160269828C586E5"""
+"""79F7C0ACEAA03DEE_1324B9A3EA50D667_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(OC)C=C(C=C2)C(F)(F)F)C""",21,"""8160269828C586E5"""
+"""B0F217863EA891BF_360509100A5F18BC_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(C)C=C(C=C2)OC(F)(F)F)C""",21,"""8160269828C586E5"""
+"""A78C800D5996D0CD_50F8B95123D6A9DC_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=C(OCCC(C)C)C=C2)C""",21,"""8160269828C586E5"""
+"""9AB4051B513AE722_AD95DA47DD9C398C_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=C(C=C2)OC3CCCC3)C""",21,"""8160269828C586E5"""
+"""598F1119D3C8114D_2CA303B96A675158_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(C=C(OC)C=C2)CN(C)C)C""",21,"""8160269828C586E5"""
+"""947126E0AA62BF1D_59DC618B104BF5EF_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=C(N=C2)C(F)(F)F)OC)C""",21,"""8160269828C586E5"""
+"""6B65EE804CEA6028_A63BA607C74A0B02_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(C)C=C(C=C2)OCC3CC3)C""",21,"""8160269828C586E5"""
+"""BEA5EDF9A0B6EB17_51BC4FF2EC33261C_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(C=CC(=C2)C3(CC3)C#N)F)C""",21,"""8160269828C586E5"""
+"""C53D8A45EF42BA71_27B761EE245F2177_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(OCC(C)(C)C)N=CC=C2)C""",21,"""8160269828C586E5"""
+"""97121D352B06964C_E287F0D4BDBB4808_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC=C(C=C2)C[N]3C=NC=N3)C""",21,"""8160269828C586E5"""
+"""B36D0EA7D8E8E5E7_88E3C5F2428D4368_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(OCC)C=CC(=C2)[N](=O)=O)C""",21,"""8160269828C586E5"""
+"""299C89AC7E7012B2_F9D877875386CD9B_6004_UN""","""CC1=C(N=C(C(=C1)N)C3=CC2=C(C=C(OC)C=C2)C=C3)C""",21,"""8160269828C586E5"""
+"""44F09FE744370FAD_4B139BF291CFC4D9_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=C(C=C2C3CC3)Cl)OC)C""",21,"""8160269828C586E5"""
+"""ABD6D3DD5D7CA7BE_3EDD097AAB6354EB_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=CC=C2)C3=CC=NC=C3)C""",21,"""8160269828C586E5"""
+"""FEE4EBA305FEBC1B_6D2151239511F5FA_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(C=CC=C2)CN3CCCC3)C""",21,"""8160269828C586E5"""
+"""CC28236B1AAFAA9B_F5F501A229A31640_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=CC(=N[N]2C3CCCCO3)C)C""",21,"""8160269828C586E5"""
+"""6A221771C4603FF7_FFF22BA170DEF2BD_6004_UN""","""CC1=C(N=C(C(=C1)N)C2=C(C=C(C=C2)OC(F)(F)F)F)C""",21,"""8160269828C586E5"""
+"""57160AD876FB0627_7F7F4BB5D626CB25_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](CCN)(=O)=O)C3CC3""",21,"""81B7355A08DDA63D"""
+"""BEBBCE0F6498338B_E4069B3F7B85C48B_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C(C)C)[S](=O)(=O)CCN""",21,"""81B7355A08DDA63D"""
+"""1DC3E06F7E7D3BBC_B389778A95C5E7D7_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](C)(=O)=O)CCN=C=S""",21,"""81B7355A08DDA63D"""
+"""2C847D544D5CB3BE_AE9F7632DB6D9E1F_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](CC)(=O)=O)CCCN""",21,"""81B7355A08DDA63D"""
+"""1BE8FE2FE375658B_2440D3DF2DB9AB3E_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""81B7355A08DDA63D"""
+"""624526DFB58F17A1_629ADBD81D8C29BF_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(CCCN)[S](=O)(=O)CCl""",21,"""81B7355A08DDA63D"""
+"""BF7AEF47375D56D4_977B579ECF1EBCFE_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C)[S](=O)(=O)C3CNCC3""",21,"""81B7355A08DDA63D"""
+"""FDEFD98028529BE0_29235C8970F1193A_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](CC)(=O)=O)CCCBr""",21,"""81B7355A08DDA63D"""
+"""DE95134A8F40E739_9DF9DD89D5FF9AB4_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(CCCNC)[S](=O)(=O)C""",21,"""81B7355A08DDA63D"""
+"""0CB45C9026421D4F_7894D5EF5C3680EC_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""81B7355A08DDA63D"""
+"""AA16896F83AF4644_2ADFBFF400095324_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](=O)(=O)CC#N)C3CC3""",21,"""81B7355A08DDA63D"""
+"""6AEDF3FAAAC9F0A6_A90BD482E8AF1133_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](C)(=O)=O)C(=O)CCN""",21,"""81B7355A08DDA63D"""
+"""472EAF5DE1CFBEB9_6F0D83720CF1A5C0_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""81B7355A08DDA63D"""
+"""7038D4D6CE6339E9_CDABDEEB1CBEB781_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""81B7355A08DDA63D"""
+"""0A1C95223F82EFBD_00CC85A2C3F097DE_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""81B7355A08DDA63D"""
+"""77C60D3AB4A4119B_F4B12A150CF0C777_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""81B7355A08DDA63D"""
+"""13460383652381E9_FE45CD15908BFF71_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(CC(CC)N)[S](=O)(=O)C""",21,"""81B7355A08DDA63D"""
+"""F7FCD2C7947B009C_FC6B983492804F5A_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""81B7355A08DDA63D"""
+"""35B1FC33709E3D93_6FA98778487894BE_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""81B7355A08DDA63D"""
+"""6C31121839F85290_BF18B0DE4E05909A_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""81B7355A08DDA63D"""
+"""B67CD59C0460E7CA_F517D76FD9CB1717_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""81B7355A08DDA63D"""
+"""410378ECBB8DD564_192A490DD3E1B318_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""81B7355A08DDA63D"""
+"""1A27711BD6A4D7C5_10C7FD6978B49EA2_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](=O)(=O)C3CC3)CC#C""",21,"""81B7355A08DDA63D"""
+"""05C96CEC8580093F_44C7E7E29FBA5B64_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""81B7355A08DDA63D"""
+"""9F9EBC40CAABE608_6CACA81FBABE178C_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""81B7355A08DDA63D"""
+"""0117895BB2989C56_A785534B3378DC9F_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N3CCCC(CC)[S]3(=O)=O""",21,"""81B7355A08DDA63D"""
+"""E459BBA927AFD179_96EC239156C16A30_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""81B7355A08DDA63D"""
+"""631703C1A9892EB9_49F2443F2CC9531E_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""81B7355A08DDA63D"""
+"""F3581ECC10926219_E2CA8AA6F859CE32_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""81B7355A08DDA63D"""
+"""5C43203302F73809_A2A63AF6FD63178C_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""81B7355A08DDA63D"""
+"""7497F2F148E67E96_0AE9A022067E08E4_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N3[S](CCN(C)CC3)(=O)=O""",21,"""81B7355A08DDA63D"""
+"""9F6D56AD92D554C6_867E86AF6ED7E307_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N3CC(=O)NCC[S]3(=O)=O""",21,"""81B7355A08DDA63D"""
+"""283AA069D903408A_D3859BA6C3722493_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N3[S](CCCCC3C)(=O)=O""",21,"""81B7355A08DDA63D"""
+"""3478B2C261232B18_A92DDE6A6D92CB6D_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(CCN)[S](=O)(=O)C3CC3""",21,"""81B7355A08DDA63D"""
+"""83C90B0DF15BCEF5_CFD7F8ABC9BE599A_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(CCN)[S](=O)(=O)C(F)F""",21,"""81B7355A08DDA63D"""
+"""111A4313C971A995_6FD264CEF7B5A778_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N([S](CC)(=O)=O)C3CNC3""",21,"""81B7355A08DDA63D"""
+"""601C2850611D0410_5D4BB0F2605CF305_6036_DP""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""81B7355A08DDA63D"""
+"""3D6FB86B2A0BB01D_E73EC960B99FB76F_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""81B7355A08DDA63D"""
+"""8157914153CD7B16_1BD55130B0FDA7DF_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""81B7355A08DDA63D"""
+"""D47B3B4E6B35116F_25B436877DC36F44_6036_UN""","""C(C2=NC1=C(C=C(C=N1)Br)[NH]2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""81B7355A08DDA63D"""
+"""99AC063CFDD9AF90_83D799F85D33F70B_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=CC=C2)OC3CCCC3""",21,"""8227C8ACACA80ED7"""
+"""B6902EC93AA6A6E3_2CA061D4A6235BF7_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=C(OCC)C=C2)OCC""",21,"""8227C8ACACA80ED7"""
+"""CDC89A2B1D36BA68_D0A0161339C8ACDD_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=CC(=C2)OCCC(C)C""",21,"""8227C8ACACA80ED7"""
+"""0D0B012C6EFC6F77_8C9AEE45AAE49AD9_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""8227C8ACACA80ED7"""
+"""EE718B9A5445B39B_BFB281842D8A6C71_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=C(C=C2)OC3CCOC3""",21,"""8227C8ACACA80ED7"""
+"""F2F7AC555357A338_745365F0F5FD9882_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=C(OC)C=C2)CN(C)C""",21,"""8227C8ACACA80ED7"""
+"""F17AD9A248956523_AC3C41FCA139890A_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=CC(=C2)COCCOC""",21,"""8227C8ACACA80ED7"""
+"""440DA488C3A16B52_2551CCFDAF858266_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=CC(=C2)CN(C)C3CC3""",21,"""8227C8ACACA80ED7"""
+"""2FB453A2DEF8151C_3A4AD81E98CF6503_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=CC(=C2)OC(COC)C""",21,"""8227C8ACACA80ED7"""
+"""A2EEF4D7FC02A312_680B202A137AC52F_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""8227C8ACACA80ED7"""
+"""0CD720E0C5B0966A_7DF2C61E8807646D_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""8227C8ACACA80ED7"""
+"""C03A958B9E1959EA_0449A9327F3D5810_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=CC=C2)CN3CCCC3""",21,"""8227C8ACACA80ED7"""
+"""34A199AE6348ADEF_1D6D8D301751B790_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""8227C8ACACA80ED7"""
+"""5CB590CA33686BB4_6099D2D2904706F9_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=CC(=C2)OCCN(C)C""",21,"""8227C8ACACA80ED7"""
+"""207104AFD40C8149_97441E100125A5C2_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""8227C8ACACA80ED7"""
+"""8BED02A0BECE2E93_A0632694F64FA676_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""8227C8ACACA80ED7"""
+"""433356CDB164DCFA_72AFD810DC408CC5_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(C=CC=C2F)OC(F)(F)F""",21,"""8227C8ACACA80ED7"""
+"""D6883C1C7DE5AB68_A27A1698291AB8D6_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""8227C8ACACA80ED7"""
+"""073C7FB86D2D94B7_8DEF22D73A3DDA13_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""8227C8ACACA80ED7"""
+"""F9BE3323A6F32F9C_88D4DC72E60D083A_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""8227C8ACACA80ED7"""
+"""C896261632408D72_4D2F7A85868D940E_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""8227C8ACACA80ED7"""
+"""4F5C546DFDD37824_5D03EAD4596320FA_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""8227C8ACACA80ED7"""
+"""8F5C85B06494E43B_8010B3EDF7C0D480_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""8227C8ACACA80ED7"""
+"""2136FB8648A7BD47_106357976E3D5E55_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""8227C8ACACA80ED7"""
+"""ABDBCB5457778B11_3542E7248E32908E_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""8227C8ACACA80ED7"""
+"""8F8E4419347108FA_53BF5765A7BB21EE_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=C(OCCC(C)C)C=C2""",21,"""8227C8ACACA80ED7"""
+"""61A54F36B34B1E2F_AED2347359F1B1BE_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=C(C=C2)OC3CCCC3""",21,"""8227C8ACACA80ED7"""
+"""FA0B47D9AD1AB058_2FE4ED8DEE0AD96A_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(C=C(OC)C=C2)CN(C)C""",21,"""8227C8ACACA80ED7"""
+"""7FB19DCB72FCF870_5A9B8FBF94267DDD_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""8227C8ACACA80ED7"""
+"""C35A248B490860A0_A57C483343278330_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(C)C=C(C=C2)OCC3CC3""",21,"""8227C8ACACA80ED7"""
+"""CE44989D7B8B1543_52FBA1C6685EAE2E_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""8227C8ACACA80ED7"""
+"""8E32E07A671395C7_24F08FDAA032A945_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(OCC(C)(C)C)N=CC=C2""",21,"""8227C8ACACA80ED7"""
+"""895C7CA53B60D347_E1C01EE039D6C03A_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""8227C8ACACA80ED7"""
+"""126AAB6DD1A9FE90_8BA42BC6C6E0CB5A_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""8227C8ACACA80ED7"""
+"""7725A2B5BAC5C8E9_FA9F99B3D7EB45A9_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""8227C8ACACA80ED7"""
+"""C6FD4B66F30EA855_485475C615A24CEB_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""8227C8ACACA80ED7"""
+"""47F2928C5823D3F9_3D9AE74E2F0EDCD9_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""8227C8ACACA80ED7"""
+"""012913664B0B9C8E_6E66BF17117C7DC8_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(C=CC=C2)CN3CCCC3""",21,"""8227C8ACACA80ED7"""
+"""39C2D500B7F5DC71_F6B2EF96ADCE9E72_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=CC(=N[N]2C3CCCCO3)C""",21,"""8227C8ACACA80ED7"""
+"""E8217A55F56E4943_FCB5C595F4B37A8F_6004_UN""","""Cl[S](=O)(=O)C1=COC=C1C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""8227C8ACACA80ED7"""
+"""2D3B8A8646876045_099CE72FB6414B94_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CN=C(OC)C=C3)=O""",21,"""82A71F551DAD4CF3"""
+"""E0B18994F0730D71_0B4D854E4492BEA5_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CC(=C(N=C3)O)C)=O""",21,"""82A71F551DAD4CF3"""
+"""991CEC32681BCB65_D74B4ED034F762E9_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C=CC=C3F)F)=O""",21,"""82A71F551DAD4CF3"""
+"""A3322F0638203DEB_FB6C4B97F77626CC_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C=CC(=C3)C)C)=O""",21,"""82A71F551DAD4CF3"""
+"""9FFB58B138146E5E_ADB9E517C1F3C430_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CC=C(SC)C=C3)=O""",21,"""82A71F551DAD4CF3"""
+"""09408318A4A6B21A_4A56B3D6EF6533D4_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C(=CC=C3)Cl)Cl)=O""",21,"""82A71F551DAD4CF3"""
+"""3070D26482E80564_FDD065565C33E638_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(N=C(C=C3)O)F)=O""",21,"""82A71F551DAD4CF3"""
+"""B087B4FE13CFBBB4_BA63915F6A0D5D86_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C)C=NC(=C3)F)=O""",21,"""82A71F551DAD4CF3"""
+"""81340C1AE6F1633C_D006DEEDECF8668A_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CC(=C(C=C3)F)F)=O""",21,"""82A71F551DAD4CF3"""
+"""FC6E228E2D473A01_F9BF9FF74A1BE85C_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CC(=C(C)C=C3)C)=O""",21,"""82A71F551DAD4CF3"""
+"""AC9CAB32A0993862_29ADF88E3E983230_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(SC)C=CC=C3)=O""",21,"""82A71F551DAD4CF3"""
+"""DFB795E4B8DD0734_83D6EA2AF6DAB0A4_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C)C=CC=C3C)=O""",21,"""82A71F551DAD4CF3"""
+"""1FFFA970259EF9A0_0CA65EC1EF64726D_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C)C(=NC=C3)F)=O""",21,"""82A71F551DAD4CF3"""
+"""4C6198D4EE8D0CB3_332FDB7125C4FCB5_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CSC=C3C(F)F)=O""",21,"""82A71F551DAD4CF3"""
+"""FE60D2CFB70E074E_10AECA267F243ED2_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C(=CC=C3)Cl)F)=O""",21,"""82A71F551DAD4CF3"""
+"""4DB9AA266FC77DF6_D5AC99B9E251C5A7_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CC(=C(C=C3)F)Cl)=O""",21,"""82A71F551DAD4CF3"""
+"""5B55983E79A65D42_9446EABE3DC3D391_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CC(=CC=C3)CF)=O""",21,"""82A71F551DAD4CF3"""
+"""02633897FA620079_857AC074657FCFE5_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CC=C(C=C3)CF)=O""",21,"""82A71F551DAD4CF3"""
+"""BF91C20F3871C796_E2589FF084EE7053_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C)C=C(C=C3)F)=O""",21,"""82A71F551DAD4CF3"""
+"""9BD7167DFA7D1235_5126BB0F38DD3610_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(CC)C=CC=C3)=O""",21,"""82A71F551DAD4CF3"""
+"""1B02328501A7D9D9_836255268AF072CC_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C=CC(=C3)F)F)=O""",21,"""82A71F551DAD4CF3"""
+"""93DB37F1D6E5C99E_2EE28E72D6DDD033_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(OC)N=CC=C3)=O""",21,"""82A71F551DAD4CF3"""
+"""F72E0BC604EB36FD_435DE595D27FD2A5_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CC(=NC=C3)OC)=O""",21,"""82A71F551DAD4CF3"""
+"""D3A0005056DF0D23_24FC2EC449732975_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C=C(C)C=C3)F)=O""",21,"""82A71F551DAD4CF3"""
+"""DFAFB64A77970F2F_0FEA49F437E3DA28_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C(=CC=C3)Br)F)=O""",21,"""82A71F551DAD4CF3"""
+"""3930E6125624F104_1B2D1EBBF3083A6B_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C=C(C)C=C3)C)=O""",21,"""82A71F551DAD4CF3"""
+"""8AFB55ED9E73DC4B_A3526848669104FA_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CC=CC(=C3)CC)=O""",21,"""82A71F551DAD4CF3"""
+"""5A3EF3B31CE3F594_614A3415B9492877_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C([N](C)N=C3)C#N)=O""",21,"""82A71F551DAD4CF3"""
+"""4896AB637A9BDDE4_876CB12ED9E5E2E8_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=C(C)C=CC(=C3)F)=O""",21,"""82A71F551DAD4CF3"""
+"""7FB06C9F31737D2F_82E738EE5CF8B274_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CC(=C(C=C3)Cl)F)=O""",21,"""82A71F551DAD4CF3"""
+"""F8AB94374BCE1445_9EDAD3EB30094B85_6006_UN""","""COC2=C1CCCC(C1=C(C=C2)C3=CN=C(NC)C=C3)=O""",21,"""82A71F551DAD4CF3"""
+"""C547F0E76A1A9DB2_22A20FB0F8CD45D4_2201_UN""","""COC3=C2CCC1=CC4=C(N=C1C2=C(C=C3)Cl)N=CC=C4""",21,"""82A71F551DAD4CF3"""
+"""10172CF7BAD522EE_943FF29B9CBA923D_2201_UN""","""COC3=C2CCC1=CC4=C(N=C1C2=C(C=C3)Cl)C=CN=C4""",21,"""82A71F551DAD4CF3"""
+"""2D340E5BA92102D0_4E73BA1EEF656B4E_2201_UN""","""COC4=C3CCC2=C(C)C1=NON=C1N=C2C3=C(C=C4)Cl""",21,"""82A71F551DAD4CF3"""
+"""9EEECDDBD397D44E_A3978B5402422A77_2201_UN""","""COC4=C3CCC2=C(C)C1=C(SC=C1)N=C2C3=C(C=C4)Cl""",21,"""82A71F551DAD4CF3"""
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+"""A694569A2D303942_5A74D715A06C39FB_6005_UN""","""OC(=O)C1=C(C=C(S1)Br)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""82C8900698E24AF1"""
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+"""5CC040F9BF8D952B_E12F464A0D9C841C_6005_UN""","""OC(=O)C1=C(C=C(S1)Br)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""82C8900698E24AF1"""
+"""5F60A7682714202D_8B4B736CF2AA8F7C_6005_UN""","""OC(=O)C1=C(C=C(S1)Br)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""82C8900698E24AF1"""
+"""A38AE21EC0D07C24_FA70C119E3A1018F_6005_UN""","""OC(=O)C1=C(C=C(S1)Br)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""82C8900698E24AF1"""
+"""60121AD98B996B98_48BB2D6C21E808CD_6005_UN""","""OC(=O)C1=C(C=C(S1)Br)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""82C8900698E24AF1"""
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+"""F104BF1366357EDC_6E89E7BD253639EE_6005_UN""","""OC(=O)C1=C(C=C(S1)Br)C2=C(C=CC=C2)CN3CCCC3""",21,"""82C8900698E24AF1"""
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+"""F16AEF154C576606_FC5A9D3FC0F93EA9_6005_UN""","""OC(=O)C1=C(C=C(S1)Br)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""82C8900698E24AF1"""
+"""A604443E2F4FB0D4_82A600251356E1C3_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""83565171E2CD181F"""
+"""B2BB1F8FB369FB98_2DD1F809E8464D3F_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""83565171E2CD181F"""
+"""2F738FA0B2382277_D1D18FCE77ADBA15_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""83565171E2CD181F"""
+"""521EF3ADA35A0C89_8DEB7798E4818C11_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""83565171E2CD181F"""
+"""BEF7080956C35F4C_BEC3185963EF7AB9_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""83565171E2CD181F"""
+"""2BF148AA6C9D4B29_7522FC2DBB988E4A_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""83565171E2CD181F"""
+"""0CA41DB1A8E68C27_AD4DD821EF5C9FC2_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=CC(=C2)COCCOC""",21,"""83565171E2CD181F"""
+"""F3A44999F92792A0_24205520E1E094AE_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""83565171E2CD181F"""
+"""A9CD59BB0AD41742_3B3B41C3D6AA73CB_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""83565171E2CD181F"""
+"""1BCFBEABBDDD7A0F_697AB9F75D1FD3E7_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""83565171E2CD181F"""
+"""3F7542980D7D6E4C_7C835FC3C66272A5_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""83565171E2CD181F"""
+"""4BEAA4FADE10BC38_053830EF31584ED8_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""83565171E2CD181F"""
+"""762C58CDF1A59BFB_1C1C14ED5934A158_6005_UN""","""OC(=O)C1=CC(=CC=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""83565171E2CD181F"""
+"""C0ADE96E24AFDBEB_61E84B0FDE221031_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""83565171E2CD181F"""
+"""42BDC6B6A93647EB_963587CD4F40B30A_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""83565171E2CD181F"""
+"""CF36860DD9688087_A112BF49B82AB0BE_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""83565171E2CD181F"""
+"""23EC61F999F35B35_73DE41CD92259A0D_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""83565171E2CD181F"""
+"""5743D0C06C9D0CC8_A30B8F45677FAE1E_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""83565171E2CD181F"""
+"""F9F16DAB9FDCEC4C_8C9EBB0A7458CCDB_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""83565171E2CD181F"""
+"""C29DEBD42DD21150_89A545AFA8681EF2_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""83565171E2CD181F"""
+"""C69A435BCBB5E907_4C5EE358C8E882C6_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""83565171E2CD181F"""
+"""C019E69A6765D884_5C72730917063632_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""83565171E2CD181F"""
+"""EE2CA595D9141E27_81612A30B9A5C248_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""83565171E2CD181F"""
+"""5764E25E13762A50_1112CE4A2058489D_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""83565171E2CD181F"""
+"""CBD29EE314A0A96C_34337EF9C0578646_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""83565171E2CD181F"""
+"""B414DE7AD94F50FB_52CECEB8E9DE3726_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""83565171E2CD181F"""
+"""5B1B561C23D7FAC5_AFA3ADAE1794A776_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""83565171E2CD181F"""
+"""40AA984C5ABB717A_2E957450A06FCFA2_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""83565171E2CD181F"""
+"""1507EF1E99191808_5BEA1662DA436B15_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""83565171E2CD181F"""
+"""358CB503B5011171_A40DD1EE0D4295F8_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""83565171E2CD181F"""
+"""C48FA597072CF4BB_538A381B263BB8E6_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""83565171E2CD181F"""
+"""218E719FC1783788_25811607EE57BF8D_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""83565171E2CD181F"""
+"""8707F05B94AA609A_E0B1873D77B3D6F2_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""83565171E2CD181F"""
+"""5C333C52DDC22241_8AD5B21B8885DD92_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""83565171E2CD181F"""
+"""7FF21572412D385D_FBEE006E998E5361_6005_UN""","""OC(=O)C1=CC(=CC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""83565171E2CD181F"""
+"""9CB97C1C0E1690C0_4925EC1B5BC75A23_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""83565171E2CD181F"""
+"""EC58899AEA0D18D6_3CEB7E93616BCA11_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""83565171E2CD181F"""
+"""BED40D8FA35FC483_6F1726CA5F196B00_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""83565171E2CD181F"""
+"""E0A873C0A07848EA_F7C3764BE3AB88BA_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""83565171E2CD181F"""
+"""12A054F83ED217CF_FDC45C48BAD66C47_6005_UN""","""OC(=O)C1=CC(=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""83565171E2CD181F"""
+"""C0C4EA08F809DE7E_7D27144080E3E63C_6036_UN""","""C(CCNCC1=CN=CC=C1)N([S](CCN)(=O)=O)C2CC2""",21,"""83EF6AAF5E188B24"""
+"""115CC421F945E0A3_E65EC4CA2D40E992_6036_UN""","""C(CCNCC1=CN=CC=C1)N(C(C)C)[S](=O)(=O)CCN""",21,"""83EF6AAF5E188B24"""
+"""9C5ECC0125B4BFD8_B1D1287FC300CACE_6036_UN""","""C(CCNCC1=CN=CC=C1)N([S](C)(=O)=O)CCN=C=S""",21,"""83EF6AAF5E188B24"""
+"""EAA6AF76858AD5C8_ACC729C78DA8B306_6036_UN""","""C(CCNCC1=CN=CC=C1)N([S](CC)(=O)=O)CCCN""",21,"""83EF6AAF5E188B24"""
+"""842D825DE1A6453A_26188C2A7B7C8627_6036_UN""","""C(CCNCC1=CN=CC=C1)N([S](C)(=O)=O)C2CC(C2)N""",21,"""83EF6AAF5E188B24"""
+"""8BB6C9A756E79B50_60C2842D4B4904A6_6036_UN""","""C(CCNCC1=CN=CC=C1)N(CCCN)[S](=O)(=O)CCl""",21,"""83EF6AAF5E188B24"""
+"""A1198C7F010E011E_9523086B99DB91E7_6036_UN""","""C(CCNCC1=CN=CC=C1)N(C)[S](=O)(=O)C2CNCC2""",21,"""83EF6AAF5E188B24"""
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+"""1BDC1EE32BC63180_2276BA13B642A01B_6005_UN""","""C[C@H](O)C1=CC=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""84A1FD65BAD80789"""
+"""EE52F110923203BA_E7462B292FA6C964_6005_UN""","""C[C@H](O)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""84A1FD65BAD80789"""
+"""BCB75D959BE19F55_8D221E0FD090C204_6005_UN""","""C[C@H](O)C1=CC=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""84A1FD65BAD80789"""
+"""F3B45F1682ACAD6E_FC19AC7AC19B4CF7_6005_UN""","""C[C@H](O)C1=CC=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""84A1FD65BAD80789"""
+"""77AE6B01E9781763_4ED2400F03D245B5_6005_UN""","""C[C@H](O)C1=CC=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""84A1FD65BAD80789"""
+"""C30FEA7C6D569135_3B1CD287397ED587_6005_UN""","""C[C@H](O)C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""84A1FD65BAD80789"""
+"""5055D7927A92E676_68E08ADE070C7496_6005_UN""","""C[C@H](O)C1=CC=C(C=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""84A1FD65BAD80789"""
+"""74DAEAC7864829D8_F034DA5FBBBE972C_6005_UN""","""C[C@H](O)C1=CC=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""84A1FD65BAD80789"""
+"""884ED880DDE7903B_FA33F05CE2C373D1_6005_UN""","""C[C@H](O)C1=CC=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""84A1FD65BAD80789"""
+"""6EADD15A5BBCEA46_0E084A3F9D93526A_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CN=C(OC)C=C3""",21,"""8533B245367F550D"""
+"""BCF6B6FDA77EB844_0CD9285E6F40A75B_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CC(=C(N=C3)O)C""",21,"""8533B245367F550D"""
+"""FB6C0DB2F0C4B280_D0DFE3C01F257B17_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C=CC=C3F)F""",21,"""8533B245367F550D"""
+"""C0AF6091990765D0_FCF8E687DCA43F32_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C=CC(=C3)C)C""",21,"""8533B245367F550D"""
+"""A0A05CC865F45B1A_AA2D4807EA21DDCE_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CC=C(SC)C=C3""",21,"""8533B245367F550D"""
+"""CAA510D6CA4A0810_4DC21EC6C4B72A2A_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C(=CC=C3)Cl)Cl""",21,"""8533B245367F550D"""
+"""45C48FF1C21FCF43_FA44C84677E1FFC6_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(N=C(C=C3)O)F""",21,"""8533B245367F550D"""
+"""887013F9B510764C_BDF73C4F41DF4478_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C)C=NC(=C3)F""",21,"""8533B245367F550D"""
+"""262AA5838FB3DB56_D79273FDC72A7F74_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CC(=C(C=C3)F)F""",21,"""8533B245367F550D"""
+"""C3C9566247D788BC_FE2B32E761C9F1A2_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CC(=C(C)C=C3)C""",21,"""8533B245367F550D"""
+"""423FE2D8DC504806_2E39559E154A2BCE_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(SC)C=CC=C3""",21,"""8533B245367F550D"""
+"""8233F99E0707FA7D_8442473ADD08A95A_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C)C=CC=C3C""",21,"""8533B245367F550D"""
+"""D2126AF2AF925696_0B32F3D1C4B66B93_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C)C(=NC=C3)F""",21,"""8533B245367F550D"""
+"""CC195EE2A1F7190E_34BB76610E16E54B_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CSC=C3C(F)F""",21,"""8533B245367F550D"""
+"""0D960772A798B604_173A673654F6272C_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C(=CC=C3)Cl)F""",21,"""8533B245367F550D"""
+"""AD34B87DD4B52349_D23834A9C983DC59_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CC(=C(C=C3)F)Cl""",21,"""8533B245367F550D"""
+"""AA71999E079BC032_93D247AE1611CA6F_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CC(=CC=C3)CF""",21,"""8533B245367F550D"""
+"""581394D8D25262D9_82EE6D644EADD61B_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CC=C(C=C3)CF""",21,"""8533B245367F550D"""
+"""20B3BB69356C63D5_E5CC32E0AF3C69AD_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C)C=C(C=C3)F""",21,"""8533B245367F550D"""
+"""2FB4525513B0FA53_56B2161F130F2FEE_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(CC)C=CC=C3""",21,"""8533B245367F550D"""
+"""D5B5337340A8E74D_84F6F836A1226B32_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C=CC(=C3)F)F""",21,"""8533B245367F550D"""
+"""2A8DCEFB0C4CA3A5_29762362FD0FC9CD_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(OC)N=CC=C3""",21,"""8533B245367F550D"""
+"""AAADC6871A115627_44C94885F9ADCB5B_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CC(=NC=C3)OC""",21,"""8533B245367F550D"""
+"""C031492B84EF2DCF_236883D462A1308B_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C=C(C)C=C3)F""",21,"""8533B245367F550D"""
+"""2A9748B3331E1B08_087EE4E41C31C3D6_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C(=CC=C3)Br)F""",21,"""8533B245367F550D"""
+"""0CC5BE168ED68FA0_1CB9B3ABD8DA2395_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C=C(C)C=C3)C""",21,"""8533B245367F550D"""
+"""8E8299C769CD6E52_A4C6C5584D431D04_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CC=CC(=C3)CC""",21,"""8533B245367F550D"""
+"""21F63AAD9AF6B91E_66DE9905929B3189_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C([N](C)N=C3)C#N""",21,"""8533B245367F550D"""
+"""2D86C0AC813D3B82_80F81C3EF237FB16_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=C(C)C=CC(=C3)F""",21,"""8533B245367F550D"""
+"""95721929ACD6A99E_857395FE772AAB8A_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CC(=C(C=C3)Cl)F""",21,"""8533B245367F550D"""
+"""82BF701B567E14FB_994E7EFB1BDB527B_6006_UN""","""C1(=CC2=C(C=C1)[S](CCC2=O)(=O)=O)C3=CN=C(NC)C=C3""",21,"""8533B245367F550D"""
+"""CF168786A965E148_2536A2A0D31F5C2A_2201_UN""","""ClC1=CC2=C(C=C1)[S](CC3=CC4=C(N=C23)N=CC=C4)(=O)=O""",21,"""8533B245367F550D"""
+"""9BF3B798426A1511_93AB5F8BB7688BC3_2201_UN""","""ClC1=CC2=C(C=C1)[S](CC3=CC4=C(N=C23)C=CN=C4)(=O)=O""",21,"""8533B245367F550D"""
+"""E494FDD0B24C875F_49E7170EC4B772B0_2201_UN""","""ClC1=CC3=C(C=C1)[S](CC4=C(C)C2=NON=C2N=C34)(=O)=O""",21,"""8533B245367F550D"""
+"""E0C121FFF8187486_A403264429903389_2201_UN""","""ClC1=CC3=C(C=C1)[S](CC4=C(C)C2=C(SC=C2)N=C34)(=O)=O""",21,"""8533B245367F550D"""
+"""2BBB2E3EACB372C9_AC3EDCFBCAE0A267_2201_UN""","""ClC1=CC3=C(C=C1)[S](CC4=CC2=C([N](C)N=C2)N=C34)(=O)=O""",21,"""8533B245367F550D"""
+"""FE713FD466730D61_50B901B42D715CB2_2201_UN""","""ClC1=CC2=C(C=C1)[S](CC3=CC4=C(N=C23)C=NC=C4)(=O)=O""",21,"""8533B245367F550D"""
+"""B34498A263556761_8FE6DC4CE2FE3CA5_2201_UN""","""ClC1=CC3=C(C=C1)[S](CC4=CC2=C(ON=C2C)N=C34)(=O)=O""",21,"""8533B245367F550D"""
+"""66506E3D175554EF_C9381E3FFE021F6A_2201_UN""","""ClC1=CC3=C(C=C1)[S](CC4=CC2=C(C)[NH]N=C2N=C34)(=O)=O""",21,"""8533B245367F550D"""
+"""41979CA0265F6440_5B9E8D8AB42B5D89_2201_UN""","""ClC1=CC2=C(C=C1)[S](CC3=CC4=C(N=C23)N=CN=C4)(=O)=O""",21,"""8533B245367F550D"""
+"""2BEAEA700C760C4E_846892384A6696F6_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=CC=C2)OC3CCCC3""",21,"""8598C36CBBFD6F2A"""
+"""FDD57608954CF2F1_2B1F6A14B1763A0A_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=C(OCC)C=C2)OCC""",21,"""8598C36CBBFD6F2A"""
+"""4E36D018641FE88E_D71F1DD32E9DCD20_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=CC(=C2)OCCC(C)C""",21,"""8598C36CBBFD6F2A"""
+"""CC853FA1BB9DEAF1_8B25E585BDB1FB24_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""8598C36CBBFD6F2A"""
+"""712FF67EB53CE761_B80D8A443ADF0D8C_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=C(C=C2)OC3CCOC3""",21,"""8598C36CBBFD6F2A"""
+"""0F3BCBE196D62BBA_73EC6E30E2A8F97F_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""8598C36CBBFD6F2A"""
+"""0F5B6D40E3528B2D_AB834A3CB66CE8F7_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=CC(=C2)COCCOC""",21,"""8598C36CBBFD6F2A"""
+"""E2B728944E8C92AA_22EEC73DB8D0E39B_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""8598C36CBBFD6F2A"""
+"""C40B4B5263B92A7E_3DF5D3DE8F9A04FE_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=CC(=C2)OC(COC)C""",21,"""8598C36CBBFD6F2A"""
+"""29860071D38413BE_6FB42BEA042FA4D2_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""8598C36CBBFD6F2A"""
+"""86A39B80B5E416EC_7A4DCDDE9F520590_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""8598C36CBBFD6F2A"""
+"""EF19ACEEF5000AE3_03F6A2F2686839ED_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=CC=C2)CN3CCCC3""",21,"""8598C36CBBFD6F2A"""
+"""969A15F4E4E6ACB9_1AD286F00004D66D_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""8598C36CBBFD6F2A"""
+"""CDDA93F402FE5C6D_6726D91287126704_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=CC(=C2)OCCN(C)C""",21,"""8598C36CBBFD6F2A"""
+"""4FD6D61FF0B13055_90FB15D01670C43F_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""8598C36CBBFD6F2A"""
+"""8ACBF910BFE7EF1C_A7DC2D54E11AC78B_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""8598C36CBBFD6F2A"""
+"""8DCB9B09294CF7D3_7510D3D0CB15ED38_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""8598C36CBBFD6F2A"""
+"""20A8B69C8E4D5E5F_A5C51D583E4FD92B_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""8598C36CBBFD6F2A"""
+"""3FEB83D2A9CEF23B_8A5029172D68BBEE_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""8598C36CBBFD6F2A"""
+"""5AD9CCDAB3E28397_8F6BD7B2F15869C7_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""8598C36CBBFD6F2A"""
+"""B474BB4240B96C47_4A90714591D8F5F3_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""8598C36CBBFD6F2A"""
+"""BF0AF31A0DDF2A79_5ABCE1144E364107_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""8598C36CBBFD6F2A"""
+"""8863C10C675BCB5D_87AFB82DE095B57D_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""8598C36CBBFD6F2A"""
+"""992B75DFC3509D60_17DC5C5779683FA8_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""8598C36CBBFD6F2A"""
+"""7DBA7CE766CCD843_32FDECE49967F173_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""8598C36CBBFD6F2A"""
+"""E45AE2E7443DB7E2_54005CA5B0EE4013_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=C(OCCC(C)C)C=C2""",21,"""8598C36CBBFD6F2A"""
+"""9CAC781D6C94862F_A96D3FB34EA4D043_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=C(C=C2)OC3CCCC3""",21,"""8598C36CBBFD6F2A"""
+"""6034EE3E98AABDB1_285BE64DF95FB897_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""8598C36CBBFD6F2A"""
+"""DA004A4FB0364F98_5D24847F83731C20_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""8598C36CBBFD6F2A"""
+"""5DDD32E21671EF87_A2C343F35472E2CD_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""8598C36CBBFD6F2A"""
+"""B3EC26E4580E13AC_5544AA067F0BCFD3_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""8598C36CBBFD6F2A"""
+"""CC3403E18A047A2D_234F841AB767C8B8_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""8598C36CBBFD6F2A"""
+"""3E76A38D52A27DE4_E67F15202E83A1C7_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""8598C36CBBFD6F2A"""
+"""C5B1345EADD6CC1E_8C1B2006D1B5AAA7_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""8598C36CBBFD6F2A"""
+"""D966C5A2BC268315_FD209273C0BE2454_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""8598C36CBBFD6F2A"""
+"""B559F2DD78EE50AE_4FEB7E0602F72D16_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""8598C36CBBFD6F2A"""
+"""55EE2B5B4CF77A31_3A25EC8E385BBD24_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""8598C36CBBFD6F2A"""
+"""BA356B7705739B04_69D9B4D706291C35_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(C=CC=C2)CN3CCCC3""",21,"""8598C36CBBFD6F2A"""
+"""700C65318E9D3B8E_F10DE456BA9BFF8F_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=CC(=N[N]2C3CCCCO3)C""",21,"""8598C36CBBFD6F2A"""
+"""863983826B80221B_FB0ACE55E3E61B72_6005_UN""","""FC1=C(C(=CC(=C1)Br)Br)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""8598C36CBBFD6F2A"""
+"""161D9B9CCAFE6561_87F0F9BA6BD69972_6005_UN""","""C[C@H](N)C1=CC=C(C=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""8600A8EE9A4D60AE"""
+"""80C3136382333BC2_2887019690C6358E_6005_UN""","""C[C@H](N)C1=CC=C(C=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""8600A8EE9A4D60AE"""
+"""C24D2086F89D1DDD_D48776510F2DC2A4_6005_UN""","""C[C@H](N)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""8600A8EE9A4D60AE"""
+"""1077C53D91A44846_88BD8E079C01F4A0_6005_UN""","""C[C@H](N)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""8600A8EE9A4D60AE"""
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+"""955AB4549E9C2C32_6D1536FA7EE8CA3B_6005_UN""","""CN(C)C1=C(C=CC=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""8739DE7CC13A01C3"""
+"""D73B9CAD4B1FF6F4_78ECD0CEE5956B79_6005_UN""","""CN(C)C1=C(C=CC=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""8739DE7CC13A01C3"""
+"""6465F617D8BFF239_0157BFE212AF5704_6005_UN""","""CN(C)C1=C(C=CC=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""8739DE7CC13A01C3"""
+"""747EB42FE2F0B3E1_18739BE07AC3B884_6005_UN""","""CN(C)C1=C(C=CC=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""8739DE7CC13A01C3"""
+"""D8CC851985E7176D_6587C402FDD509ED_6005_UN""","""CN(C)C1=C(C=CC=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""8739DE7CC13A01C3"""
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+"""AE8082074A612970_58821C8A4BF53CD0_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=CC=C(OCCC(C)C)C=C2""",21,"""891A834340E613E9"""
+"""B0FCFD0DF7570371_A5EF7F9CB5BFAC80_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=CC=C(C=C2)OC3CCCC3""",21,"""891A834340E613E9"""
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+"""A9AACB873A9AB993_51A6C450786860E3_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""891A834340E613E9"""
+"""614E69635D0D2BC8_AE4103DCAF699E0E_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""891A834340E613E9"""
+"""304C67609BD9E323_59C6EA298410B310_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""891A834340E613E9"""
+"""04E59D60C657C2F4_2FCDC4354C7CB47B_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""891A834340E613E9"""
+"""192EF2CC00AFFED5_EAFD550FD598DD04_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""891A834340E613E9"""
+"""2290A6101B9CCE24_809960292AAED664_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""891A834340E613E9"""
+"""B01E681275B484E9_F1A2D25C3BA55897_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""891A834340E613E9"""
+"""4E792C42882996B2_43693E29F9EC51D5_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""891A834340E613E9"""
+"""4D9C8A9D71576660_36A7ACA1C340C1E7_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""891A834340E613E9"""
+"""C4C18542B1A96BA9_655BF4F8FD3260F6_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=C(C=CC=C2)CN3CCCC3""",21,"""891A834340E613E9"""
+"""E5A1BE77D80AF227_FD8FA4794180834C_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""891A834340E613E9"""
+"""FDE5E350903A4332_F7888E7A18FD67B1_6004_UN""","""N[S](=O)(=O)C1=NC(=CS1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""891A834340E613E9"""
+"""BA0EC71C64DF00B1_77B4BDE02F39E4F3_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](CCN)(=O)=O)C2CC2""",21,"""897CC30FF1C289EB"""
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+"""907A8414F7103B4F_A65480672272B1C9_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](CC)(=O)=O)CCCN""",21,"""897CC30FF1C289EB"""
+"""36406E5C95809171_2C8B258AD4A684E8_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](C)(=O)=O)C2CC(C2)N""",21,"""897CC30FF1C289EB"""
+"""0B79162D6F7C80DA_6A512D8DE4930669_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(CCCN)[S](=O)(=O)CCl""",21,"""897CC30FF1C289EB"""
+"""AF57D147E54B28EF_9FB0A1CB36019328_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(C)[S](=O)(=O)C2CNCC2""",21,"""897CC30FF1C289EB"""
+"""D31FB26AC351B73C_21E8AADC89EE36EC_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](CC)(=O)=O)CCCBr""",21,"""897CC30FF1C289EB"""
+"""86231E93A724CD07_95322BDC2CE0B562_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(CCCNC)[S](=O)(=O)C""",21,"""897CC30FF1C289EB"""
+"""CD5FF8045E5C422E_705F23BAA529AF3A_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""897CC30FF1C289EB"""
+"""B83897FA9E77B39A_221449A1F9167CF2_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](=O)(=O)CC#N)C2CC2""",21,"""897CC30FF1C289EB"""
+"""365A9024712A2B47_A1C022D711B03EE5_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](C)(=O)=O)C(=O)CCN""",21,"""897CC30FF1C289EB"""
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+"""7FC045F50EF0E770_C56028BEE5A19857_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""897CC30FF1C289EB"""
+"""8648AFC6E449450B_080773F73AEFB808_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""897CC30FF1C289EB"""
+"""C6A995E533813093_FC7ADC40F5EFE8A1_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""897CC30FF1C289EB"""
+"""5BDE4F70CCE4A1F8_F68E3B406994D0A7_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(CC(CC)N)[S](=O)(=O)C""",21,"""897CC30FF1C289EB"""
+"""FB6AF2487D596958_F4A06E616B9F608C_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""897CC30FF1C289EB"""
+"""2B30A55E395E726C_6762712DB167BB68_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](C)(=O)=O)CCN=[N]#N""",21,"""897CC30FF1C289EB"""
+"""0835B344128B4E05_B7D3468BB71ABF4C_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(CC(C)(C)N)[S](=O)(=O)C""",21,"""897CC30FF1C289EB"""
+"""37DB1260A2958C26_FDDC213A20D438C1_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""897CC30FF1C289EB"""
+"""79D8A7039F6FAA05_11E1BF582AFE9CCE_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""897CC30FF1C289EB"""
+"""61208E9381E8CE48_180C0B3C81ABB174_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](=O)(=O)C2CC2)CC#C""",21,"""897CC30FF1C289EB"""
+"""963BF3D36BC4A082_4C0C11B766A574B2_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN2[S](=O)(=O)C3(CCC2)CC3""",21,"""897CC30FF1C289EB"""
+"""B36ECD7B727FD0B5_64675E4A43A1385A_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN2CCCC(C)(C)[S]2(=O)=O""",21,"""897CC30FF1C289EB"""
+"""4599594C9B8A9A22_AF4EA51ECA67F349_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN2CCCC(CC)[S]2(=O)=O""",21,"""897CC30FF1C289EB"""
+"""A9813462D566EAB8_9E27D5C4AFDE45E6_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN2C(C(N)CC[S]2(=O)=O)=O""",21,"""897CC30FF1C289EB"""
+"""F615F02E419A7EC8_4139B26AD5D67CC8_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""897CC30FF1C289EB"""
+"""A53AE2015FFD17C6_EA017CF30146E1E4_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""897CC30FF1C289EB"""
+"""350B3613D6A22A73_AA6DCCA3047C385A_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""897CC30FF1C289EB"""
+"""51AC983C7F646566_02225677FF612732_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN2[S](CCN(C)CC2)(=O)=O""",21,"""897CC30FF1C289EB"""
+"""BAB0273B854C2296_8EB570FA97C8CCD1_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN2CC(=O)NCC[S]2(=O)=O""",21,"""897CC30FF1C289EB"""
+"""628F163E73D7F42D_DB4E6DF33A6D0B45_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN2[S](CCCCC2C)(=O)=O""",21,"""897CC30FF1C289EB"""
+"""2CF63F45DC3D9951_A1E6283F948DE4BB_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(CCN)[S](=O)(=O)C2CC2""",21,"""897CC30FF1C289EB"""
+"""EDD4BB05C18246D3_C71C0EFE30A1764C_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(CCN)[S](=O)(=O)C(F)F""",21,"""897CC30FF1C289EB"""
+"""2CEEB6D0CD62E915_6719929B0EAA88AE_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN([S](CC)(=O)=O)C2CNC2""",21,"""897CC30FF1C289EB"""
+"""275F6A439D6714A5_558046A79943DCD3_6036_DP""","""CC1=CC=C(C=C1)CC(N)CN3CC2(CNC2)C[S]3(=O)=O""",21,"""897CC30FF1C289EB"""
+"""9E0DE6B57F20F5BE_EFF53F35408098B9_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""897CC30FF1C289EB"""
+"""ABB6420B615CC5BD_131EA76549E28809_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""897CC30FF1C289EB"""
+"""8ED11CDDC5313C27_2D7FC0D284DC4092_6036_UN""","""CC1=CC=C(C=C1)CC(N)CN(C(C)(C)CN)[S](=O)(=O)C""",21,"""897CC30FF1C289EB"""
+"""FDFFF8060A20820F_88442B2E29836C66_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=CC=C2)OC3CCCC3""",21,"""89B47A7AD81895BA"""
+"""67CCC57297295F4D_2733D302D293C09A_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(OCC)C=C2)OCC""",21,"""89B47A7AD81895BA"""
+"""5450C59E31A43A05_DB33A4C54D7837B0_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)OCCC(C)C""",21,"""89B47A7AD81895BA"""
+"""5351281771D8D106_87095C93DE5401B4_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""89B47A7AD81895BA"""
+"""35B5A57D1B98A36F_B4213352593AF71C_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)OC3CCOC3""",21,"""89B47A7AD81895BA"""
+"""5A9903BB7767A008_7FC0D726814D03EF_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""89B47A7AD81895BA"""
+"""466C9862425E094D_A7AFF32AD5891267_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)COCCOC""",21,"""89B47A7AD81895BA"""
+"""B15AA2C5CE68E174_2EC27E2BDB35190B_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""89B47A7AD81895BA"""
+"""2CD0C8CD689761D1_31D96AC8EC7FFE6E_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)OC(COC)C""",21,"""89B47A7AD81895BA"""
+"""4D9836DF5D52B497_639892FC67CA5E42_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""89B47A7AD81895BA"""
+"""790BA49578EB11DC_766174C8FCB7FF00_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""89B47A7AD81895BA"""
+"""CD56DE2BA89B8CD7_0FDA1BE40B8DC37D_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=CC=C2)CN3CCCC3""",21,"""89B47A7AD81895BA"""
+"""3CEB79CFDB01C427_16FE3FE663E12CFD_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""89B47A7AD81895BA"""
+"""741EBEDE6DA1E21F_6B0A6004E4F79D94_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)OCCN(C)C""",21,"""89B47A7AD81895BA"""
+"""D2B17BB0575F0251_9CD7ACC675953EAF_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""89B47A7AD81895BA"""
+"""1EC7DDE0FA93F4C0_ABF0944282FF3D1B_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""89B47A7AD81895BA"""
+"""627B3231AD8520D6_793C6AC6A8F017A8_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""89B47A7AD81895BA"""
+"""EA5EF6D7FA7CFC52_A9E9A44E5DAA23BB_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""89B47A7AD81895BA"""
+"""5251A23D71398FCE_867C90014E8D417E_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""89B47A7AD81895BA"""
+"""D3CB1988FB97EE7B_83476EA492BD9357_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""89B47A7AD81895BA"""
+"""A2A07CEDCB742DFA_46BCC853F23D0F63_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""89B47A7AD81895BA"""
+"""EA26304EAA06D01B_569058022DD3BB97_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""89B47A7AD81895BA"""
+"""1780DCE6536810EE_8B83013B83704FED_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""89B47A7AD81895BA"""
+"""11F51BB7FE968113_1BF0E5411A8DC538_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""89B47A7AD81895BA"""
+"""B0B9E42D88F88C60_3ED155F2FA820BE3_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""89B47A7AD81895BA"""
+"""18537400A3D3E01F_582CE5B3D30BBA83_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=C(OCCC(C)C)C=C2""",21,"""89B47A7AD81895BA"""
+"""BF8BB55FA3EE33A4_A54186A52D412AD3_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)OC3CCCC3""",21,"""89B47A7AD81895BA"""
+"""D968D1ADC6AFEA11_24775F5B9ABA4207_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""89B47A7AD81895BA"""
+"""A15F4ED717A56A59_51083D69E096E6B0_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""89B47A7AD81895BA"""
+"""117E205213659E2E_AEEFFAE53797185D_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""89B47A7AD81895BA"""
+"""E5573944EE458388_596813101CEE3543_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""89B47A7AD81895BA"""
+"""0D33A499ED5DBB10_2F633D0CD4823228_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""89B47A7AD81895BA"""
+"""99AA67565E663CED_EA53AC364D665B57_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""89B47A7AD81895BA"""
+"""6D1544AE577370C5_80379910B2505037_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""89B47A7AD81895BA"""
+"""0834B1077BCA3D78_F10C2B65A35BDEC4_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""89B47A7AD81895BA"""
+"""F11308AA610BC8BE_43C7C7106112D786_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""89B47A7AD81895BA"""
+"""4A49425CC4CDABE2_360955985BBE47B4_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""89B47A7AD81895BA"""
+"""425EDD647FA18029_65F50DC165CCE6A5_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(C=CC=C2)CN3CCCC3""",21,"""89B47A7AD81895BA"""
+"""7BDD93462FBC3EB7_FD215D40D97E051F_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""89B47A7AD81895BA"""
+"""04446FAB415E41EE_F72677438003E1E2_6005_UN""","""F[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""89B47A7AD81895BA"""
+"""40E16A8761AD922B_773092B0B9B1F30B_6036_UN""","""CC(N)C(C1=C(C=CC=C1)F)N([S](CCN)(=O)=O)C2CC2""",21,"""89F8EC5F674A9E13"""
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+"""838A14CD79D863ED_679DBDCB98229F56_6036_UN""","""CC(N)C(C1=C(C=CC=C1)F)N([S](CC)(=O)=O)C2CNC2""",21,"""89F8EC5F674A9E13"""
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+"""C46200AFEB5416B6_326FE70E337D5DA3_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC=CC(=C2)OC(COC)C)F""",21,"""8A02F7BC071A3677"""
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+"""CC6FEC30B4DF8C97_0C6C9622D48F60B0_6005_UN""","""CCC1=C(C=CC(=C1)C2=CC(=CC=C2)CN3CCCC3)F""",21,"""8A02F7BC071A3677"""
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+"""7BD74DD38FC93DF6_B82049202FF15F48_6036_UN""","""CC(NCCN([S](C)(=O)=O)CCN=C=S)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
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+"""E77F35AD114EFD49_6933E572A7B89120_6036_UN""","""CC(NCCN(CCCN)[S](=O)(=O)CCl)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""3D1D03136C36FF06_9CD26934752A0461_6036_UN""","""CC(NCCN(C)[S](=O)(=O)C1CNCC1)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""38C2BC7A19609F01_228A6223CAC5A1A5_6036_UN""","""CC(NCCN([S](CC)(=O)=O)CCCBr)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""57D1EE03FD0EFD37_9650E3236FCB222B_6036_UN""","""CC(NCCN(CCCNC)[S](=O)(=O)C)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""1827F1FFD1A00E30_733DEB45E6023873_6036_UN""","""CC(NCCN(C(C)(C)C#N)[S](=O)(=O)C)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""5B2D25344A17175A_2176815EBA3DEBBB_6036_UN""","""CC(NCCN([S](=O)(=O)CC#N)C1CC1)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""B8F6A846CEDDF604_A2A2EA28529BA9AC_6036_UN""","""CC(NCCN([S](C)(=O)=O)C(=O)CCN)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""A0F534016B3F85C1_64A4BDD8B6C51D5F_6036_UN""","""CC(NCCN(C)[S](=O)(=O)C1=CC=CS1)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""EECC35EE922A8806_C602E041A68A0F1E_6036_UN""","""CC(NCCN(C(C)(C)C)[S](=O)(=O)CCl)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""F742C61FC0B59625_0B65BB0879C42F41_6036_UN""","""CC(NCCN(C(C)(C)C)[S](=O)(=O)CBr)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""55D50E48C9B9166A_FF1814BFB6C47FE8_6036_UN""","""CC(NCCN(C(C)(C)C#C)[S](=O)(=O)C)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""879E4C18AFB21E0D_F5ECF3BF2ABF47EE_6036_UN""","""CC(NCCN(CC(CC)N)[S](=O)(=O)C)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""3C5EA2462710CA51_F7C2A69E28B4F7C5_6036_UN""","""CC(NCCN(C)[S](=O)(=O)C1=C[NH]C=N1)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""ECDF6B6BE567E282_6400B9D2F24C2C21_6036_UN""","""CC(NCCN([S](C)(=O)=O)CCN=[N]#N)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""A948267F4D5993F4_B4B18E74F4312805_6036_UN""","""CC(NCCN(CC(C)(C)N)[S](=O)(=O)C)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""B9F789162E0E3EFC_FEBEE9C563FFAF88_6036_UN""","""CC(NCCN1[S](CC(C)(C)C1=O)(=O)=O)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""E4B3E0F5D3C124DD_128377A769D50B87_6036_UN""","""CC(NCCN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)C3=CC=C(Br)S3""",21,"""8A1E0BF0B2E91EA2"""
+"""C2E730E1BB8C460D_1B6EC3C3C280263D_6036_UN""","""CC(NCCN([S](=O)(=O)C1CC1)CC#C)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""EDED5629B8D9FD92_4F6ED948258EE3FB_6036_UN""","""CC(NCCN1[S](=O)(=O)C2(CCC1)CC2)C3=CC=C(Br)S3""",21,"""8A1E0BF0B2E91EA2"""
+"""F863909526B099B3_670596B5008AAF13_6036_UN""","""CC(NCCN1CCCC(C)(C)[S]1(=O)=O)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""7191172EB3FF73B9_AC2C6DE1894C6400_6036_UN""","""CC(NCCN1CCCC(CC)[S]1(=O)=O)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""E2FC4BB10CB3E46D_9D451D3BECF5D2AF_6036_UN""","""CC(NCCN1C(C(N)CC[S]1(=O)=O)=O)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""67FD0B9C6AA3701C_425B7A9596FDEB81_6036_UN""","""CC(NCCN([S](C)(=O)=O)[C@@H]1CNCC1)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""5EE1E7DC8A32894C_E963B40C426D76AD_6036_UN""","""CC(NCCN1CCCC(Cl)(Cl)[S]1(=O)=O)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""38A8CE90C4352F5C_A90F045C4757AF13_6036_UN""","""CC(NCCN([S](C)(=O)=O)[C@H]1CNCC1)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""CF55FEAB017EA056_01409E88BC4AB07B_6036_UN""","""CC(NCCN1[S](CCN(C)CC1)(=O)=O)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""753DB2A4EB6AAC9C_8DD7B805D4E35B98_6036_UN""","""CC(NCCN1CC(=O)NCC[S]1(=O)=O)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""58C8ABEA0EC72F3F_D82CA50C79469C0C_6036_UN""","""CC(NCCN1[S](CCCCC1C)(=O)=O)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""FFFEE3ECDA456A34_A284E0C0D7A673F2_6036_UN""","""CC(NCCN(CCN)[S](=O)(=O)C1CC1)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""28041DBCBC520B0F_C47EC601738AE105_6036_UN""","""CC(NCCN(CCN)[S](=O)(=O)C(F)F)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""51FA3094B32724E5_647B5A644D811FE7_6036_UN""","""CC(NCCN([S](CC)(=O)=O)C1CNC1)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""C92F1A5FDD331423_56E28E58DA684B9A_6036_DP""","""CC(NCCN2CC1(CNC1)C[S]2(=O)=O)C3=CC=C(Br)S3""",21,"""8A1E0BF0B2E91EA2"""
+"""4022EA7481488F03_EC97F7CA03AB0FF0_6036_UN""","""CC(NCCN(C)[S](=O)(=O)C1=N[NH]C=N1)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""0D8CB3194158F6E9_107C6F9A0AC91F40_6036_UN""","""CC(NCCN(C)[S](=O)(=O)C1=C[NH]N=C1)C2=CC=C(Br)S2""",21,"""8A1E0BF0B2E91EA2"""
+"""85A0AB4FF8DB4938_2E1D082DC7F7D7DB_6036_UN""","""CC(NCCN(C(C)(C)CN)[S](=O)(=O)C)C1=CC=C(Br)S1""",21,"""8A1E0BF0B2E91EA2"""
+"""EE60CA22D98E3ACB_75E1E879CD076CFE_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](CCN)(=O)=O)C3CC3""",21,"""8B29969613FC01E6"""
+"""BE28C2BDBD9B7A8F_EE9838F360A46350_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C(C)C)[S](=O)(=O)CCN""",21,"""8B29969613FC01E6"""
+"""0871C3A8A7C576C2_B917D4468EE4400C_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](C)(=O)=O)CCN=C=S""",21,"""8B29969613FC01E6"""
+"""5A694E22D9FF342B_A401D5FEC04C39C4_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](CC)(=O)=O)CCCN""",21,"""8B29969613FC01E6"""
+"""07024B6F6D93F4F2_2EDE701336980CE5_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""8B29969613FC01E6"""
+"""7D7C1DF4AE09137D_6804781406AD8E64_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(CCCN)[S](=O)(=O)CCl""",21,"""8B29969613FC01E6"""
+"""E499E10FC0D53BC3_9DE5F452D43F1B25_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C)[S](=O)(=O)C3CNCC3""",21,"""8B29969613FC01E6"""
+"""7B381E71E465D8FC_23BDFF456BD0BEE1_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](CC)(=O)=O)CCCBr""",21,"""8B29969613FC01E6"""
+"""451AB0B6E75443BA_97677E45CEDE3D6F_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(CCCNC)[S](=O)(=O)C""",21,"""8B29969613FC01E6"""
+"""EC663EB05FF350C0_720A762347172737_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""8B29969613FC01E6"""
+"""A3E69E13A5B2E2BA_20411C381B28F4FF_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](=O)(=O)CC#N)C3CC3""",21,"""8B29969613FC01E6"""
+"""1CA32B8830833405_A395774EF38EB6E8_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](C)(=O)=O)C(=O)CCN""",21,"""8B29969613FC01E6"""
+"""76AEDD7047C10B47_659320BE17D0021B_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""8B29969613FC01E6"""
+"""627896F35627CCAF_C7357D27079F105A_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""8B29969613FC01E6"""
+"""8F829AF772DE26EA_0A52266ED8D13005_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""8B29969613FC01E6"""
+"""FC388997F54BDC1C_FE2F89D917D160AC_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""8B29969613FC01E6"""
+"""6C88D3837648DC0D_F4DB6ED98BAA58AA_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(CC(CC)N)[S](=O)(=O)C""",21,"""8B29969613FC01E6"""
+"""0FA90191841167E4_F6F53BF889A1E881_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""8B29969613FC01E6"""
+"""1FB12D3FCAA4D964_653724B453593365_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""8B29969613FC01E6"""
+"""62872125885A7629_B586131255243741_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""8B29969613FC01E6"""
+"""191B1CF9F60247D5_FF8974A3C2EAB0CC_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""8B29969613FC01E6"""
+"""A4CC9A0A96F119B5_13B4EAC1C8C014C3_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""8B29969613FC01E6"""
+"""2B721AFEE52C1EA7_1A595EA563953979_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](=O)(=O)C3CC3)CC#C""",21,"""8B29969613FC01E6"""
+"""1A725FEBD524C109_4E59442E849BFCBF_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""8B29969613FC01E6"""
+"""3809488FC74BFCE5_66320BD3A19FB057_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""8B29969613FC01E6"""
+"""60811D1FA4EF7C07_AD1BF08728597B44_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N3CCCC(CC)[S]3(=O)=O""",21,"""8B29969613FC01E6"""
+"""3E9BA91CCEAD16DE_9C72805D4DE0CDEB_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""8B29969613FC01E6"""
+"""B3406E1CA183D7C1_436CE7F337E8F4C5_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""8B29969613FC01E6"""
+"""6A359A7B2CB2ED6D_E854296AE37869E9_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""8B29969613FC01E6"""
+"""4FFC4BA83F0D8815_A838993AE642B057_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""8B29969613FC01E6"""
+"""B4A1837ACC785D7B_007703EE1D5FAF3F_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N3[S](CCN(C)CC3)(=O)=O""",21,"""8B29969613FC01E6"""
+"""E53A2ABE2EDD24DE_8CE0256375F644DC_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N3CC(=O)NCC[S]3(=O)=O""",21,"""8B29969613FC01E6"""
+"""AC9C829639F98C47_D91B386AD8538348_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N3[S](CCCCC3C)(=O)=O""",21,"""8B29969613FC01E6"""
+"""FAA8A7E18BC62A8E_A3B37DA676B36CB6_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(CCN)[S](=O)(=O)C3CC3""",21,"""8B29969613FC01E6"""
+"""16F2EB828A16988A_C5495B67D29FFE41_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(CCN)[S](=O)(=O)C(F)F""",21,"""8B29969613FC01E6"""
+"""30F755ADFBC90EAC_654CC702EC9400A3_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N([S](CC)(=O)=O)C3CNC3""",21,"""8B29969613FC01E6"""
+"""9FEB9C3A0100368B_57D5133E7B7D54DE_6036_DP""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""8B29969613FC01E6"""
+"""59280F4C4E7F0421_EDA06AACA2BE10B4_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""8B29969613FC01E6"""
+"""05C4BA39B30AFF8C_114BF2FCABDC0004_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""8B29969613FC01E6"""
+"""50F8CE244DA44A9D_2F2A954B66E2C89F_6036_UN""","""C(C2=NC1=C(C=CC(=C1)Br)[NH]2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""8B29969613FC01E6"""
+"""4476D09131D730BE_1F71016A92FF2FB9_2201_UN""","""CCC1=C(C2=C(N=C1C#C)C=CC(=C2)Cl)C3=CC=CC=C3""",21,"""8B2CDCF7F37B8F1D"""
+"""284B9022A30CA058_93F6F98EC69AB7A8_2201_UN""","""CCC3=C(C1=CC=C(C)C=C1)C2=C(SC(=C2)Br)N=C3C#C""",21,"""8B2CDCF7F37B8F1D"""
+"""5223784423244C2E_7234EA2BFBFA252A_2201_UN""","""CCC1=C(C2=C(N=C1C#C)C=C(C=C2)Cl)C3=CC=CC=C3""",21,"""8B2CDCF7F37B8F1D"""
+"""9B429C4A6DDB69B0_DE02EF379674C812_2201_UN""","""CCC1=C(C2=C(N=C1C#C)N=CC=C2)C3=CC=C(C=C3)F""",21,"""8B2CDCF7F37B8F1D"""
+"""F82FCAD6B2F6C5C5_9D94869415209368_2201_UN""","""CCC1=C(C2=C(N=C1C#C)C=CC(=C2)Br)C3=CC=CC=C3""",21,"""8B2CDCF7F37B8F1D"""
+"""99464C3E2A47A105_721472736FCB1514_2201_UN""","""CCC2=C(C1=C(C)C=CC=C1N=C2C#C)C3=CC=CC=C3""",21,"""8B2CDCF7F37B8F1D"""
+"""CAA2257E4A3E5BD0_D4E3F69E1BF90C01_2201_UN""","""CCC1=C(C2=C(N=C1C#C)C=C(C=C2)Cl)C3COCCC3""",21,"""8B2CDCF7F37B8F1D"""
+"""30FD9141AD723FB3_6192DD564D625AC4_2201_UN""","""CCC1=C(C2=C(N=C1C#C)C=CC=N2)C3=CC=C(C=C3)F""",21,"""8B2CDCF7F37B8F1D"""
+"""C77BD85058B538A8_62F195E1E2254B4E_2201_UN""","""CCC3=C(C1=CC=C(C)C=C1)C2=C(C=CC=C2)N=C3C#C""",21,"""8B2CDCF7F37B8F1D"""
+"""B80EE6F7DB70CCAE_85159A59B26A776A_2201_UN""","""CCC1=C(C2=C(N=C1C#C)C=CC(=C2)F)C3=CC=CC=C3""",21,"""8B2CDCF7F37B8F1D"""
+"""7C099892763829BE_B55C84ED258BAB6A_2201_UN""","""CCC1=C(C2=C(N=C1C#C)N=CC=C2)C3=CC(=CC=C3)Cl""",21,"""8B2CDCF7F37B8F1D"""
+"""88DA0F737D585204_8EBAFB4C73E534C1_2201_UN""","""CCC1=C(C2=C(N=C1C#C)C=CC=C2)C3=CC=C(C=C3)F""",21,"""8B2CDCF7F37B8F1D"""
+"""8ED9D9B7E57298EF_83B0C7A868DF1181_2267_UN""","""CCCC(=O)C#CC1=CC(=C(C=C1)[N]2C=NN=N2)C(O)=O""",21,"""8B2CDCF7F37B8F1D"""
+"""2A7CEC59D78E9BD1_959A77D51101550A_2267_UN""","""CCCC(=O)C#CC2=CC=C([N]1C=CC=C1C(O)=O)C=C2""",21,"""8B2CDCF7F37B8F1D"""
+"""2D6B74C2521F7973_5E3FDBD6BBFF0F27_2267_UN""","""CCCC(=O)C#CC1=C(C(OC)=O)C=C(C=C1[N](=O)=O)C""",21,"""8B2CDCF7F37B8F1D"""
+"""DAF3A125437D5E89_1CC45BF737BEF8F4_2267_UN""","""CCCC(=O)C#CC1=CC=C(CCCCCC(O)=O)C=C1""",21,"""8B2CDCF7F37B8F1D"""
+"""B47AF142EDE5A978_F649FAF81127626C_2267_UN""","""CCCC(=O)C#CC2=C[N](CC1=CC=C(OC)C=C1)N=C2""",21,"""8B2CDCF7F37B8F1D"""
+"""FFE565287903D356_F46500F27E2CDA8C_2267_UN""","""CCCC(=O)C#CC2=CC=C(CN1CCCC1CN)C=C2""",21,"""8B2CDCF7F37B8F1D"""
+"""476ABE1BAA18127B_4335C684233BC293_2267_UN""","""CCCC(=O)C#CC2=CC1=C(N=C(C(OC)=O)C=C1)C=C2""",21,"""8B2CDCF7F37B8F1D"""
+"""8EC1E29E7AE7F2EB_2E94C23BF2A1F96F_2267_UN""","""CCCC(=O)C#CC1=CN=C2[N]1N=C(NCCCO)C=C2""",21,"""8B2CDCF7F37B8F1D"""
+"""A07F0995BB2839D8_E5DCFBC678EA788F_2267_UN""","""CCCC(=O)C#CC1=C(C(OC)=O)C=C(C=C1)C(F)(F)F""",21,"""8B2CDCF7F37B8F1D"""
+"""F028976263DE8D40_2B7D42F3DBE92D43_2267_UN""","""CCCC(=O)C#CC2=CC=C(C1(C)NC(=O)NC1=O)C=C2""",21,"""8B2CDCF7F37B8F1D"""
+"""CAF418A3E6CFD584_4BC7E8C598CD8C93_2267_UN""","""CCCC(=O)C#CC1=C([N](N=C1C)C2C[S](CC2)(=O)=O)C""",21,"""8B2CDCF7F37B8F1D"""
+"""851AF7513D230A6C_81566D01AA3CEC2B_2267_UN""","""CCCC(=O)C#CC1=C(C=CC=C1)C(=O)N2CCNCC2""",21,"""8B2CDCF7F37B8F1D"""
+"""D4337F6B0828C85D_C1539D914E842719_2267_UN""","""CCCC(=O)C#CC1=CC=C(CCC(C)CC(=O)O)C=C1""",21,"""8B2CDCF7F37B8F1D"""
+"""EBD48B5CE05AA1C6_87275A44633883A9_2267_UN""","""CCCC(=O)C#CC1=CC=C(C=C1)CCN2CCOCC2""",21,"""8B2CDCF7F37B8F1D"""
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+"""A84735C9CB33955F_47485037EF44CC57_6036_UN""","""NC(CN([S](C)(=O)=O)[C@@H]1CNCC1)C2=C(C=CC(=C2)F)F""",21,"""8F0D2152CB503974"""
+"""8965A506AF5052D0_EC709EAE3BD4517B_6036_UN""","""NC(CN1CCCC(Cl)(Cl)[S]1(=O)=O)C2=C(C=CC(=C2)F)F""",21,"""8F0D2152CB503974"""
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+"""D7E9732C40875EB4_E984DD687A122826_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=N[NH]C=N1)C2=C(C=CC(=C2)F)F""",21,"""8F0D2152CB503974"""
+"""FEA28302C7B8DA20_156F453873703896_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=C[NH]N=C1)C2=C(C=CC(=C2)F)F""",21,"""8F0D2152CB503974"""
+"""0173CE7089696A5B_2B0E228FBE4EF00D_6036_UN""","""NC(CN(C(C)(C)CN)[S](=O)(=O)C)C1=C(C=CC(=C1)F)F""",21,"""8F0D2152CB503974"""
+"""B5BDA060DF5FBA08_8ED688218F83040C_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC(=CC=C2)OC3CCCC3""",21,"""8F26D9757E18FDD0"""
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+"""671686C42813D0F1_DDA107CAEB785FDA_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=CC(=C2)OCCC(C)C""",21,"""8F26D9757E18FDD0"""
+"""D87825642CEE7C99_819BFF9C785469DE_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""8F26D9757E18FDD0"""
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+"""023A703A60461E35_A13D502573897A0D_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=CC(=C2)COCCOC""",21,"""8F26D9757E18FDD0"""
+"""CF2EC98E004E2764_2850DD247D357161_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""8F26D9757E18FDD0"""
+"""AF468BE649C5BAE7_374BC9C74A7F9604_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=CC(=C2)OC(COC)C""",21,"""8F26D9757E18FDD0"""
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+"""F613EF30D2426DB5_70F3D7C75AB7976A_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""8F26D9757E18FDD0"""
+"""881A272C6C2AA500_0948B8EBAD8DAB17_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC(=CC=C2)CN3CCCC3""",21,"""8F26D9757E18FDD0"""
+"""CECFDD56A1E17AAC_106C9CE9C5E14497_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""8F26D9757E18FDD0"""
+"""63F728D24260294A_6D98C30B42F7F5FE_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=CC(=C2)OCCN(C)C""",21,"""8F26D9757E18FDD0"""
+"""BDFE16950ADE06D3_9A450FC9D39556C5_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""8F26D9757E18FDD0"""
+"""4D0FA5BDBACA5CD7_AD62374D24FF5571_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""8F26D9757E18FDD0"""
+"""B78EB1A77B984D0E_7FAEC9C90EF07FC2_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""8F26D9757E18FDD0"""
+"""699475091E73E16F_AF7B0741FBAA4BD1_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""8F26D9757E18FDD0"""
+"""D59FE07A3C47CFC5_14F4B7512125A37F_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""8F26D9757E18FDD0"""
+"""4519E6A8ED777828_80EE330EE88D2914_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""8F26D9757E18FDD0"""
+"""B2E13FCBB312F4C0_85D5CDAB34BDFB3D_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""8F26D9757E18FDD0"""
+"""D141EC49DBEAA996_402E6B5C543D6709_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""8F26D9757E18FDD0"""
+"""EFDB354D46233113_5002FB0D8BD3D3FD_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""8F26D9757E18FDD0"""
+"""0776F8EDF16F2D32_8D11A23425702787_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""8F26D9757E18FDD0"""
+"""206D0F9CDB2152F1_1D62464EBC8DAD52_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""8F26D9757E18FDD0"""
+"""325B48AF3205BC9B_3843F6FD5C826389_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""8F26D9757E18FDD0"""
+"""6F61F08EF48B73F8_5EBE46BC750BD2E9_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=C(OCCC(C)C)C=C2""",21,"""8F26D9757E18FDD0"""
+"""D7D47A814D5AFB9B_A3D325AA8B4142B9_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=C(C=C2)OC3CCCC3""",21,"""8F26D9757E18FDD0"""
+"""D7775BB0A4B030BE_22E5FC543CBA2A6D_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""8F26D9757E18FDD0"""
+"""5E2DA74A559B1A5E_579A9E6646968EDA_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""8F26D9757E18FDD0"""
+"""D60107B76D924EDF_A87D59EA91977037_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""8F26D9757E18FDD0"""
+"""C59B6A635A9CED42_5FFAB01FBAEE5D29_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""8F26D9757E18FDD0"""
+"""0DBE5B3A618B6066_29F19E0372825A42_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""8F26D9757E18FDD0"""
+"""93BDA8E94B85DC54_ECC10F39EB66333D_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""8F26D9757E18FDD0"""
+"""AE6ADB2C2B084EF7_86A53A1F1450385D_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""8F26D9757E18FDD0"""
+"""ED9C2BA32C1BCF98_F79E886A055BB6AE_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""8F26D9757E18FDD0"""
+"""28CE2B3DFA3BDF88_4555641FC712BFEC_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""8F26D9757E18FDD0"""
+"""20728B77CD497CBE_309BF697FDBE2FDE_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""8F26D9757E18FDD0"""
+"""7B55C0B29C75D16A_6367AECEC3CC8ECF_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(C=CC=C2)CN3CCCC3""",21,"""8F26D9757E18FDD0"""
+"""FDE16E4944CF1223_F1B4D44C26038988_6025_UN""","""C1(=NN=C(C(F)F)[N]1N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""8F26D9757E18FDD0"""
+"""688A189F075074DB_8EB800BF996D3D84_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=CC=C2)OC3CCCC3""",21,"""8F4851EB68F6C458"""
+"""C1DA28E39A143260_21CFF893627D9178_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=C(OCC)C=C2)OCC""",21,"""8F4851EB68F6C458"""
+"""A0146051B0D11253_DDCF8F54FD966652_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=CC(=C2)OCCC(C)C""",21,"""8F4851EB68F6C458"""
+"""03A696B4F21B5C52_81F577026EBA5056_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""8F4851EB68F6C458"""
+"""9847EA62A7DEFF5A_B2DD18C3E9D4A6FE_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=C(C=C2)OC3CCOC3""",21,"""8F4851EB68F6C458"""
+"""17617EE7745A47FD_793CFCB731A3520D_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""8F4851EB68F6C458"""
+"""E6F7D75ACF56E944_A153D8BB65674385_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=CC(=C2)COCCOC""",21,"""8F4851EB68F6C458"""
+"""9827114E9BAC8D08_283E55BA6BDB48E9_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""8F4851EB68F6C458"""
+"""5002F83ECED44C06_372541595C91AF8C_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=CC(=C2)OC(COC)C""",21,"""8F4851EB68F6C458"""
+"""723FD10F89249BBD_6564B96DD7240FA0_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""8F4851EB68F6C458"""
+"""278509C22A320D49_709D5F594C59AEE2_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""8F4851EB68F6C458"""
+"""D7446DC4BAEAC269_09263075BB63929F_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=CC=C2)CN3CCCC3""",21,"""8F4851EB68F6C458"""
+"""A89CB9E0124447C2_10021477D30F7D1F_6005_UN""","""COCC[N]1C=CC(=N1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""8F4851EB68F6C458"""
+"""91674966F1C1F8D8_6DF64B955419CC76_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=CC(=C2)OCCN(C)C""",21,"""8F4851EB68F6C458"""
+"""78346B1F2AEB1306_9A2B8757C57B6F4D_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""8F4851EB68F6C458"""
+"""248F38108EDE9C97_AD0CBFD332116CF9_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""8F4851EB68F6C458"""
+"""4528D9E4F314D3C2_7FC04157181E464A_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""8F4851EB68F6C458"""
+"""55C9E173BB1B1B10_AF158FDFED447259_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""8F4851EB68F6C458"""
+"""2AEA50BF721AD36A_8080BB90FE63109C_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""8F4851EB68F6C458"""
+"""A8C0FC71E71D269E_85BB45352253C2B5_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""8F4851EB68F6C458"""
+"""DF732AB552484D07_4040E3C242D35E81_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""8F4851EB68F6C458"""
+"""5E0895362B73F5A8_506C73939D3DEA75_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""8F4851EB68F6C458"""
+"""F49A73FBB63D65A5_8D7F2AAA339E1E0F_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""8F4851EB68F6C458"""
+"""2FC9113BD4377903_1D0CCED0AA6394DA_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""8F4851EB68F6C458"""
+"""DA6A21E50D621724_382D7E634A6C5A01_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""8F4851EB68F6C458"""
+"""29DE20330DB16FD3_5ED0CE2263E5EB61_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=C(OCCC(C)C)C=C2""",21,"""8F4851EB68F6C458"""
+"""E0B04BFA6E21F6E9_A3BDAD349DAF7B31_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=C(C=C2)OC3CCCC3""",21,"""8F4851EB68F6C458"""
+"""D37670D01F5A6407_228B74CA2A5413E5_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""8F4851EB68F6C458"""
+"""C6FBE5A5D09AB048_57F416F85078B752_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""8F4851EB68F6C458"""
+"""70D78C753EA456C9_A813D174877949BF_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""8F4851EB68F6C458"""
+"""9CC647049E407787_5F943881AC0064A1_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""8F4851EB68F6C458"""
+"""1F7DAC87DBB47D5D_299F169D646C63CA_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""8F4851EB68F6C458"""
+"""93C0054FB3C3F11D_ECAF87A7FD880AB5_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""8F4851EB68F6C458"""
+"""F33FA5FF61DE43DA_86CBB28102BE01D5_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""8F4851EB68F6C458"""
+"""A74A9BF37C9B28AA_F7F000F413B58F26_6005_UN""","""COCC[N]1C=CC(=N1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""8F4851EB68F6C458"""
+"""B18ACC486FA1E191_453BEC81D1FC8664_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""8F4851EB68F6C458"""
+"""9114149F5804ED1C_30F57E09EB501656_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""8F4851EB68F6C458"""
+"""4F5ECCF301BC7B88_63092650D522B747_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(C=CC=C2)CN3CCCC3""",21,"""8F4851EB68F6C458"""
+"""A0D344CD4B5C51EB_FBDD76D1699054FD_6005_UN""","""COCC[N]1C=CC(=N1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""8F4851EB68F6C458"""
+"""5D537E641504E701_F1DA5CD230EDB000_6005_UN""","""COCC[N]1C=CC(=N1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""8F4851EB68F6C458"""
+"""E1C8C530A7810F37_8EA5923B26973DB1_6005_UN""","""NC1=C(C=C(C(=C1)F)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""8F55C36FD70CC46D"""
+"""B8195B48B8EE5D7C_21D26A17DD87914D_6005_UN""","""NC1=C(C=C(C(=C1)F)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""8F55C36FD70CC46D"""
+"""AE9C888B7F7EF7D2_DDD21DD0426C6667_6005_UN""","""NC1=C(C=C(C(=C1)F)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""8F55C36FD70CC46D"""
+"""F5F74AF382E0FFF3_81E8E586D1405063_6005_UN""","""NC1=C(C=C(C(=C1)F)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""8F55C36FD70CC46D"""
+"""FDA5B148A8C5C6AF_B2C08A47562EA6CB_6005_UN""","""NC1=C(C=C(C(=C1)F)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""8F55C36FD70CC46D"""
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+"""E850349C6C17FD92_B3649F8DC371AE3A_6005_UN""","""NC1=C(C(=C(C=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3)F""",21,"""912071B59996069B"""
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+"""8E728B5BF6B44FBF_26455E3DBB0C98C2_6005_UN""","""NC1=C(C(=C(C=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F)F""",21,"""912071B59996069B"""
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+"""D3E8464F480EA259_3CE35494DB34D126_6005_UN""","""NC1=C(C(=C(C=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C)F""",21,"""912071B59996069B"""
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+"""FBFD5E52C93C8F95_EFB27C8CC18D72C3_6005_UN""","""NC1=C(C(=C(C=C1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F)F""",21,"""912071B59996069B"""
+"""4DB3D5340F99B04C_6F731FF37262BF4C_6036_UN""","""C[C@H](CN([S](CCN)(=O)=O)C1CC1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
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+"""7B9F7E029E1FD41A_A38523CC318193BE_6036_UN""","""C[C@H](CN([S](C)(=O)=O)CCN=C=S)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""07DA2DB9930E6EBD_BE9322747F29EA76_6036_UN""","""C[C@H](CN([S](CC)(=O)=O)CCCN)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""B95E7FC53F02F3B1_344C879989FDDF57_6036_UN""","""C[C@H](CN([S](C)(=O)=O)C1CC(C1)N)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""5F80E344A340539F_72968F9EB9C85DD6_6036_UN""","""C[C@H](CN(CCCN)[S](=O)(=O)CCl)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""B619C81A9DC208E1_877703D86B5AC897_6036_UN""","""C[C@H](CN(C)[S](=O)(=O)C1CNCC1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""01FD7D288FB70AF8_392F08CFD4B56D53_6036_UN""","""C[C@H](CN([S](CC)(=O)=O)CCCBr)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""A1E5FB1BD0FAD22E_8DF589CF71BBEEDD_6036_UN""","""C[C@H](CN(CCCNC)[S](=O)(=O)C)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""F42214403DB33BBE_689881A9F872F485_6036_UN""","""C[C@H](CN(C(C)(C)C#N)[S](=O)(=O)C)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""58DEF66FF0AA6E3D_3AD3EBB2A44D274D_6036_UN""","""C[C@H](CN([S](=O)(=O)CC#N)C1CC1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""FDA56784D5823BFE_B90780C44CEB655A_6036_UN""","""C[C@H](CN([S](C)(=O)=O)C(=O)CCN)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""9D06C657DD8669F4_7F01D734A8B5D1A9_6036_UN""","""C[C@H](CN(C)[S](=O)(=O)C1=CC=CS1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""26283B69D001BDCF_DDA78AADB8FAC3E8_6036_UN""","""C[C@H](CN(C(C)(C)C)[S](=O)(=O)CCl)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""83AB08300C277EF7_10C0D1E467B4E3B7_6036_UN""","""C[C@H](CN(C(C)(C)C)[S](=O)(=O)CBr)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""10C56BD1019C426F_E4BD7E53A8B4B31E_6036_UN""","""C[C@H](CN(C(C)(C)C#C)[S](=O)(=O)C)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""11CC48166FA9883E_EE49995334CF8B18_6036_UN""","""C[C@H](CN(CC(CC)N)[S](=O)(=O)C)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""8374BB93EA724677_EC67CC7236C43B33_6036_UN""","""C[C@H](CN(C)[S](=O)(=O)C1=C[NH]C=N1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""5CBB1F93B0F11CCA_7FA5D33EEC3CE0D7_6036_UN""","""C[C@H](CN([S](C)(=O)=O)CCN=[N]#N)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""B7540776B851A6B2_AF14E498EA41E4F3_6036_UN""","""C[C@H](CN(CC(C)(C)N)[S](=O)(=O)C)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""FBB27B377E9E44DD_E51B83297D8F637E_6036_UN""","""C[C@H](CN1[S](CC(C)(C)C1=O)(=O)=O)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""20D5EE1701E01C68_09261D4B77A5C771_6036_UN""","""C[C@H](CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)NCC3=CC=CC=C3""",21,"""91BB611CAC99D254"""
+"""C57AE5EB9D07C90E_00CBA92FDCF0EACB_6036_UN""","""C[C@H](CN([S](=O)(=O)C1CC1)CC#C)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""70A25BB658513F36_54CBB3A43BFE2F0D_6036_UN""","""C[C@H](CN1[S](=O)(=O)C2(CCC1)CC2)NCC3=CC=CC=C3""",21,"""91BB611CAC99D254"""
+"""C337D1DCE1BB2F5F_7CA0FC591EFA63E5_6036_UN""","""C[C@H](CN1CCCC(C)(C)[S]1(=O)=O)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""6B6110795C337984_B789070D973CA8F6_6036_UN""","""C[C@H](CN1CCCC(CC)[S]1(=O)=O)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""8B4F0F0F93242BB4_86E077D7F2851E59_6036_UN""","""C[C@H](CN1C(C(N)CC[S]1(=O)=O)=O)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""CEFD5A317CD049C0_59FE1079888D2777_6036_UN""","""C[C@H](CN([S](C)(=O)=O)[C@@H]1CNCC1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""E1C9CBF0846E415D_F2C6DEE05C1DBA5B_6036_UN""","""C[C@H](CN1CCCC(Cl)(Cl)[S]1(=O)=O)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""EBAE62D2069BEFC6_B2AA6EB0592763E5_6036_UN""","""C[C@H](CN([S](C)(=O)=O)[C@H]1CNCC1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""49EAFE80B2BE7164_1AE5F464A23A7C8D_6036_UN""","""C[C@H](CN1[S](CCN(C)CC1)(=O)=O)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""CE9E183F23E06F05_9672D2E9CA93976E_6036_UN""","""C[C@H](CN1CC(=O)NCC[S]1(=O)=O)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""DAA42D2D18A6BDB2_C389CFE0673650FA_6036_UN""","""C[C@H](CN1[S](CCCCC1C)(=O)=O)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""FCF74DE8E4F8E7B4_B9218A2CC9D6BF04_6036_UN""","""C[C@H](CN(CCN)[S](=O)(=O)C1CC1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""0C570C0A5A75FFBE_DFDBACED6DFA2DF3_6036_UN""","""C[C@H](CN(CCN)[S](=O)(=O)C(F)F)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""1CA18CEAF8966552_7FDE308853F1D311_6036_UN""","""C[C@H](CN([S](CC)(=O)=O)C1CNC1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""C9257C12AD17A6D1_4D47E4B4C418876C_6036_DP""","""C[C@H](CN2CC1(CNC1)C[S]2(=O)=O)NCC3=CC=CC=C3""",21,"""91BB611CAC99D254"""
+"""7EC406F637B8082D_F7329D261DDBC306_6036_UN""","""C[C@H](CN(C)[S](=O)(=O)C1=N[NH]C=N1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""44178FF2E273358C_0BD9057614B9D3B6_6036_UN""","""C[C@H](CN(C)[S](=O)(=O)C1=C[NH]N=C1)NCC2=CC=CC=C2""",21,"""91BB611CAC99D254"""
+"""6EA12712CE363B19_35B862C1D9871B2D_6036_UN""","""C[C@H](CN(C(C)(C)CN)[S](=O)(=O)C)NCC1=CC=CC=C1""",21,"""91BB611CAC99D254"""
+"""152247289262FB9C_938374E5F4AFB2F5_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=CC=C2)OC3CCCC3""",21,"""927325B105344B29"""
+"""38BD6AB74F8569BD_3CF48CC90FBF1E09_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=C(OCC)C=C2)OCC""",21,"""927325B105344B29"""
+"""06C800A2FE891637_C0F4FB0E9054E923_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=CC(=C2)OCCC(C)C""",21,"""927325B105344B29"""
+"""38642AF2A87E6D29_9CCE03580378DF27_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""927325B105344B29"""
+"""C2FEEEA46787B572_AFE66C998416298F_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=C(C=C2)OC3CCOC3""",21,"""927325B105344B29"""
+"""B0D89691DEE5012B_640788ED5C61DD7C_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""927325B105344B29"""
+"""495FE663B94807FC_BC68ACE108A5CCF4_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=CC(=C2)COCCOC""",21,"""927325B105344B29"""
+"""44079F9DBA484139_350521E00619C798_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""927325B105344B29"""
+"""986A8D5C98EF2DA0_2A1E3503315320FD_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=CC(=C2)OC(COC)C""",21,"""927325B105344B29"""
+"""01971F3B2198A299_785FCD37BAE680D1_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""927325B105344B29"""
+"""811A8F9943A07B84_6DA62B03219B2193_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""927325B105344B29"""
+"""BF0767FD18802408_141D442FD6A11DEE_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=CC=C2)CN3CCCC3""",21,"""927325B105344B29"""
+"""176014908F5797E4_0D39602DBECDF26E_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""927325B105344B29"""
+"""A1280E81636A836C_70CD3FCF39DB4307_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=CC(=C2)OCCN(C)C""",21,"""927325B105344B29"""
+"""08CE8F556F9455BF_8710F30DA8B9E03C_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""927325B105344B29"""
+"""D47C841195EB9EF5_B037CB895FD3E388_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""927325B105344B29"""
+"""9FF9226A38A2E836_62FB350D75DCC93B_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""927325B105344B29"""
+"""3162ECF303EF82E5_B22EFB858086FD28_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""927325B105344B29"""
+"""BE78E3430D1A14AF_9DBBCFCA93A19FED_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""927325B105344B29"""
+"""F585F6BD6B32B1B1_9880316F4F914DC4_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""927325B105344B29"""
+"""708ED667A2BAC206_5D7B97982F11D1F0_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""927325B105344B29"""
+"""F4BBBF20C0BF1585_4D5707C9F0FF6504_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""927325B105344B29"""
+"""181B34F116C2C6AD_90445EF05E5C917E_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""927325B105344B29"""
+"""67FC14BE469F0276_0037BA8AC7A11BAB_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""927325B105344B29"""
+"""97BFD729069BC5ED_25160A3927AED570_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""927325B105344B29"""
+"""65905DE14A7245C5_43EBBA780E276410_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=C(OCCC(C)C)C=C2""",21,"""927325B105344B29"""
+"""88C1D49F26B0C653_BE86D96EF06DF440_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=C(C=C2)OC3CCCC3""",21,"""927325B105344B29"""
+"""51BF8405497549BA_3FB0009047969C94_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""927325B105344B29"""
+"""5FAF3AD143FF9BB6_4ACF62A23DBA3823_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""927325B105344B29"""
+"""461E4BA0BF92072D_B528A52EEABBC6CE_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""927325B105344B29"""
+"""170963B4BE118FD3_42AF4CDBC1C2EBD0_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""927325B105344B29"""
+"""E0D4B2C3FDDE7D9C_34A462C709AEECBB_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""927325B105344B29"""
+"""35D93DE4101CF5FB_F194F3FD904A85C4_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""927325B105344B29"""
+"""BD91BE2383CD42E9_9BF0C6DB6F7C8EA4_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""927325B105344B29"""
+"""7072AF89ACCE0F87_EACB74AE7E770057_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""927325B105344B29"""
+"""91E483A4370DEE2B_580098DBBC3E0915_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""927325B105344B29"""
+"""4D055AB5A2FC3507_2DCE0A5386929927_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""927325B105344B29"""
+"""9F9C6C57A9D78486_7E32520AB8E03836_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(C=CC=C2)CN3CCCC3""",21,"""927325B105344B29"""
+"""BCD19B20DF95CA39_E6E6028B0452DB8C_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=CC(=N[N]2C3CCCCO3)C""",21,"""927325B105344B29"""
+"""DCE7D6D41E3F86AE_ECE128885D2F3F71_6005_UN""","""C[N]1N=C(C=C1C(=O)O)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""927325B105344B29"""
+"""0F5C43C279F2221A_6C278473C4CB77C4_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](CCN)(=O)=O)C2CC2""",21,"""92EFFA9C1A301ADC"""
+"""B7542731631651FE_F75E54F96968786A_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""92EFFA9C1A301ADC"""
+"""68C4E0B83F4C4434_A0D1B84C87285B36_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""92EFFA9C1A301ADC"""
+"""9FD99A6BCE1D6FB6_BDC7B9F4C98022FE_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](CC)(=O)=O)CCCN""",21,"""92EFFA9C1A301ADC"""
+"""5D1CC4B0BAA1B3EB_37181C193F5417DF_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2CC(C2)N""",21,"""92EFFA9C1A301ADC"""
+"""89142307621D0CB7_71C2141E0F61955E_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""92EFFA9C1A301ADC"""
+"""31B4C674C95631A0_84239858DDF3001F_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2CNCC2""",21,"""92EFFA9C1A301ADC"""
+"""7A2756F1D8F7B8AC_3A7B934F621CA5DB_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](CC)(=O)=O)CCCBr""",21,"""92EFFA9C1A301ADC"""
+"""1E7D93B11CE6A8B3_8EA1124FC7122655_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(CCCNC)[S](=O)(=O)C""",21,"""92EFFA9C1A301ADC"""
+"""B3D662D5423CD9AE_6BCC1A294EDB3C0D_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""92EFFA9C1A301ADC"""
+"""F2204CE0EF7379CD_3987703212E4EFC5_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](=O)(=O)CC#N)C2CC2""",21,"""92EFFA9C1A301ADC"""
+"""9D358D7E067C06FD_BA531B44FA42ADD2_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""92EFFA9C1A301ADC"""
+"""455D1F2FAE5BAE19_7C554CB41E1C1921_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""92EFFA9C1A301ADC"""
+"""9AC6C10B9CD13B72_DEF3112D0E530B60_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""92EFFA9C1A301ADC"""
+"""3312BA06362072DF_13944A64D11D2B3F_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""92EFFA9C1A301ADC"""
+"""765ED300A323B036_E7E9E5D31E1D7B96_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""92EFFA9C1A301ADC"""
+"""24FC69AEDCC25332_ED1D02D382664390_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""92EFFA9C1A301ADC"""
+"""5BDE92E4993DD2DE_EF3357F2806DF3BB_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""92EFFA9C1A301ADC"""
+"""B1A19F23762EF7C1_7CF148BE5A95285F_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""92EFFA9C1A301ADC"""
+"""A451C5F1DE16904A_AC407F185CE82C7B_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""92EFFA9C1A301ADC"""
+"""7C3DED20A2E9368B_E64F18A9CB26ABF6_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""92EFFA9C1A301ADC"""
+"""7047848844CC04D9_0A7286CBC10C0FF9_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""92EFFA9C1A301ADC"""
+"""B8C5CE7687E101EE_039F32AF6A592243_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](=O)(=O)C2CC2)CC#C""",21,"""92EFFA9C1A301ADC"""
+"""22A61505CA324382_579F28248D57E785_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""92EFFA9C1A301ADC"""
+"""5F9541B93241711C_7FF467D9A853AB6D_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N2CCCC(C)(C)[S]2(=O)=O""",21,"""92EFFA9C1A301ADC"""
+"""058677B24BA91384_B4DD9C8D2195607E_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N2CCCC(CC)[S]2(=O)=O""",21,"""92EFFA9C1A301ADC"""
+"""8DD7EEE8156923EB_85B4EC57442CD6D1_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""92EFFA9C1A301ADC"""
+"""16562F50835B819C_5AAA8BF93E24EFFF_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""92EFFA9C1A301ADC"""
+"""07F7DEB559672947_F1924560EAB472D3_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""92EFFA9C1A301ADC"""
+"""C3EF8D6746DC3C2C_B1FEF530EF8EAB6D_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""92EFFA9C1A301ADC"""
+"""335C5DE031BF840C_19B16FE41493B405_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N2[S](CCN(C)CC2)(=O)=O""",21,"""92EFFA9C1A301ADC"""
+"""3BDD06DF946E65BF_952649697C3A5FE6_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N2CC(=O)NCC[S]2(=O)=O""",21,"""92EFFA9C1A301ADC"""
+"""F33E3461D2951237_C0DD5460D19F9872_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N2[S](CCCCC2C)(=O)=O""",21,"""92EFFA9C1A301ADC"""
+"""B693740DF0B89B81_BA7511AC7F7F778C_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(CCN)[S](=O)(=O)C2CC2""",21,"""92EFFA9C1A301ADC"""
+"""98E517D77487E283_DC8F376DDB53E57B_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""92EFFA9C1A301ADC"""
+"""53627BCE6194F89F_7C8AAB08E5581B99_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N([S](CC)(=O)=O)C2CNC2""",21,"""92EFFA9C1A301ADC"""
+"""5D5E1158560D4C98_4E137F3472B14FE4_6036_DP""","""C(CNCC1=CC(=CC=C1)Br)N3CC2(CNC2)C[S]3(=O)=O""",21,"""92EFFA9C1A301ADC"""
+"""CB856805C5F8248A_F46606A6AB720B8E_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""92EFFA9C1A301ADC"""
+"""42462195F4C38EB8_088D9EF6A2101B3E_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""92EFFA9C1A301ADC"""
+"""72CC2627284F3B19_36ECF9416F2ED3A5_6036_UN""","""C(CNCC1=CC(=CC=C1)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""92EFFA9C1A301ADC"""
+"""2DEC4C5912C7F061_6D7D0B54B4A30A42_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](CCN)(=O)=O)C3CC3""",21,"""93B575BB6A58675A"""
+"""FD56055741B01D93_F604DBDE190005EC_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C(C)C)[S](=O)(=O)CCN""",21,"""93B575BB6A58675A"""
+"""F708E72C448EF1A2_A18B376BF74026B0_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](C)(=O)=O)CCN=C=S""",21,"""93B575BB6A58675A"""
+"""CF4E5335ADCCCBC6_BC9D36D3B9E85F78_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](CC)(=O)=O)CCCN""",21,"""93B575BB6A58675A"""
+"""5040653D7AF418C3_3642933E4F3C6A59_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""93B575BB6A58675A"""
+"""B3EBAF0DE5923EBE_70989B397F09E8D8_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(CCCN)[S](=O)(=O)CCl""",21,"""93B575BB6A58675A"""
+"""82D3238F802EA013_8579177FAD9B7D99_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C)[S](=O)(=O)C3CNCC3""",21,"""93B575BB6A58675A"""
+"""B159CB9B17487120_3B211C681274D85D_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](CC)(=O)=O)CCCBr""",21,"""93B575BB6A58675A"""
+"""E4993709D5785020_8FFB9D68B77A5BD3_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(CCCNC)[S](=O)(=O)C""",21,"""93B575BB6A58675A"""
+"""BDFE9EC80AA34DC7_6A96950E3EB3418B_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""93B575BB6A58675A"""
+"""9F3266CCDB5E36DA_38DDFF15628C9243_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](=O)(=O)CC#N)C3CC3""",21,"""93B575BB6A58675A"""
+"""0BAEEA9149F09D53_BB0994638A2AD054_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](C)(=O)=O)C(=O)CCN""",21,"""93B575BB6A58675A"""
+"""6C5482639CC87754_7D0FC3936E7464A7_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""93B575BB6A58675A"""
+"""5F319CEADB713C44_DFA99E0A7E3B76E6_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""93B575BB6A58675A"""
+"""A723A7904B7F559C_12CEC543A17556B9_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""93B575BB6A58675A"""
+"""11969C246D7F0B9E_E6B36AF46E750610_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""93B575BB6A58675A"""
+"""ED969279F2561500_EC478DF4F20E3E16_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(CC(CC)N)[S](=O)(=O)C""",21,"""93B575BB6A58675A"""
+"""2563D052DD799565_EE69D8D5F0058E3D_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""93B575BB6A58675A"""
+"""6497D096EDB13319_7DABC7992AFD55D9_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""93B575BB6A58675A"""
+"""7BE3B0CDF65AB2E6_AD1AF03F2C8051FD_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""93B575BB6A58675A"""
+"""933CFBA73A473F60_E715978EBB4ED670_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""93B575BB6A58675A"""
+"""66B42BC9E500184C_0B2809ECB164727F_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""93B575BB6A58675A"""
+"""C255905883FABDEC_02C5BD881A315FC5_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](=O)(=O)C3CC3)CC#C""",21,"""93B575BB6A58675A"""
+"""F0BE672709CDD793_56C5A703FD3F9A03_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""93B575BB6A58675A"""
+"""224EA74515157471_7EAEE8FED83BD6EB_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""93B575BB6A58675A"""
+"""B294D65FE22FAEE1_B58713AA51FD1DF8_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N3CCCC(CC)[S]3(=O)=O""",21,"""93B575BB6A58675A"""
+"""E9D5A6A842A29C2D_84EE63703444AB57_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""93B575BB6A58675A"""
+"""B1019F97DFAFF17B_5BF004DE4E4C9279_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""93B575BB6A58675A"""
+"""C0C58E08969CA406_F0C8CA479ADC0F55_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""93B575BB6A58675A"""
+"""C96AA08ABFC5863A_B0A47A179FE6D6EB_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""93B575BB6A58675A"""
+"""5AD23B5D3515D509_18EBE0C364FBC983_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N3[S](CCN(C)CC3)(=O)=O""",21,"""93B575BB6A58675A"""
+"""4D24A00F80724646_947CC64E0C522260_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N3CC(=O)NCC[S]3(=O)=O""",21,"""93B575BB6A58675A"""
+"""EB524590B363EBE6_C187DB47A1F7E5F4_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N3[S](CCCCC3C)(=O)=O""",21,"""93B575BB6A58675A"""
+"""85C1F2B1A9B72FFB_BB2F9E8B0F170A0A_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(CCN)[S](=O)(=O)C3CC3""",21,"""93B575BB6A58675A"""
+"""DD6BCCA2CB446CD8_DDD5B84AAB3B98FD_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(CCN)[S](=O)(=O)C(F)F""",21,"""93B575BB6A58675A"""
+"""B940111CD6F45B7C_7DD0242F9530661F_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N([S](CC)(=O)=O)C3CNC3""",21,"""93B575BB6A58675A"""
+"""BC0E578D201C6EB6_4F49F01302D93262_6036_DP""","""NC2=C1OCCC(C1=CC=C2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""93B575BB6A58675A"""
+"""76CDF725D625522C_F53C8981DB1A7608_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""93B575BB6A58675A"""
+"""3BCC792EFAFB6401_09D711D1D27866B8_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""93B575BB6A58675A"""
+"""6980761F5D968E0D_37B676661F46AE23_6036_UN""","""NC2=C1OCCC(C1=CC=C2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""93B575BB6A58675A"""
+"""1FB65D849B7F3405_6D368D5E2E1D2BBF_6036_UN""","""CC2CC(C)(C)CC(N)(CN([S](CCN)(=O)=O)C1CC1)C2""",21,"""93FEF3B1F0E646A7"""
+"""85909B0F3F26F8AB_F64F5DD483BE2411_6036_UN""","""CC1CC(C)(C)CC(N)(CN(C(C)C)[S](=O)(=O)CCN)C1""",21,"""93FEF3B1F0E646A7"""
+"""E1BF79E588C96800_A1C0B1616DFE074D_6036_UN""","""CC1CC(C)(C)CC(N)(CN([S](C)(=O)=O)CCN=C=S)C1""",21,"""93FEF3B1F0E646A7"""
+"""CA20E37F9C887A3C_BCD6B0D923567E85_6036_UN""","""CC1CC(C)(C)CC(N)(CN([S](CC)(=O)=O)CCCN)C1""",21,"""93FEF3B1F0E646A7"""
+"""2B8D9CB702C3663C_36091534D5824BA4_6036_UN""","""CC2CC(C)(C)CC(N)(CN([S](C)(=O)=O)C1CC(C1)N)C2""",21,"""93FEF3B1F0E646A7"""
+"""97F68568F672F1C1_70D31D33E5B7C925_6036_UN""","""CC1CC(C)(C)CC(N)(CN(CCCN)[S](=O)(=O)CCl)C1""",21,"""93FEF3B1F0E646A7"""
+"""9DA76E73358087FC_8532917537255C64_6036_UN""","""CC2CC(C)(C)CC(N)(CN(C)[S](=O)(=O)C1CNCC1)C2""",21,"""93FEF3B1F0E646A7"""
+"""67A014EE352BE61D_3B6A9A6288CAF9A0_6036_UN""","""CC1CC(C)(C)CC(N)(CN([S](CC)(=O)=O)CCCBr)C1""",21,"""93FEF3B1F0E646A7"""
+"""728EE89D33EDC51C_8FB01B622DC47A2E_6036_UN""","""CC1CC(C)(C)CC(N)(CN(CCCNC)[S](=O)(=O)C)C1""",21,"""93FEF3B1F0E646A7"""
+"""DA086EEB6B933235_6ADD1304A40D6076_6036_UN""","""CC1CC(C)(C)CC(N)(CN(C(C)(C)C#N)[S](=O)(=O)C)C1""",21,"""93FEF3B1F0E646A7"""
+"""D6871F520629E2C8_3896791FF832B3BE_6036_UN""","""CC2CC(C)(C)CC(N)(CN([S](=O)(=O)CC#N)C1CC1)C2""",21,"""93FEF3B1F0E646A7"""
+"""4BE671061481758A_BB4212691094F1A9_6036_UN""","""CC1CC(C)(C)CC(N)(CN([S](C)(=O)=O)C(=O)CCN)C1""",21,"""93FEF3B1F0E646A7"""
+"""AF49F71D72990376_7D444599F4CA455A_6036_UN""","""CC2CC(C)(C)CC(N)(CN(C)[S](=O)(=O)C1=CC=CS1)C2""",21,"""93FEF3B1F0E646A7"""
+"""C8DD30BFB1ADE6C4_DFE21800E485571B_6036_UN""","""CC1CC(C)(C)CC(N)(CN(C(C)(C)C)[S](=O)(=O)CCl)C1""",21,"""93FEF3B1F0E646A7"""
+"""E302E00A400E56DE_128543493BCB7744_6036_UN""","""CC1CC(C)(C)CC(N)(CN(C(C)(C)C)[S](=O)(=O)CBr)C1""",21,"""93FEF3B1F0E646A7"""
+"""51BC4027BA198B13_E6F8ECFEF4CB27ED_6036_UN""","""CC1CC(C)(C)CC(N)(CN(C(C)(C)C#C)[S](=O)(=O)C)C1""",21,"""93FEF3B1F0E646A7"""
+"""E0B5A67DA005AA17_EC0C0BFE68B01FEB_6036_UN""","""CC1CC(C)(C)CC(N)(CN(CC(CC)N)[S](=O)(=O)C)C1""",21,"""93FEF3B1F0E646A7"""
+"""FA2703B55B86CA9E_EE225EDF6ABBAFC0_6036_UN""","""CC2CC(C)(C)CC(N)(CN(C)[S](=O)(=O)C1=C[NH]C=N1)C2""",21,"""93FEF3B1F0E646A7"""
+"""08FC4288EBA318FA_7DE04193B0437424_6036_UN""","""CC1CC(C)(C)CC(N)(CN([S](C)(=O)=O)CCN=[N]#N)C1""",21,"""93FEF3B1F0E646A7"""
+"""E865CA83C20993E4_AD517635B63E7000_6036_UN""","""CC1CC(C)(C)CC(N)(CN(CC(C)(C)N)[S](=O)(=O)C)C1""",21,"""93FEF3B1F0E646A7"""
+"""E0D77F47A0C8EDE3_E75E118421F0F78D_6036_UN""","""CC2CC(C)(C)CC(N)(CN1[S](CC(C)(C)C1=O)(=O)=O)C2""",21,"""93FEF3B1F0E646A7"""
+"""A81AFBC11A24CAB9_0B638FE62BDA5382_6036_UN""","""CC3CC(C)(C)CC(N)(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)C3""",21,"""93FEF3B1F0E646A7"""
+"""533ECB6B54BA792B_028E3B82808F7E38_6036_UN""","""CC2CC(C)(C)CC(N)(CN([S](=O)(=O)C1CC1)CC#C)C2""",21,"""93FEF3B1F0E646A7"""
+"""601E2964BFEA9121_568E21096781BBFE_6036_UN""","""CC3CC(C)(C)CC(N)(CN1[S](=O)(=O)C2(CCC1)CC2)C3""",21,"""93FEF3B1F0E646A7"""
+"""197977D96E793EE1_7EE56EF44285F716_6036_UN""","""CC2CC(C)(C)CC(N)(CN1CCCC(C)(C)[S]1(=O)=O)C2""",21,"""93FEF3B1F0E646A7"""
+"""29E9FFC80986F99A_B5CC95A0CB433C05_6036_UN""","""CC2CC(C)(C)CC(N)(CN1CCCC(CC)[S]1(=O)=O)C2""",21,"""93FEF3B1F0E646A7"""
+"""384C6E7EF0988445_84A5E57AAEFA8AAA_6036_UN""","""CC2CC(C)(C)CC(N)(CN1C(C(N)CC[S]1(=O)=O)=O)C2""",21,"""93FEF3B1F0E646A7"""
+"""5BA291BB3D24C786_5BBB82D4D4F2B384_6036_UN""","""CC2CC(C)(C)CC(N)(CN([S](C)(=O)=O)[C@@H]1CNCC1)C2""",21,"""93FEF3B1F0E646A7"""
+"""7A009000AC2285F2_F0834C4D00622EA8_6036_UN""","""CC2CC(C)(C)CC(N)(CN1CCCC(Cl)(Cl)[S]1(=O)=O)C2""",21,"""93FEF3B1F0E646A7"""
+"""184E5FD5A8350016_B0EFFC1D0558F716_6036_UN""","""CC2CC(C)(C)CC(N)(CN([S](C)(=O)=O)[C@H]1CNCC1)C2""",21,"""93FEF3B1F0E646A7"""
+"""144F395C396DDF98_18A066C9FE45E87E_6036_UN""","""CC2CC(C)(C)CC(N)(CN1[S](CCN(C)CC1)(=O)=O)C2""",21,"""93FEF3B1F0E646A7"""
+"""A58E0087DC449A2C_9437404496EC039D_6036_UN""","""CC2CC(C)(C)CC(N)(CN1CC(=O)NCC[S]1(=O)=O)C2""",21,"""93FEF3B1F0E646A7"""
+"""BC533683A4BA16E4_C1CC5D4D3B49C409_6036_UN""","""CC2CC(C)(C)CC(N)(CN1[S](CCCCC1C)(=O)=O)C2""",21,"""93FEF3B1F0E646A7"""
+"""6712AED22056AC41_BB64188195A92BF7_6036_UN""","""CC2CC(C)(C)CC(N)(CN(CCN)[S](=O)(=O)C1CC1)C2""",21,"""93FEF3B1F0E646A7"""
+"""86EB2BEE71FB2FF1_DD9E3E403185B900_6036_UN""","""CC1CC(C)(C)CC(N)(CN(CCN)[S](=O)(=O)C(F)F)C1""",21,"""93FEF3B1F0E646A7"""
+"""D785DEA30EA3A306_7D9BA2250F8E47E2_6036_UN""","""CC2CC(C)(C)CC(N)(CN([S](CC)(=O)=O)C1CNC1)C2""",21,"""93FEF3B1F0E646A7"""
+"""63ED9A4DAD5E856D_4F0276199867139F_6036_DP""","""CC3CC(C)(C)CC(N)(CN2CC1(CNC1)C[S]2(=O)=O)C3""",21,"""93FEF3B1F0E646A7"""
+"""336CB6DEFD0E6FCF_F5770F8B41A457F5_6036_UN""","""CC2CC(C)(C)CC(N)(CN(C)[S](=O)(=O)C1=N[NH]C=N1)C2""",21,"""93FEF3B1F0E646A7"""
+"""5A4505923AC7AF85_099C97DB48C64745_6036_UN""","""CC2CC(C)(C)CC(N)(CN(C)[S](=O)(=O)C1=C[NH]N=C1)C2""",21,"""93FEF3B1F0E646A7"""
+"""4CB3374F1BEC22E4_37FDF06C85F88FDE_6036_UN""","""CC1CC(C)(C)CC(N)(CN(C(C)(C)CN)[S](=O)(=O)C)C1""",21,"""93FEF3B1F0E646A7"""
+"""7D080CF5E964EEB8_95237183138B3101_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=CC=C2)OC3CCCC3""",21,"""94D320D7E210C8DD"""
+"""F04E04244B04EF88_3A5489AFE89B9DFD_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=C(OCC)C=C2)OCC""",21,"""94D320D7E210C8DD"""
+"""C538BDDBBEDB06AC_C654FE6877706AD7_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=CC(=C2)OCCC(C)C""",21,"""94D320D7E210C8DD"""
+"""EC4ED93A4882089D_9A6E063EE45C5CD3_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""94D320D7E210C8DD"""
+"""5CA03949AE937601_A94669FF6332AA7B_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=C(C=C2)OC3CCOC3""",21,"""94D320D7E210C8DD"""
+"""548DB1589ABD90FB_62A78D8BBB455E88_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=C(OC)C=C2)CN(C)C""",21,"""94D320D7E210C8DD"""
+"""B4017903AC62DC56_BAC8A987EF814F00_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=CC(=C2)COCCOC""",21,"""94D320D7E210C8DD"""
+"""DA275430DA210AB8_33A52486E13D446C_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=CC(=C2)CN(C)C3CC3""",21,"""94D320D7E210C8DD"""
+"""D07307340748C7FD_2CBE3065D677A309_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=CC(=C2)OC(COC)C""",21,"""94D320D7E210C8DD"""
+"""D0949EFA6C263C0C_7EFFC8515DC20325_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""94D320D7E210C8DD"""
+"""449AA9191DF7646E_6B062E65C6BFA267_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""94D320D7E210C8DD"""
+"""40F8BBB9735D275E_12BD414931859E1A_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=CC=C2)CN3CCCC3""",21,"""94D320D7E210C8DD"""
+"""D09234282488C60F_0B99654B59E9719A_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""94D320D7E210C8DD"""
+"""76B7297B82C42999_766D3AA9DEFFC0F3_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=CC(=C2)OCCN(C)C""",21,"""94D320D7E210C8DD"""
+"""C1BEDA23884ED129_81B0F66B4F9D63C8_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""94D320D7E210C8DD"""
+"""889801AB3CD6AC3C_B697CEEFB8F7607C_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""94D320D7E210C8DD"""
+"""34F5B350E3A01398_645B306B92F84ACF_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(C=CC=C2F)OC(F)(F)F""",21,"""94D320D7E210C8DD"""
+"""DA873C29B7BB3133_B48EFEE367A27EDC_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""94D320D7E210C8DD"""
+"""4A652659012EC5A0_9B1BCAAC74851C19_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""94D320D7E210C8DD"""
+"""675703B65E980B40_9E203409A8B5CE30_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""94D320D7E210C8DD"""
+"""8E80D5C4BE93A24D_5BDB92FEC8355204_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""94D320D7E210C8DD"""
+"""9B4C50386F3651CD_4BF702AF17DBE6F0_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""94D320D7E210C8DD"""
+"""085FD817C4AC79DD_96E45B96B978128A_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""94D320D7E210C8DD"""
+"""D6565AF4777C19C3_0697BFEC2085985F_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""94D320D7E210C8DD"""
+"""F3820316784B3D1C_23B60F5FC08A5684_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""94D320D7E210C8DD"""
+"""08C6CF0F69701A77_454BBF1EE903E7E4_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=C(OCCC(C)C)C=C2""",21,"""94D320D7E210C8DD"""
+"""38EEA1F91493FA9A_B826DC08174977B4_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=C(C=C2)OC3CCCC3""",21,"""94D320D7E210C8DD"""
+"""6743B28C5DAC4BD4_391005F6A0B21F60_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(C=C(OC)C=C2)CN(C)C""",21,"""94D320D7E210C8DD"""
+"""8A56229C41261281_4C6F67C4DA9EBBD7_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""94D320D7E210C8DD"""
+"""C49CC94B5CADC1CA_B388A0480D9F453A_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(C)C=C(C=C2)OCC3CC3""",21,"""94D320D7E210C8DD"""
+"""292019FFAAB30184_440F49BD26E66824_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""94D320D7E210C8DD"""
+"""8B6D14723069A5D6_320467A1EE8A6F4F_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(OCC(C)(C)C)N=CC=C2""",21,"""94D320D7E210C8DD"""
+"""683048FE0AA06F16_F734F69B776E0630_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""94D320D7E210C8DD"""
+"""F5E18A7BDDCD64BD_9D50C3BD88580D50_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""94D320D7E210C8DD"""
+"""FD65EF02AB65E7D2_EC6B71C8995383A3_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""94D320D7E210C8DD"""
+"""1850073CA4E5DF35_5EA09DBD5B1A8AE1_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""94D320D7E210C8DD"""
+"""2FD1C24B36A81F02_2B6E0F3561B61AD3_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""94D320D7E210C8DD"""
+"""8B8AEDB4A21CD991_7892576C5FC4BBC2_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(C=CC=C2)CN3CCCC3""",21,"""94D320D7E210C8DD"""
+"""FC884D7091BA77C4_E04607EDE3765878_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=CC(=N[N]2C3CCCCO3)C""",21,"""94D320D7E210C8DD"""
+"""FEEC282353191B36_EA412DEEBA0BBC85_6005_UN""","""FC(F)(F)C1=N[NH]C=C1C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""94D320D7E210C8DD"""
+"""7ADABC472EC5A776_943A13B8C2889D73_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=CC=C2)OC3CCCC3""",21,"""95CA42EC331364AF"""
+"""81DAA84751034A1D_3B4DEB943998318F_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=C(OCC)C=C2)OCC""",21,"""95CA42EC331364AF"""
+"""26746A0FD4A48A10_C74D9C53A673C6A5_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=CC(=C2)OCCC(C)C""",21,"""95CA42EC331364AF"""
+"""D264EC5CA6299EB6_9B776405355FF0A1_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""95CA42EC331364AF"""
+"""BF495925586C3EF5_A85F0BC4B2310609_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=C(C=C2)OC3CCOC3""",21,"""95CA42EC331364AF"""
+"""7AC56C07EE40CF3D_63BEEFB06A46F2FA_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""95CA42EC331364AF"""
+"""FD2441C352BDCC80_BBD1CBBC3E82E372_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=CC(=C2)COCCOC""",21,"""95CA42EC331364AF"""
+"""C24D8B6F724FF9F5_32BC46BD303EE81E_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""95CA42EC331364AF"""
+"""6628DF39BA36F9AA_2DA7525E07740F7B_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=CC(=C2)OC(COC)C""",21,"""95CA42EC331364AF"""
+"""BCDFF9F1AE65A4D0_7FE6AA6A8CC1AF57_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""95CA42EC331364AF"""
+"""BD04C848D1124F18_6A1F4C5E17BC0E15_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""95CA42EC331364AF"""
+"""3AF87F0CD2B3E16E_13A42372E0863268_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=CC=C2)CN3CCCC3""",21,"""95CA42EC331364AF"""
+"""982C20331231002E_0A80077088EADDE8_6005_UN""","""CC(C)[N]1N=CC(=C1N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""95CA42EC331364AF"""
+"""EDB6729B1BBA0B3E_777458920FFC6C81_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=CC(=C2)OCCN(C)C""",21,"""95CA42EC331364AF"""
+"""4DED4B264050849E_80A994509E9ECFBA_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""95CA42EC331364AF"""
+"""4654137F4AAE2496_B78EACD469F4CC0E_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""95CA42EC331364AF"""
+"""D6051AEE2F1E6D5F_6542525043FBE6BD_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""95CA42EC331364AF"""
+"""54FDEB2C278E0656_B5979CD8B6A1D2AE_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""95CA42EC331364AF"""
+"""C82F5C8937F8DD98_9A02A897A586B06B_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""95CA42EC331364AF"""
+"""5D01A23FB4DFA6F6_9F39563279B66242_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""95CA42EC331364AF"""
+"""21A005BA4E4E9676_5AC2F0C51936FE76_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""95CA42EC331364AF"""
+"""96CDE24DB6D1CA7F_4AEE6094C6D84A82_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""95CA42EC331364AF"""
+"""74FBF4F9C66666A0_97FD39AD687BBEF8_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""95CA42EC331364AF"""
+"""997DBEBE8C0F833A_078EDDD7F186342D_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""95CA42EC331364AF"""
+"""DA1CEFC13C4F8290_22AF6D641189FAF6_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""95CA42EC331364AF"""
+"""73CA5B39CB70DCC1_4452DD2538004B96_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=C(OCCC(C)C)C=C2""",21,"""95CA42EC331364AF"""
+"""2586C0F4981F5CA1_B93FBE33C64ADBC6_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=C(C=C2)OC3CCCC3""",21,"""95CA42EC331364AF"""
+"""AD0FD9B789446896_380967CD71B1B312_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""95CA42EC331364AF"""
+"""87262C1456EB84A0_4D7605FF0B9D17A5_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""95CA42EC331364AF"""
+"""AA6ADF1A0D4DDBDC_B291C273DC9CE948_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""95CA42EC331364AF"""
+"""9D015158E5D43E85_45162B86F7E5C456_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""95CA42EC331364AF"""
+"""D8B63DCD8A7EBB66_331D059A3F89C33D_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""95CA42EC331364AF"""
+"""D1027AB2ED94DE5B_F62D94A0A66DAA42_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""95CA42EC331364AF"""
+"""FFEF9A5B0565B7BD_9C49A186595BA122_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""95CA42EC331364AF"""
+"""0194FA94EBB04B60_ED7213F348502FD1_6005_UN""","""CC(C)[N]1N=CC(=C1N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""95CA42EC331364AF"""
+"""A110620200C694BF_5FB9FF868A192693_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""95CA42EC331364AF"""
+"""73AC9697CC33A08E_2A776D0EB0B5B6A1_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""95CA42EC331364AF"""
+"""E909249D162F1084_798B35578EC717B0_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(C=CC=C2)CN3CCCC3""",21,"""95CA42EC331364AF"""
+"""7E79EB7807451F50_E15F65D63275F40A_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""95CA42EC331364AF"""
+"""69E79B042373FB79_EB584FD56B0810F7_6005_UN""","""CC(C)[N]1N=CC(=C1N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""95CA42EC331364AF"""
+"""BD7BE2B68206EF38_68F96D046FEFA52C_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](CCN)(=O)=O)C2CC2""",21,"""963113EBB114C834"""
+"""9F582AB68B29E410_F380BD8EC24CAA82_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C(C)C)[S](=O)(=O)CCN""",21,"""963113EBB114C834"""
+"""BE706878CAC493AB_A40F513B2C0C89DE_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](C)(=O)=O)CCN=C=S""",21,"""963113EBB114C834"""
+"""D0410687F4D0AB37_B919508362A4F016_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](CC)(=O)=O)CCCN""",21,"""963113EBB114C834"""
+"""010ECDDC92179587_33C6F56E9470C537_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](C)(=O)=O)C2CC(C2)N""",21,"""963113EBB114C834"""
+"""08DCADDE87933800_751CFD69A44547B6_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(CCCN)[S](=O)(=O)CCl""",21,"""963113EBB114C834"""
+"""23D3484AE56586A8_80FD712F76D7D2F7_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2CNCC2""",21,"""963113EBB114C834"""
+"""C84A97D05089A157_3EA57A38C9387733_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](CC)(=O)=O)CCCBr""",21,"""963113EBB114C834"""
+"""1D7B7CF9109E6FB9_8A7FFB386C36F4BD_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(CCCNC)[S](=O)(=O)C""",21,"""963113EBB114C834"""
+"""702BEA6E3A2EF3DC_6F12F35EE5FFEEE5_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""963113EBB114C834"""
+"""E3F7A19C77D57EB5_3D599945B9C03D2D_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](=O)(=O)CC#N)C2CC2""",21,"""963113EBB114C834"""
+"""33B1C6C7207958A2_BE8DF23351667F3A_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""963113EBB114C834"""
+"""1720BEDC4C0DF68C_788BA5C3B538CBC9_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""963113EBB114C834"""
+"""F65E27EF3B0B2B5E_DA2DF85AA577D988_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""963113EBB114C834"""
+"""E3F78FFE14DD5525_174AA3137A39F9D7_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""963113EBB114C834"""
+"""22784685F9386CC5_E3370CA4B539A97E_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""963113EBB114C834"""
+"""BB07D81666632D2A_E9C3EBA429429178_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""963113EBB114C834"""
+"""503355F19A37903D_EBEDBE852B492153_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""963113EBB114C834"""
+"""72937D79B50DD610_782FA1C9F1B1FAB7_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""963113EBB114C834"""
+"""A2F8C5F2593643C8_A89E966FF7CCFE93_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""963113EBB114C834"""
+"""D16AEF329BB241E8_E291F1DE6002791E_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""963113EBB114C834"""
+"""9EBA0F5057BFF87E_0EAC6FBC6A28DD11_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""963113EBB114C834"""
+"""EB5F8E582FD6BAC0_0741DBD8C17DF0AB_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](=O)(=O)C2CC2)CC#C""",21,"""963113EBB114C834"""
+"""748F3F8DEA7AA0D7_5341C1532673356D_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""963113EBB114C834"""
+"""D0741F1B032FBBE5_7B2A8EAE03777985_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N2CCCC(C)(C)[S]2(=O)=O""",21,"""963113EBB114C834"""
+"""5E14B247E997CB95_B00375FA8AB1B296_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N2CCCC(CC)[S]2(=O)=O""",21,"""963113EBB114C834"""
+"""20C2D81490E0C83F_816A0520EF080439_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""963113EBB114C834"""
+"""ABB4B0D0248257F5_5E74628E95003D17_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""963113EBB114C834"""
+"""C2B60843832FFE8F_F54CAC174190A03B_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""963113EBB114C834"""
+"""F1D0B6BA06C3A835_B5201C4744AA7985_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""963113EBB114C834"""
+"""6D1C886129FA4954_1D6F8693BFB766ED_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N2[S](CCN(C)CC2)(=O)=O""",21,"""963113EBB114C834"""
+"""F13443F5DA1949F5_91F8A01ED71E8D0E_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N2CC(=O)NCC[S]2(=O)=O""",21,"""963113EBB114C834"""
+"""56E55C93E783057F_C403BD177ABB4A9A_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N2[S](CCCCC2C)(=O)=O""",21,"""963113EBB114C834"""
+"""AEE70683060920DC_BEABF8DBD45BA564_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(CCN)[S](=O)(=O)C2CC2""",21,"""963113EBB114C834"""
+"""BEFEF2B1F54E75B5_D851DE1A70773793_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(CCN)[S](=O)(=O)C(F)F""",21,"""963113EBB114C834"""
+"""D2C5223694CEC94B_7854427F4E7CC971_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N([S](CC)(=O)=O)C2CNC2""",21,"""963113EBB114C834"""
+"""6ADD2273936F3877_4ACD9643D9959D0C_6036_DP""","""CC(N)C(C1=CC(=CC=C1)F)N3CC2(CNC2)C[S]3(=O)=O""",21,"""963113EBB114C834"""
+"""438A93B8EA23E5C2_F0B8EFD10056D966_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""963113EBB114C834"""
+"""2A20F9C11F2DCA4B_0C5377810934C9D6_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""963113EBB114C834"""
+"""A257D31492602B0A_32321036C40A014D_6036_UN""","""CC(N)C(C1=CC(=CC=C1)F)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""963113EBB114C834"""
+"""BC45BB827C7FB745_974DE6F8364F6313_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=CC=C2)OC3CCCC3""",21,"""96BDB7ACC7D49ACF"""
+"""704ED3738F7192E4_383A1ED4CD5FCFEF_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=C(OCC)C=C2)OCC""",21,"""96BDB7ACC7D49ACF"""
+"""481DFA600DB317DA_C43A691352B438C5_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=CC(=C2)OCCC(C)C""",21,"""96BDB7ACC7D49ACF"""
+"""CBC9ADFA9147439E_98009145C1980EC1_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""96BDB7ACC7D49ACF"""
+"""AB7FC1AE6E0C7434_AB28FE8446F6F869_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=C(C=C2)OC3CCOC3""",21,"""96BDB7ACC7D49ACF"""
+"""E7AB4A8EA1F0CF45_60C91AF09E810C9A_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""96BDB7ACC7D49ACF"""
+"""092349708EA3F827_B8A63EFCCA451D12_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=CC(=C2)COCCOC""",21,"""96BDB7ACC7D49ACF"""
+"""CD79AB2D6C311441_31CBB3FDC4F9167E_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""96BDB7ACC7D49ACF"""
+"""919B931C9D3125E7_2ED0A71EF3B3F11B_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=CC(=C2)OC(COC)C""",21,"""96BDB7ACC7D49ACF"""
+"""3B8AD1AC560768F1_7C915F2A78065137_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""96BDB7ACC7D49ACF"""
+"""5625D53F66567584_6968B91EE37BF075_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""96BDB7ACC7D49ACF"""
+"""F34AF38174676BBE_10D3D6321441CC08_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=CC=C2)CN3CCCC3""",21,"""96BDB7ACC7D49ACF"""
+"""ECAB289E74A43939_09F7F2307C2D2388_6004_UN""","""NC1=C(C=C(C=N1)C#N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""96BDB7ACC7D49ACF"""
+"""114F75FB0AE955CF_7403ADD2FB3B92E1_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=CC(=C2)OCCN(C)C""",21,"""96BDB7ACC7D49ACF"""
+"""A1373D48536C0040_83DE61106A5931DA_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""96BDB7ACC7D49ACF"""
+"""ADFDF3E660A3AF83_B4F959949D33326E_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""96BDB7ACC7D49ACF"""
+"""41EDAF91AFFD9B3F_6635A710B73C18DD_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""96BDB7ACC7D49ACF"""
+"""E67E0CA482F1B977_B6E0699842662CCE_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""96BDB7ACC7D49ACF"""
+"""AEFA6D8A0E0A6837_99755DD751414E0B_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""96BDB7ACC7D49ACF"""
+"""8803480232A9C789_9C4EA3728D719C22_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""96BDB7ACC7D49ACF"""
+"""993E0859AC7CB57B_59B50585EDF10016_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""96BDB7ACC7D49ACF"""
+"""CC36F92F6AEFE002_499995D4321FB4E2_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""96BDB7ACC7D49ACF"""
+"""02B0FB95FE9642B5_948ACCED9CBC4098_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""96BDB7ACC7D49ACF"""
+"""CFC237E4C6DDFA5B_04F928970541CA4D_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""96BDB7ACC7D49ACF"""
+"""40B454DA07DF1D5D_21D89824E54E0496_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""96BDB7ACC7D49ACF"""
+"""B155914CC9A3456B_47252865CCC7B5F6_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=C(OCCC(C)C)C=C2""",21,"""96BDB7ACC7D49ACF"""
+"""A29BFDB4B12C7D7C_BA484B73328D25A6_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=C(C=C2)OC3CCCC3""",21,"""96BDB7ACC7D49ACF"""
+"""F3C8E462D2206DD5_3B7E928D85764D72_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""96BDB7ACC7D49ACF"""
+"""2D8F93F8FAB51A5D_4E01F0BFFF5AE9C5_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""96BDB7ACC7D49ACF"""
+"""D286C5015D4BEB03_B1E63733285B1728_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""96BDB7ACC7D49ACF"""
+"""C84DB12A7480F7D5_4661DEC603223A36_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""96BDB7ACC7D49ACF"""
+"""52C267C4F96A732A_306AF0DACB4E3D5D_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""96BDB7ACC7D49ACF"""
+"""0ABCDA1756A594CE_F55A61E052AA5422_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""96BDB7ACC7D49ACF"""
+"""4DF585BF40B65F51_9F3E54C6AD9C5F42_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""96BDB7ACC7D49ACF"""
+"""608B094A38AF59DB_EE05E6B3BC97D1B1_6004_UN""","""NC1=C(C=C(C=N1)C#N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""96BDB7ACC7D49ACF"""
+"""FC51963624C705E8_5CCE0AC67EDED8F3_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""96BDB7ACC7D49ACF"""
+"""BCCF20619842F93C_2900984E447248C1_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""96BDB7ACC7D49ACF"""
+"""B995D48D4DFAE8B1_7AFCC0177A00E9D0_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(C=CC=C2)CN3CCCC3""",21,"""96BDB7ACC7D49ACF"""
+"""27BB016D7572E274_E2289096C6B20A6A_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""96BDB7ACC7D49ACF"""
+"""B14F16D46F1E73AF_E82FBA959FCFEE97_6004_UN""","""NC1=C(C=C(C=N1)C#N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""96BDB7ACC7D49ACF"""
+"""6A4028F81E71D6A2_96B3382A4592FEAE_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=CC=C2)OC3CCCC3""",21,"""9743697EB4090772"""
+"""BE614B7141DF8A7C_39C4C006BE825252_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=C(OCC)C=C2)OCC""",21,"""9743697EB4090772"""
+"""11E77F67F0557D7A_C5C4B7C12169A578_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=CC(=C2)OCCC(C)C""",21,"""9743697EB4090772"""
+"""952427CB1376B7A3_99FE4F97B245937C_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""9743697EB4090772"""
+"""9F824BF35776F555_AAD62056352B65D4_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=C(C=C2)OC3CCOC3""",21,"""9743697EB4090772"""
+"""A57E8ED2B879CDDE_6137C422ED5C9127_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""9743697EB4090772"""
+"""41E3B07C71C7C90A_B958E02EB99880AF_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=CC(=C2)COCCOC""",21,"""9743697EB4090772"""
+"""2E381B15ACD788F4_30356D2FB7248BC3_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""9743697EB4090772"""
+"""E258184F63C80163_2F2E79CC806E6CA6_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=CC(=C2)OC(COC)C""",21,"""9743697EB4090772"""
+"""C3B2B5B70656CBB2_7D6F81F80BDBCC8A_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""9743697EB4090772"""
+"""AFFA4B4FD0E99471_689667CC90A66DC8_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""9743697EB4090772"""
+"""59FCD0CE5C840484_112D08E0679C51B5_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=CC=C2)CN3CCCC3""",21,"""9743697EB4090772"""
+"""5BF092F0DD12AC92_08092CE20FF0BE35_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""9743697EB4090772"""
+"""50CAA85359B58785_75FD730088E60F5C_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=CC(=C2)OCCN(C)C""",21,"""9743697EB4090772"""
+"""8B04A5BB634C6F56_8220BFC21984AC67_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""9743697EB4090772"""
+"""117AB0E259DB9957_B5078746EEEEAFD3_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""9743697EB4090772"""
+"""D810D66FE9E0FA09_67CB79C2C4E18560_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""9743697EB4090772"""
+"""67670CADD4EB1AD9_B71EB74A31BBB173_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""9743697EB4090772"""
+"""7A1248D53BB07B6A_988B8305229CD3B6_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""9743697EB4090772"""
+"""939DD87E1D2542BE_9DB07DA0FEAC019F_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""9743697EB4090772"""
+"""FDB05A34366AE4FE_584BDB579E2C9DAB_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""9743697EB4090772"""
+"""ACED43009F6F5EC4_48674B0641C2295F_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""9743697EB4090772"""
+"""5DE89F94FA7EF5DD_9574123FEF61DD25_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""9743697EB4090772"""
+"""90EC511286B05771_0507F645769C57F0_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""9743697EB4090772"""
+"""4B70C9DBF10AD607_202646F69693992B_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""9743697EB4090772"""
+"""801E41DCE711A6BA_46DBF6B7BF1A284B_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=C(OCCC(C)C)C=C2""",21,"""9743697EB4090772"""
+"""03A951906334AEDD_BBB695A14150B81B_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=C(C=C2)OC3CCCC3""",21,"""9743697EB4090772"""
+"""1F09E6D131E910CA_3A804C5FF6ABD0CF_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""9743697EB4090772"""
+"""3A1A3C70D1596386_4FFF2E6D8C877478_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""9743697EB4090772"""
+"""667DFF58A41CBC2A_B018E9E15B868A95_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""9743697EB4090772"""
+"""E3FB60FB34C14FB9_479F001470FFA78B_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""9743697EB4090772"""
+"""C4CD03186B3BAECC_31942E08B893A0E0_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""9743697EB4090772"""
+"""9305A7FD6FC2AE3C_F4A4BF322177C99F_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""9743697EB4090772"""
+"""46DFE14DE4CBA142_9EC08A14DE41C2FF_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""9743697EB4090772"""
+"""B663896AF6DFD7F0_EFFB3861CF4A4C0C_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""9743697EB4090772"""
+"""6DC901BCF2A4FFDD_5D30D4140D03454E_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""9743697EB4090772"""
+"""071BF6C9FD488535_28FE469C37AFD57C_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""9743697EB4090772"""
+"""A66F8403C08A3B59_7B021EC509DD746D_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(C=CC=C2)CN3CCCC3""",21,"""9743697EB4090772"""
+"""4AB320477AC07E64_E3D64E44B56F97D7_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=CC(=N[N]2C3CCCCO3)C""",21,"""9743697EB4090772"""
+"""35ECA570BD0B0578_E9D16447EC12732A_6005_UN""","""FC1=C(C(=CC(=C1)Br)F)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""9743697EB4090772"""
+"""8EDB564DB6BE0C70_69504C7DA6490321_6036_UN""","""CCOC2CC(N)(CN([S](CCN)(=O)=O)C1CC1)C2(C)C""",21,"""9798329278B26E39"""
+"""FDBF2F23AF7704C2_F2299CF70BEA0C8F_6036_UN""","""CCOC1CC(N)(CN(C(C)C)[S](=O)(=O)CCN)C1(C)C""",21,"""9798329278B26E39"""
+"""8588A32922FD55B3_A5A67042E5AA2FD3_6036_UN""","""CCOC1CC(N)(CN([S](C)(=O)=O)CCN=C=S)C1(C)C""",21,"""9798329278B26E39"""
+"""F3627064902EC95F_B8B071FAAB02561B_6036_UN""","""CCOC1CC(N)(CN([S](CC)(=O)=O)CCCN)C1(C)C""",21,"""9798329278B26E39"""
+"""6EA33F2118861048_326FD4175DD6633A_6036_UN""","""CCOC2CC(N)(CN([S](C)(=O)=O)C1CC(C1)N)C2(C)C""",21,"""9798329278B26E39"""
+"""220C2EA48B76512E_74B5DC106DE3E1BB_6036_UN""","""CCOC1CC(N)(CN(CCCN)[S](=O)(=O)CCl)C1(C)C""",21,"""9798329278B26E39"""
+"""2074304DEDE82C65_81545056BF7174FA_6036_UN""","""CCOC2CC(N)(CN(C)[S](=O)(=O)C1CNCC1)C2(C)C""",21,"""9798329278B26E39"""
+"""50EDD861B4C14A46_3F0C5B41009ED13E_6036_UN""","""CCOC1CC(N)(CN([S](CC)(=O)=O)CCCBr)C1(C)C""",21,"""9798329278B26E39"""
+"""327E919DD95F6122_8BD6DA41A59052B0_6036_UN""","""CCOC1CC(N)(CN(CCCNC)[S](=O)(=O)C)C1(C)C""",21,"""9798329278B26E39"""
+"""031C52FE1E947C84_6EBBD2272C5948E8_6036_UN""","""CCOC1CC(N)(CN(C(C)(C)C#N)[S](=O)(=O)C)C1(C)C""",21,"""9798329278B26E39"""
+"""01F73E727EFF3AA8_3CF0B83C70669B20_6036_UN""","""CCOC2CC(N)(CN([S](=O)(=O)CC#N)C1CC1)C2(C)C""",21,"""9798329278B26E39"""
+"""B1E18A8EF08673F6_BF24D34A98C0D937_6036_UN""","""CCOC1CC(N)(CN([S](C)(=O)=O)C(=O)CCN)C1(C)C""",21,"""9798329278B26E39"""
+"""C217E79ED48EB866_792284BA7C9E6DC4_6036_UN""","""CCOC2CC(N)(CN(C)[S](=O)(=O)C1=CC=CS1)C2(C)C""",21,"""9798329278B26E39"""
+"""B26CB44594278D79_DB84D9236CD17F85_6036_UN""","""CCOC1CC(N)(CN(C(C)(C)C)[S](=O)(=O)CCl)C1(C)C""",21,"""9798329278B26E39"""
+"""0DEEBDCC8BE640EF_16E3826AB39F5FDA_6036_UN""","""CCOC1CC(N)(CN(C(C)(C)C)[S](=O)(=O)CBr)C1(C)C""",21,"""9798329278B26E39"""
+"""57A7475ADFED4CC1_E29E2DDD7C9F0F73_6036_UN""","""CCOC1CC(N)(CN(C(C)(C)C#C)[S](=O)(=O)C)C1(C)C""",21,"""9798329278B26E39"""
+"""AAFCB96BAE6D7F11_E86ACADDE0E43775_6036_UN""","""CCOC1CC(N)(CN(CC(CC)N)[S](=O)(=O)C)C1(C)C""",21,"""9798329278B26E39"""
+"""2705F44519B3C4B6_EA449FFCE2EF875E_6036_UN""","""CCOC2CC(N)(CN(C)[S](=O)(=O)C1=C[NH]C=N1)C2(C)C""",21,"""9798329278B26E39"""
+"""133CB197EB37DFE9_798680B038175CBA_6036_UN""","""CCOC1CC(N)(CN([S](C)(=O)=O)CCN=[N]#N)C1(C)C""",21,"""9798329278B26E39"""
+"""9F14FE3BC31F5AFA_A937B7163E6A589E_6036_UN""","""CCOC1CC(N)(CN(CC(C)(C)N)[S](=O)(=O)C)C1(C)C""",21,"""9798329278B26E39"""
+"""90FA96027C7C91E7_E338D0A7A9A4DF13_6036_UN""","""CCOC2CC(N)(CN1[S](CC(C)(C)C1=O)(=O)=O)C2(C)C""",21,"""9798329278B26E39"""
+"""CB900EC949F583A4_0F054EC5A38E7B1C_6036_UN""","""CCOC3CC(N)(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)C3(C)C""",21,"""9798329278B26E39"""
+"""6E885AD3F66B9A90_06E8FAA108DB56A6_6036_UN""","""CCOC2CC(N)(CN([S](=O)(=O)C1CC1)CC#C)C2(C)C""",21,"""9798329278B26E39"""
+"""0B0ADF79B6B6ABA1_52E8E02AEFD59360_6036_UN""","""CCOC3CC(N)(CN1[S](=O)(=O)C2(CCC1)CC2)C3(C)C""",21,"""9798329278B26E39"""
+"""E6AEC4CDAF4B1C5F_7A83AFD7CAD1DF88_6036_UN""","""CCOC2CC(N)(CN1CCCC(C)(C)[S]1(=O)=O)C2(C)C""",21,"""9798329278B26E39"""
+"""352A352118CB6580_B1AA54834317149B_6036_UN""","""CCOC2CC(N)(CN1CCCC(CC)[S]1(=O)=O)C2(C)C""",21,"""9798329278B26E39"""
+"""56E205982568ADA9_80C3245926AEA234_6036_UN""","""CCOC2CC(N)(CN1C(C(N)CC[S]1(=O)=O)=O)C2(C)C""",21,"""9798329278B26E39"""
+"""03416FC62232634B_5FDD43F75CA69B1A_6036_UN""","""CCOC2CC(N)(CN([S](C)(=O)=O)[C@@H]1CNCC1)C2(C)C""",21,"""9798329278B26E39"""
+"""663381FC1C07F0E3_F4E58D6E88360636_6036_UN""","""CCOC2CC(N)(CN1CCCC(Cl)(Cl)[S]1(=O)=O)C2(C)C""",21,"""9798329278B26E39"""
+"""73F477FE8C1CF716_B4893D3E8D0CDF88_6036_UN""","""CCOC2CC(N)(CN([S](C)(=O)=O)[C@H]1CNCC1)C2(C)C""",21,"""9798329278B26E39"""
+"""D3D1D34E3E8EA77A_1CC6A7EA7611C0E0_6036_UN""","""CCOC2CC(N)(CN1[S](CCN(C)CC1)(=O)=O)C2(C)C""",21,"""9798329278B26E39"""
+"""95EF74D83477FE7E_905181671EB82B03_6036_UN""","""CCOC2CC(N)(CN1CC(=O)NCC[S]1(=O)=O)C2(C)C""",21,"""9798329278B26E39"""
+"""F3482418FF629312_C5AA9C6EB31DEC97_6036_UN""","""CCOC2CC(N)(CN1[S](CCCCC1C)(=O)=O)C2(C)C""",21,"""9798329278B26E39"""
+"""548C99AAE95E10CF_BF02D9A21DFD0369_6036_UN""","""CCOC2CC(N)(CN(CCN)[S](=O)(=O)C1CC1)C2(C)C""",21,"""9798329278B26E39"""
+"""8AEA072EE79F90D7_D9F8FF63B9D1919E_6036_UN""","""CCOC1CC(N)(CN(CCN)[S](=O)(=O)C(F)F)C1(C)C""",21,"""9798329278B26E39"""
+"""8570C557928AAF39_79FD630687DA6F7C_6036_UN""","""CCOC2CC(N)(CN([S](CC)(=O)=O)C1CNC1)C2(C)C""",21,"""9798329278B26E39"""
+"""7C0DAA31434D3D0D_4B64B73A10333B01_6036_DP""","""CCOC3CC(N)(CN2CC1(CNC1)C[S]2(=O)=O)C3(C)C""",21,"""9798329278B26E39"""
+"""38F6C52B4281F560_F111CEA8C9F07F6B_6036_UN""","""CCOC2CC(N)(CN(C)[S](=O)(=O)C1=N[NH]C=N1)C2(C)C""",21,"""9798329278B26E39"""
+"""3793F6AA3483184C_0DFA56F8C0926FDB_6036_UN""","""CCOC2CC(N)(CN(C)[S](=O)(=O)C1=C[NH]N=C1)C2(C)C""",21,"""9798329278B26E39"""
+"""4616ADC21E5219DD_339B314F0DACA740_6036_UN""","""CCOC1CC(N)(CN(C(C)(C)CN)[S](=O)(=O)C)C1(C)C""",21,"""9798329278B26E39"""
+"""E30F5615214F96CD_6790522C520388CD_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](CCN)(=O)=O)C2CC2""",21,"""99582CC38CF8E5D5"""
+"""D44E67D31A42AC0B_FCE982A6FFA08763_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""99582CC38CF8E5D5"""
+"""7736144E7AFF4FA7_AB666E1311E0A43F_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""99582CC38CF8E5D5"""
+"""094C179E6FC56888_B6706FAB5F48DDF7_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](CC)(=O)=O)CCCN""",21,"""99582CC38CF8E5D5"""
+"""DF802F846F2D0483_3CAFCA46A99CE8D6_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2CC(C2)N""",21,"""99582CC38CF8E5D5"""
+"""F510EEE65AD862C9_7A75C24199A96A57_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""99582CC38CF8E5D5"""
+"""0A6B3FE3DE46F273_8F944E074B3BFF16_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2CNCC2""",21,"""99582CC38CF8E5D5"""
+"""9BEF5F672272AD7E_31CC4510F4D45AD2_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](CC)(=O)=O)CCCBr""",21,"""99582CC38CF8E5D5"""
+"""BAD8377FB78A30DB_8516C41051DAD95C_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(CCCNC)[S](=O)(=O)C""",21,"""99582CC38CF8E5D5"""
+"""B9CDE82DE9E09531_607BCC76D813C304_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""99582CC38CF8E5D5"""
+"""FC98F207A35EDC9B_3230A66D842C10CC_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](=O)(=O)CC#N)C2CC2""",21,"""99582CC38CF8E5D5"""
+"""031C75F0248668D6_B1E4CD1B6C8A52DB_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""99582CC38CF8E5D5"""
+"""4AC94A7172F03FC0_77E29AEB88D4E628_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""99582CC38CF8E5D5"""
+"""D5736B52815FF61E_D544C772989BF469_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""99582CC38CF8E5D5"""
+"""3380D3BD68757B29_18239C3B47D5D436_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""99582CC38CF8E5D5"""
+"""20842426B852A953_EC5E338C88D5849F_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""99582CC38CF8E5D5"""
+"""CB28E7362DD38726_E6AAD48C14AEBC99_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""99582CC38CF8E5D5"""
+"""E31393C8E9B28211_E48481AD16A50CB2_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""99582CC38CF8E5D5"""
+"""7DFBE1056198DC1D_77469EE1CC5DD756_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""99582CC38CF8E5D5"""
+"""7817BA2F98A8AB72_A7F7A947CA20D372_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""99582CC38CF8E5D5"""
+"""5E5F76FDF274DB4C_EDF8CEF65DEE54FF_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""99582CC38CF8E5D5"""
+"""50E569316F165957_01C5509457C4F0F0_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""99582CC38CF8E5D5"""
+"""9B3744BD4D84383A_0828E4F0FC91DD4A_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](=O)(=O)C2CC2)CC#C""",21,"""99582CC38CF8E5D5"""
+"""EA0087249CE7D3E6_5C28FE7B1B9F188C_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""99582CC38CF8E5D5"""
+"""3E1C0F732BC5CC00_7443B1863E9B5464_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N2CCCC(C)(C)[S]2(=O)=O""",21,"""99582CC38CF8E5D5"""
+"""CDCE72CD2AB3DC89_BF6A4AD2B75D9F77_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N2CCCC(CC)[S]2(=O)=O""",21,"""99582CC38CF8E5D5"""
+"""8D0D5AA75FD45EB1_8E033A08D2E429D8_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""99582CC38CF8E5D5"""
+"""F08B9A6F1B76EF68_511D5DA6A8EC10F6_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""99582CC38CF8E5D5"""
+"""89231E34A2CF8B04_FA25933F7C7C8DDA_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""99582CC38CF8E5D5"""
+"""A6F0160185B82500_BA49236F79465464_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""99582CC38CF8E5D5"""
+"""8D0C4E7BCCFFB645_1206B9BB825B4B0C_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N2[S](CCN(C)CC2)(=O)=O""",21,"""99582CC38CF8E5D5"""
+"""460E6031F9D153E6_9E919F36EAF2A0EF_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N2CC(=O)NCC[S]2(=O)=O""",21,"""99582CC38CF8E5D5"""
+"""FC1E71D3D12720CE_CB6A823F4757677B_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N2[S](CCCCC2C)(=O)=O""",21,"""99582CC38CF8E5D5"""
+"""D5341BB32CA2407E_B1C2C7F3E9B78885_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(CCN)[S](=O)(=O)C2CC2""",21,"""99582CC38CF8E5D5"""
+"""21B73A074F825EDE_D738E1324D9B1A72_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""99582CC38CF8E5D5"""
+"""313E1981A5B504BB_773D7D577390E490_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N([S](CC)(=O)=O)C2CNC2""",21,"""99582CC38CF8E5D5"""
+"""3A864A3449384CC0_45A4A96BE479B0ED_6036_DP""","""C(CCOC1=CC=C(C=C1)Br)N3CC2(CNC2)C[S]3(=O)=O""",21,"""99582CC38CF8E5D5"""
+"""941916C95C85B52A_FFD1D0F93DBAF487_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""99582CC38CF8E5D5"""
+"""F18CBB8FCA9B338C_033A48A934D8E437_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""99582CC38CF8E5D5"""
+"""4714A36ED6312859_3D5B2F1EF9E62CAC_6036_UN""","""C(CCOC1=CC=C(C=C1)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""99582CC38CF8E5D5"""
+"""F7BB0EC48968B944_6795D2F37AE4D89F_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](CCN)(=O)=O)C3CC3""",21,"""995DAC1CA41FB587"""
+"""50E5675719C83243_FCEC0279D747D731_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(C(C)C)[S](=O)(=O)CCN""",21,"""995DAC1CA41FB587"""
+"""510B711BA18BD909_AB63EECC3907F46D_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](C)(=O)=O)CCN=C=S""",21,"""995DAC1CA41FB587"""
+"""941C42A0631CDF1C_B675EF7477AF8DA5_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](CC)(=O)=O)CCCN""",21,"""995DAC1CA41FB587"""
+"""952F633CDEC2CC11_3CAA4A99817BB884_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""995DAC1CA41FB587"""
+"""450EADF0B69A0088_7A70429EB14E3A05_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(CCCN)[S](=O)(=O)CCl""",21,"""995DAC1CA41FB587"""
+"""36E2F8D3B00816BB_8F91CED863DCAF44_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(C)[S](=O)(=O)C3CNCC3""",21,"""995DAC1CA41FB587"""
+"""B553F365A0689C68_31C9C5CFDC330A80_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](CC)(=O)=O)CCCBr""",21,"""995DAC1CA41FB587"""
+"""34339AFD7762E0BD_851344CF793D890E_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(CCCNC)[S](=O)(=O)C""",21,"""995DAC1CA41FB587"""
+"""CCFD307737B585E4_607E4CA9F0F49356_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""995DAC1CA41FB587"""
+"""3C4AEA8EE8E6AB03_323526B2ACCB409E_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](=O)(=O)CC#N)C3CC3""",21,"""995DAC1CA41FB587"""
+"""1A2E416613E6CB45_B1E14DC4446D0289_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](C)(=O)=O)C(=O)CCN""",21,"""995DAC1CA41FB587"""
+"""38AD98FC591AA3E4_77E71A34A033B67A_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""995DAC1CA41FB587"""
+"""4702E28A629CCA38_D54147ADB07CA43B_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""995DAC1CA41FB587"""
+"""5CFF261258A1D3E1_18261CE46F328464_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""995DAC1CA41FB587"""
+"""DD29DC15E434209F_EC5BB353A032D4CD_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""995DAC1CA41FB587"""
+"""4950778E80EDBFD7_E6AF54533C49ECCB_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(CC(CC)N)[S](=O)(=O)C""",21,"""995DAC1CA41FB587"""
+"""11560F724E2B0190_E48101723E425CE0_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""995DAC1CA41FB587"""
+"""4D4197E589D6D0A1_77431E3EE4BA8704_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""995DAC1CA41FB587"""
+"""0F664777B99AAF78_A7F22998E2C78320_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""995DAC1CA41FB587"""
+"""23A8FADCF9407CC4_EDFD4E29750904AD_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""995DAC1CA41FB587"""
+"""A2F501EB0B96DBA9_01C0D04B7F23A0A2_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""995DAC1CA41FB587"""
+"""AE4E5DC2412ADD71_082D642FD4768D18_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](=O)(=O)C3CC3)CC#C""",21,"""995DAC1CA41FB587"""
+"""2BB2BB2A1B269884_5C2D7EA4337848DE_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""995DAC1CA41FB587"""
+"""C2A281396E59DCBF_74463159167C0436_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""995DAC1CA41FB587"""
+"""FE2EA8200C4F267A_BF6FCA0D9FBACF25_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N3CCCC(CC)[S]3(=O)=O""",21,"""995DAC1CA41FB587"""
+"""2FE04BFEAA4BDC2E_8E06BAD7FA03798A_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""995DAC1CA41FB587"""
+"""46D4F24572CA57FF_5118DD79800B40A4_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""995DAC1CA41FB587"""
+"""38555FB06B2C9502_FA2013E0549BDD88_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""995DAC1CA41FB587"""
+"""B5EC492134037E3E_BA4CA3B051A10436_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""995DAC1CA41FB587"""
+"""2AFF276C15C1D98C_12033964AABC1B5E_6036_UN""","""C1(CCNCC2=C1C=CC=C2)N3[S](CCN(C)CC3)(=O)=O""",21,"""995DAC1CA41FB587"""
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+"""4D22A006CE8AC63A_9598FE3033533497_6005_UN""","""C1(=C[NH]C2=C1C=NC=C2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""9A50144BA5C6E053"""
+"""CCC9F55410DA0C75_90A30095EF63E6BE_6005_UN""","""C1(=C[NH]C2=C1C=NC=C2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""9A50144BA5C6E053"""
+"""20128CDD409FDA65_5558A6628FE37A8A_6005_UN""","""C1(=C[NH]C2=C1C=NC=C2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""9A50144BA5C6E053"""
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+"""F26319794EA6C5F2_3C87533DA95C47C1_6005_UN""","""C1(=C[NH]C2=C1C=NC=C2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""9A50144BA5C6E053"""
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+"""923627FEA12D1CCB_5023A9211CCCA26F_6005_UN""","""C1(=C[NH]C2=C1C=NC=C2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""9A50144BA5C6E053"""
+"""72C9885157D8A23E_25ED3BA92660325D_6005_UN""","""C1(=C[NH]C2=C1C=NC=C2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""9A50144BA5C6E053"""
+"""CA9F94AB5C37D42C_761163F01812934C_6005_UN""","""C1(=C[NH]C2=C1C=NC=C2)C3=C(C=CC=C3)CN4CCCC4""",21,"""9A50144BA5C6E053"""
+"""CAAD4A6F1B6C02AD_EEC53371A4A070F6_6005_UN""","""C1(=C[NH]C2=C1C=NC=C2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""9A50144BA5C6E053"""
+"""8E2D33AFC750BA0C_E4C21972FDDD940B_6005_UN""","""C1(=C[NH]C2=C1C=NC=C2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""9A50144BA5C6E053"""
+"""22366C7A46F3C379_643B34050A341F30_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](CCN)(=O)=O)C3CC3""",21,"""9AF34AEAD4CF7228"""
+"""DD980D320C06E16D_FF42E48FA797109E_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""9AF34AEAD4CF7228"""
+"""33DEFA91454E8126_A8CD083A49D733C2_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""9AF34AEAD4CF7228"""
+"""1A24E5D90E7B8305_B5DB0982077F4A0A_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](CC)(=O)=O)CCCN""",21,"""9AF34AEAD4CF7228"""
+"""7F977D283E46B1DB_3F04AC6FF1AB7F2B_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](C)(=O)=O)C3CC(C3)N""",21,"""9AF34AEAD4CF7228"""
+"""4A4EAD7C4C763388_79DEA468C19EFDAA_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""9AF34AEAD4CF7228"""
+"""9718BD5002C4D1E0_8C3F282E130C68EB_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C)[S](=O)(=O)C3CNCC3""",21,"""9AF34AEAD4CF7228"""
+"""932F5A9FCDC7DB73_32672339ACE3CD2F_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](CC)(=O)=O)CCCBr""",21,"""9AF34AEAD4CF7228"""
+"""631D9F7C960CDD79_86BDA23909ED4EA1_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(CCCNC)[S](=O)(=O)C""",21,"""9AF34AEAD4CF7228"""
+"""301BEEE89CEB1CA6_63D0AA5F802454F9_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""9AF34AEAD4CF7228"""
+"""D2D64EB9377B7595_319BC044DC1B8731_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](=O)(=O)CC#N)C3CC3""",21,"""9AF34AEAD4CF7228"""
+"""D0226566BBEAC144_B24FAB3234BDC526_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""9AF34AEAD4CF7228"""
+"""2B48147DC15325C6_7449FCC2D0E371D5_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""9AF34AEAD4CF7228"""
+"""38400C18928E76ED_D6EFA15BC0AC6394_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""9AF34AEAD4CF7228"""
+"""0F6167B43D14AE61_1B88FA121FE243CB_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""9AF34AEAD4CF7228"""
+"""E62650DBB4BF0176_EFF555A5D0E21362_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""9AF34AEAD4CF7228"""
+"""EDD9CC8F0432C2D8_E501B2A54C992B64_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""9AF34AEAD4CF7228"""
+"""F435305B8AF6AAFE_E72FE7844E929B4F_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""9AF34AEAD4CF7228"""
+"""25274E4C4301747B_74EDF8C8946A40AB_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""9AF34AEAD4CF7228"""
+"""1CF8E06D2B156635_A45CCF6E9217448F_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""9AF34AEAD4CF7228"""
+"""1A32FD215BEAB798_EE53A8DF05D9C302_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""9AF34AEAD4CF7228"""
+"""2E0D0E799779B538_026E36BD0FF3670D_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""9AF34AEAD4CF7228"""
+"""80695EB8B15A1F33_0B8382D9A4A64AB7_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](=O)(=O)C3CC3)CC#C""",21,"""9AF34AEAD4CF7228"""
+"""F5D712703A193986_5F83985243A88F71_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""9AF34AEAD4CF7228"""
+"""61C0867B2F32A490_77E8D7AF66ACC399_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N3CCCC(C)(C)[S]3(=O)=O""",21,"""9AF34AEAD4CF7228"""
+"""34FC57DB41DED8D7_BCC12CFBEF6A088A_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N3CCCC(CC)[S]3(=O)=O""",21,"""9AF34AEAD4CF7228"""
+"""468EDFBDFC8456D1_8DA85C218AD3BE25_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""9AF34AEAD4CF7228"""
+"""A9FD2AE06495B06A_52B63B8FF0DB870B_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""9AF34AEAD4CF7228"""
+"""0B2B3A44C86C8B12_F98EF516244B1A27_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""9AF34AEAD4CF7228"""
+"""9E905E95CAC70E16_B9E245462171C399_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""9AF34AEAD4CF7228"""
+"""18059007FC7C3B58_11ADDF92DA6CDCF1_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N3[S](CCN(C)CC3)(=O)=O""",21,"""9AF34AEAD4CF7228"""
+"""A38909EE37E5A3AB_9D3AF91FB2C53712_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N3CC(=O)NCC[S]3(=O)=O""",21,"""9AF34AEAD4CF7228"""
+"""B41EF156C9E3E8F1_C8C1E4161F60F086_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N3[S](CCCCC3C)(=O)=O""",21,"""9AF34AEAD4CF7228"""
+"""CA77CC9A3FB1613E_B269A1DAB1801F78_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(CCN)[S](=O)(=O)C3CC3""",21,"""9AF34AEAD4CF7228"""
+"""56970714BC858FD7_D493871B15AC8D8F_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""9AF34AEAD4CF7228"""
+"""BA7CD38781F4D243_74961B7E2BA7736D_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N([S](CC)(=O)=O)C3CNC3""",21,"""9AF34AEAD4CF7228"""
+"""1DC27C389D089BBB_460FCF42BC4E2710_6036_DP""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N4CC3(CNC3)C[S]4(=O)=O""",21,"""9AF34AEAD4CF7228"""
+"""E6500A70ED72A6A2_FC7AB6D0658D637A_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""9AF34AEAD4CF7228"""
+"""DCFF010A424BC5B9_00912E806CEF73CA_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""9AF34AEAD4CF7228"""
+"""7B06B5795D3657E4_3EF04937A1D1BB51_6036_UN""","""C1(C(=O)NC2=C1C=CC(=C2)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""9AF34AEAD4CF7228"""
+"""5CFF69BD6A61BB5C_9ABD1F2465886000_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=CC=C2)OC3CCCC3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""F7502C3CDB56247F_35CAE7089E98CCFC_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(OCC)C=C2)OCC)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""280452D42FFB6BBF_C9CA90CF01733BD6_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2)OCCC(C)C)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""B74093BA2409A98C_95F06899925F0DD2_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""DD3B90D86338D03A_A6D807581531FB7A_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(C=C2)OC3CCOC3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""0A85DC2EA3325A4B_6D39E32CCD460F89_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(OC)C=C2)CN(C)C)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""5E0AEE7D80E86FD5_B556C72099821E01_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2)COCCOC)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""B7E617BF827977FE_3C3B4A21973E156D_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2)CN(C)C3CC3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""414880B044944557_23205EC2A074F208_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2)OC(COC)C)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""D75D19B6345A8EF2_7161A6F62BC15224_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""18DFD29CC45CA39C_649840C2B0BCF366_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""F2435F5969BF6B61_1D232FEE4786CF1B_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=CC=C2)CN3CCCC3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""A4A37B04D4216D5B_04070BEC2FEA209B_6005_UN""","""CC1=C(C=C(C(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""1AACD94399669ABA_79F3540EA8FC91F2_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2)OCCN(C)C)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""5A1056D654318E09_8E2E98CC399E32C9_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""6FC321649ACC5419_B909A048CEF4317D_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(C=C2)C3=CC=CC=C3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""E1FCDF89D04CE53C_6BC55ECCE4FB1BCE_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=CC=C2F)OC(F)(F)F)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""40B929CCED3DFAE4_BB10904411A12FDD_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""A29C2E474F5C3DF6_9485A40B02864D18_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""32E43A2ADC441918_91BE5AAEDEB69F31_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2F)C(N(C)C)=O)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""27C98FE1ED2BDC6F_5445FC59BE360305_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""FF9DE93C668C42A6_44696C0861D8B7F1_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""19D8D6AAED0B593A_997A3531CF7B438B_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=CC=C2)C3=CC=CC=C3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""24D6F77BE0A09E5C_0909D14B5686C95E_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""89F5B1138B9CA801_2C2861F8B6890785_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""F892474228E059E5_4AD5D1B99F00B6E5_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(OCCC(C)C)C=C2)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""E2A2412F704BACD5_B7B8B2AF614A26B5_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(C=C2)OC3CCCC3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""CF03E58A9C6C65E4_368E6B51D6B14E61_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=C(OC)C=C2)CN(C)C)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""EF66CB07A88B52BE_43F10963AC9DEAD6_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""8C0A2C9798AAA9A1_BC16CEEF7B9C143B_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C)C=C(C=C2)OCC3CC3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""45CB6E2043E05678_4B91271A50E53925_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""21685D696D58E18E_3D9A090698893E4E_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(OCC(C)(C)C)N=CC=C2)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""92EC2424ABB0772E_F8AA983C016D5731_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""12A951828A4B539F_92CEAD1AFE5B5C51_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""AA76890DFFC155FA_E3F51F6FEF50D2A2_6005_UN""","""CC1=C(C=C(C(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""204C068D8D52AFFC_513EF31A2D19DBE0_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""D3B56B6BF5127201_24F0619217B54BD2_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=CC=C2)C3=CC=NC=C3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""9432FEB3EE65A25F_770C39CB29C7EAC3_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=CC=C2)CN3CCCC3)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""C158CE116C8A471B_EFD8694A95750979_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=N[N]2C3CCCCO3)C)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""0A26CB48D5A8C4DA_E5DF4349CC08ED84_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)Cl)Br""",21,"""9B4D4E70941399DC"""
+"""9A49B9BF9AFF1C7B_9D88AAF5F5A96ADA_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC(=CC=C3)OC4CCCC4""",21,"""9C78FBA104329306"""
+"""F963BDB44DC9ACE6_32FF52D90EB9C626_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC(=C(OCC)C=C3)OCC""",21,"""9C78FBA104329306"""
+"""45413D3D7D620912_CEFF251E9152310C_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC=CC(=C3)OCCC(C)C""",21,"""9C78FBA104329306"""
+"""4CD2ACBA01629F08_92C5DD48027E0708_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""9C78FBA104329306"""
+"""85A40337A629E0F8_A1EDB2898510F1A0_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC=C(C=C3)OC4CCOC4""",21,"""9C78FBA104329306"""
+"""A7BAEDCFA0B4F521_6A0C56FD5D670553_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""9C78FBA104329306"""
+"""664B82BAEADA24F5_B26372F109A314DB_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC=CC(=C3)COCCOC""",21,"""9C78FBA104329306"""
+"""52E245A19F3B2249_3B0EFFF0071F1FB7_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""9C78FBA104329306"""
+"""E4CE55BA62F33B1D_2415EB133055F8D2_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC=CC(=C3)OC(COC)C""",21,"""9C78FBA104329306"""
+"""D431D766CF5D435C_76541327BBE058FE_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""9C78FBA104329306"""
+"""1F359DFA24F7730A_63ADF513209DF9BC_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""9C78FBA104329306"""
+"""A2F0EF3C99AA8394_1A169A3FD7A7C5C1_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C3=CC(=CC=C3)CN4CCCC4""",21,"""9C78FBA104329306"""
+"""75F5950C1A7F3319_0332BE3DBFCB2A41_6004_UN""","""C2(=CC1=C(C(NC1)=O)S2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""9C78FBA104329306"""
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+"""554ECD8E51749194_B1D4E2B6FEC8C027_6005_UN""","""C1(=CC2=C(C=C1)SN=C2)C3=CC=C(C=C3)OC4CCCC4""",21,"""9D211E690B917F4E"""
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+"""034D2031D66502AB_BA7A9EF6E41EF2A9_6005_UN""","""C1(=CC2=C(C=C1)SN=C2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""9D211E690B917F4E"""
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+"""D206C299D091A5CD_CF2FA0F7EF184064_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=CC=CC(=C3)OCCC(C)C""",21,"""9DA87E487A78E26E"""
+"""929EB71C717DC7D5_931558A17C347660_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""9DA87E487A78E26E"""
+"""197A867634DDAA3F_A03D3760FB5A80C8_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=CC=C(C=C3)OC4CCOC4""",21,"""9DA87E487A78E26E"""
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+"""99CEEB9EA9F65E37_B3B3F71877E965B3_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=CC=CC(=C3)COCCOC""",21,"""9DA87E487A78E26E"""
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+"""8920A5BA35698A88_627D70FA5ED788D4_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""9DA87E487A78E26E"""
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+"""195B545B36A5C32F_02E23BD4C1815B29_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""9DA87E487A78E26E"""
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+"""C1E9EBD091EB218A_88CBA8F4D7F5497B_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""9DA87E487A78E26E"""
+"""D5597FDDAB1EB847_BFEC9070209F4ACF_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""9DA87E487A78E26E"""
+"""6F44559E7EBBA572_6D206EF40A90607C_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""9DA87E487A78E26E"""
+"""49926E6A232460D8_BDF5A07CFFCA546F_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""9DA87E487A78E26E"""
+"""326361D43274C102_92609433ECED36AA_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""9DA87E487A78E26E"""
+"""97B472B8F4D73FC4_975B6A9630DDE483_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""9DA87E487A78E26E"""
+"""D498D129355A3251_52A0CC61505D78B7_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""9DA87E487A78E26E"""
+"""813626F440839E66_428C5C308FB3CC43_6005_UN""","""C1(=CC2=C(C=C1)OC=C2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""9DA87E487A78E26E"""
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+"""96480D4FB92B1D75_719B07816EFA9B9B_6005_UN""","""COC1=C(C=NC(=C1)N)C2=C(C=CC=C2)CN3CCCC3""",21,"""9DDA703AD32EE884"""
+"""6339DA7B8F90E18C_E94F5700D2487821_6005_UN""","""COC1=C(C=NC(=C1)N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""9DDA703AD32EE884"""
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+"""DE4D65D9DB829126_3015C6DD9990F036_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=C(OCC)C=C2)OCC""",21,"""9E926FA5931BA516"""
+"""432E506BC95DF1DD_CC15B11A067B071C_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=CC(=C2)OCCC(C)C""",21,"""9E926FA5931BA516"""
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+"""096EB08D4B510A8E_A307268D1239C7B0_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=C(C=C2)OC3CCOC3""",21,"""9E926FA5931BA516"""
+"""096D46DA0E2072E3_68E6C2F9CA4E3343_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""9E926FA5931BA516"""
+"""CF9ACF32B3F43561_B089E6F59E8A22CB_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=CC(=C2)COCCOC""",21,"""9E926FA5931BA516"""
+"""FF8D8A33C3C8F540_39E46BF4903629A7_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""9E926FA5931BA516"""
+"""E2767E2E125CFDE0_26FF7F17A77CCEC2_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=CC(=C2)OC(COC)C""",21,"""9E926FA5931BA516"""
+"""F679B73E7D18AA80_74BE87232CC96EEE_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""9E926FA5931BA516"""
+"""18B36D87820C4B97_61476117B7B4CFAC_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""9E926FA5931BA516"""
+"""5640AB832174D034_18FC0E3B408EF3D1_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=CC=C2)CN3CCCC3""",21,"""9E926FA5931BA516"""
+"""7105400FCC6A62B9_01D82A3928E21C51_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""9E926FA5931BA516"""
+"""0D92AFACE99E1A44_7C2C75DBAFF4AD38_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=CC(=C2)OCCN(C)C""",21,"""9E926FA5931BA516"""
+"""3ABA9E2ABCFDDFFA_8BF1B9193E960E03_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""9E926FA5931BA516"""
+"""54493EB0100C5F6C_BCD6819DC9FC0DB7_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""9E926FA5931BA516"""
+"""DD10C0985353AFD6_6E1A7F19E3F32704_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""9E926FA5931BA516"""
+"""7BDC2A8B7DC87009_BECFB19116A91317_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""9E926FA5931BA516"""
+"""E8973E4E2138A3E0_915A85DE058E71D2_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""9E926FA5931BA516"""
+"""70ED382272D0B725_94617B7BD9BEA3FB_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""9E926FA5931BA516"""
+"""576FE464B8838BF3_519ADD8CB93E3FCF_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""9E926FA5931BA516"""
+"""F07AD08D1BB2D7DC_41B64DDD66D08B3B_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""9E926FA5931BA516"""
+"""759586596B422B98_9CA514E4C8737F41_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""9E926FA5931BA516"""
+"""8BA07FA9B744B1B1_0CD6F09E518EF594_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""9E926FA5931BA516"""
+"""284C27251BA4F364_29F7402DB1813B4F_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""9E926FA5931BA516"""
+"""E26A70C6FE5522A5_4F0AF06C98088A2F_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=C(OCCC(C)C)C=C2""",21,"""9E926FA5931BA516"""
+"""77B0E248B8B61243_B267937A66421A7F_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=C(C=C2)OC3CCCC3""",21,"""9E926FA5931BA516"""
+"""100A004D17D389B6_33514A84D1B972AB_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""9E926FA5931BA516"""
+"""EBBC294483BA8DC1_462E28B6AB95D61C_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""9E926FA5931BA516"""
+"""CF68C3522C8E3E97_B9C9EF3A7C9428F1_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""9E926FA5931BA516"""
+"""2E143F443F3B434B_4E4E06CF57ED05EF_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""9E926FA5931BA516"""
+"""0522D6A612557E58_384528D39F810284_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""9E926FA5931BA516"""
+"""F91F2DF9FD732A5E_FD75B9E906656BFB_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""9E926FA5931BA516"""
+"""151B5057618EF9A9_97118CCFF953609B_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""9E926FA5931BA516"""
+"""865FCE8FE6CD1153_E62A3EBAE858EE68_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""9E926FA5931BA516"""
+"""4C390B11CA03DE4E_54E1D2CF2A11E72A_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""9E926FA5931BA516"""
+"""5D64B7D764ECAFB4_212F404710BD7718_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""9E926FA5931BA516"""
+"""175C4D8063DC5B59_72D3181E2ECFD609_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(C=CC=C2)CN3CCCC3""",21,"""9E926FA5931BA516"""
+"""44B1E5B9A3D6BD97_EA07489F927D35B3_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""9E926FA5931BA516"""
+"""0DE4CF3A40298C70_E000629CCB00D14E_6005_UN""","""COC(=O)C1=CC(=C[NH]1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""9E926FA5931BA516"""
+"""0EC7EFE5040F015A_9EF62CC78C435E07_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=CC=C2)OC3CCCC3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""6B2A414763CCC5C4_3181D4EB7753F2FB_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(OCC)C=C2)OCC)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""F79C3E8309414F78_CD81A32CE8B805D1_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2)OCCC(C)C)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""2CD5272944FCF19D_91BB5B7A7B9433D5_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""EA2EF20FBAB5B48C_A29334BBFCFAC57D_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(C=C2)OC3CCOC3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""272E8454F3ED0C84_6972D0CF248D318E_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(OC)C=C2)CN(C)C)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""C919507FDFD4ABB9_B11DF4C370492006_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2)COCCOC)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""494C498AC5EB562A_387079C27EF52B6A_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2)CN(C)C3CC3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""9201B525323E45FE_276B6D2149BFCC0F_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2)OC(COC)C)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""3E3FE1004DC0F7D2_752A9515C20A6C23_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""A2069FBA9C52C5AC_60D373215977CD61_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""BE56FC0521EC64EB_19681C0DAE4DF11C_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=CC=C2)CN3CCCC3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""FFC1E5CD1F2910B0_004C380FC6211E9C_6005_UN""","""CC1=C(C=C(C(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""38BAD084F91F4DAB_7DB867ED4137AFF5_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2)OCCN(C)C)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""061B9C37EF5426B8_8A65AB2FD0550CCE_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""A2C9B0660F855E82_BD4293AB273F0F7A_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(C=C2)C3=CC=CC=C3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""A41F7886ED1FB1F5_6F8E6D2F0D3025C9_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=CC=C2F)OC(F)(F)F)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""85D29AE7AF114EFC_BF5BA3A7F86A11DA_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""8F3B35B8C045B0B2_90CE97E8EB4D731F_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""A69E59CA7DB26637_95F5694D377DA136_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=CC(=C2F)C(N(C)C)=O)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""4D20A5DF42CA19BB_500ECFBA57FD3D02_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""A92AF20123408ECC_40225FEB881389F6_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""1C12322181EE25BC_9D3106D226B07D8C_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=CC=C2)C3=CC=CC=C3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""A783E02E2A1EA4AD_0D42E2A8BF4DF759_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""0D25C7E0C25705AA_2863521B5F423982_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""B0FF75540E42EB64_4E9EE25A76CB88E2_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(OCCC(C)C)C=C2)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""905663D1D51222C3_B3F3814C888118B2_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(C=C2)OC3CCCC3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""6961ABDC9241C147_32C558B23F7A7066_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=C(OC)C=C2)CN(C)C)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""87C39F04E43482BB_47BA3A804556D4D1_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""B2C41D4DB5A0C391_B85DFD0C92572A3C_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C)C=C(C=C2)OCC3CC3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""6BC5F745397FC5C9_4FDA14F9B92E0722_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""CAD0C83851C5E962_39D13AE571420049_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(OCC(C)(C)C)N=CC=C2)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""4EF8BC35654E3315_FCE1ABDFE8A66936_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""1F02EC719259C78C_96859EF917906256_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""22F1B8A338D6D8B2_E7BE2C8C069BECA5_6005_UN""","""CC1=C(C=C(C(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""B3B716B7A95233E1_5575C0F9C4D2E5E7_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""CFDF875D2A008E26_20BB5271FE7E75D5_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=CC=C2)C3=CC=NC=C3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""AB29A109C6E07117_73470A28C00CD4C4_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=CC=C2)CN3CCCC3)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""531C5B44C67EED99_EB935AA97CBE377E_6005_UN""","""CC1=C(C=C(C(=C1)C2=CC(=N[N]2C3CCCCO3)C)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""8DE6A1338D30BEC2_E19470AA25C3D383_6005_UN""","""CC1=C(C=C(C(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)Br)Br""",21,"""9F067D937DD8A7DB"""
+"""516AC6FE3C8A2C38_9E64C836697AA49E_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""9F94996298E15D42"""
+"""58C45BDFD59D3D5A_3113301A926A0862_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""9F94996298E15D42"""
+"""34C4A698955E084D_CD1347DD0D81FF48_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""9F94996298E15D42"""
+"""6BB15C815E9862D0_9129BF8B9EADC94C_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""9F94996298E15D42"""
+"""A114FC991DCFCDEE_A201D04A19C33FE4_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""9F94996298E15D42"""
+"""962F1D1F1A3BAE79_69E0343EC1B4CB17_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""9F94996298E15D42"""
+"""FE3E464A19D56F1D_B18F10329570DA9F_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=CC(=C2)COCCOC""",21,"""9F94996298E15D42"""
+"""DF35619DCDE6458A_38E29D339BCCD1F3_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""9F94996298E15D42"""
+"""ABBD582899E51567_27F989D0AC863696_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""9F94996298E15D42"""
+"""DE0F2DC9F124753A_75B871E4273396BA_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""9F94996298E15D42"""
+"""E0A4B524C4200A65_604197D0BC4E37F8_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""9F94996298E15D42"""
+"""A248BA615879F00A_19FAF8FC4B740B85_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""9F94996298E15D42"""
+"""A15A2E4442571246_00DEDCFE2318E405_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""9F94996298E15D42"""
+"""59D0B77D85678326_7D2A831CA40E556C_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""9F94996298E15D42"""
+"""62A590693A5D47AF_8AF74FDE356CF657_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""9F94996298E15D42"""
+"""E3CE7EAA812FA490_BDD0775AC206F5E3_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""9F94996298E15D42"""
+"""DA274D3600AF9A54_6F1C89DEE809DF50_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""9F94996298E15D42"""
+"""22063361F26727BD_BFC947561D53EB43_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""9F94996298E15D42"""
+"""BAC9E42BFED2D3C8_905C73190E748986_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""9F94996298E15D42"""
+"""2EFC967EB614C2DA_95678DBCD2445BAF_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""9F94996298E15D42"""
+"""0BCB1ED2898A9BAE_509C2B4BB2C4C79B_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""9F94996298E15D42"""
+"""C30A98D018E9B1A5_40B0BB1A6D2A736F_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""9F94996298E15D42"""
+"""BF3152E86FD65647_9DA3E223C3898715_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""9F94996298E15D42"""
+"""72BBCCEC68DE6E31_0DD006595A740DC0_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""9F94996298E15D42"""
+"""58B7DB99BFD3EC4F_28F1B6EABA7BC31B_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""9F94996298E15D42"""
+"""0A18C0C8F5D4AA44_4E0C06AB93F2727B_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""9F94996298E15D42"""
+"""43D325A9AB2CC941_B36165BD6DB8E22B_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""9F94996298E15D42"""
+"""F131AB83C62CA2AE_3257BC43DA438AFF_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""9F94996298E15D42"""
+"""C54B9F4921F2D48B_4728DE71A06F2E48_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""9F94996298E15D42"""
+"""92CF023B9A19A99B_B8CF19FD776ED0A5_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""9F94996298E15D42"""
+"""F971705AB0B3D6A8_4F48F0085C17FDBB_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""9F94996298E15D42"""
+"""5459540E830408AA_3943DE14947BFAD0_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""9F94996298E15D42"""
+"""C5792071E0BB9F33_FC734F2E0D9F93AF_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""9F94996298E15D42"""
+"""2886BB8B3735A4C9_96177A08F2A998CF_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""9F94996298E15D42"""
+"""19A303F15AB96587_E72CC87DE3A2163C_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""9F94996298E15D42"""
+"""2D8E0771D2B3A9CB_55E7240821EB1F7E_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""9F94996298E15D42"""
+"""71EC54EFD00278A8_2029B6801B478F4C_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""9F94996298E15D42"""
+"""15784484995A8B49_73D5EED925352E5D_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(C=CC=C2)CN3CCCC3""",21,"""9F94996298E15D42"""
+"""52BAFD238EEE63B4_EB01BE589987CDE7_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=CC(=N[N]2C3CCCCO3)C""",21,"""9F94996298E15D42"""
+"""7FB8B385E787A5B6_E106945BC0FA291A_6005_UN""","""NCC1=CC(=CC(=C1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""9F94996298E15D42"""
+"""EB0E735E42E92293_9E0A89FEDA0C14E1_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=CC(=CC=C2)OC3CCCC3""",21,"""9FFAD8AA2B97ED3D"""
+"""9EF9C1327450878F_317D71D2211CB81D_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=CC(=C(OCC)C=C2)OCC""",21,"""9FFAD8AA2B97ED3D"""
+"""04EECD3A2794D9B4_CD7D0615BEF74F37_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=CC=CC(=C2)OCCC(C)C""",21,"""9FFAD8AA2B97ED3D"""
+"""39A6346D2B1F8179_9147FE432DDB7933_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""9FFAD8AA2B97ED3D"""
+"""9739AAEF2BF5E26D_A26F9182AAB58F9B_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=CC=C(C=C2)OC3CCOC3""",21,"""9FFAD8AA2B97ED3D"""
+"""A484E16E6B7B27E6_698E75F672C27B68_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""9FFAD8AA2B97ED3D"""
+"""BB4939EB347AD6E4_B1E151FA26066AE0_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=CC=CC(=C2)COCCOC""",21,"""9FFAD8AA2B97ED3D"""
+"""806E744427CCFBAB_388CDCFB28BA618C_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""9FFAD8AA2B97ED3D"""
+"""EC178E18298B0C83_2797C8181FF086E9_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=CC=CC(=C2)OC(COC)C""",21,"""9FFAD8AA2B97ED3D"""
+"""6BA33ACF200535C8_75D6302C944526C5_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""9FFAD8AA2B97ED3D"""
+"""99165614957495BE_602FD6180F388787_6005_UN""","""OC(=O)C1=CSC(=C1Br)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""9FFAD8AA2B97ED3D"""
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+"""14A7B07B215D509F_AEE1911876E29ECB_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""A05CB7F170AE0AC5"""
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+"""C4600B5EFF424B68_56281AAD29FB9C90_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""A05CB7F170AE0AC5"""
+"""0B5D537345E91AB2_8E473EA17D3F8D18_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC=CC(=C2)COCCOC""",21,"""A05CB7F170AE0AC5"""
+"""BB5B997264DC8C5C_072AB3A073838674_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""A05CB7F170AE0AC5"""
+"""5CDA71CDD6D3EC91_1831A74344C96111_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""A05CB7F170AE0AC5"""
+"""1261147FBD3F28A4_4A705F77CF7CC13D_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""A05CB7F170AE0AC5"""
+"""4616F4109819DD05_5F89B9435401607F_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""A05CB7F170AE0AC5"""
+"""51AAA0E3F18EED99_2632D66FA33B5C02_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""A05CB7F170AE0AC5"""
+"""CCF751BD58952DAD_3F16F26DCB57B382_6004_UN""","""NCCC1=CC(=CN=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""A05CB7F170AE0AC5"""
+"""134D09AAAE609E1E_42E2AD8F4C4102EB_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""A05CB7F170AE0AC5"""
+"""AEA332673F719817_B53F614DDD23A1D0_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""A05CB7F170AE0AC5"""
+"""26B8D668D6BCD63E_821859C92A49A264_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""A05CB7F170AE0AC5"""
+"""5D33A3DBDD4D0110_50D4A74D004688D7_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""A05CB7F170AE0AC5"""
+"""7A254E5893D815A7_800169C5F51CBCC4_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""A05CB7F170AE0AC5"""
+"""3F4189193D7B8AEC_AF945D8AE63BDE01_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A05CB7F170AE0AC5"""
+"""93DE9DA69D7D5497_AAAFA32F3A0B0C28_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""A05CB7F170AE0AC5"""
+"""A92A55ACB9D651A9_6F5405D85A8B901C_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""A05CB7F170AE0AC5"""
+"""E509EAC10304CE32_7F789589856524E8_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A05CB7F170AE0AC5"""
+"""2B305A2B4102F1DA_A26BCCB02BC6D092_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""A05CB7F170AE0AC5"""
+"""4ACC03F04A1820C5_321828CAB23B5A47_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""A05CB7F170AE0AC5"""
+"""A4F097ECFCEEFD2E_173998795234949C_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""A05CB7F170AE0AC5"""
+"""42E3E5D9493BA3B7_71C428387BBD25FC_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""A05CB7F170AE0AC5"""
+"""CE2A24C79522A425_8CA94B2E85F7B5AC_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""A05CB7F170AE0AC5"""
+"""B7DA934BD57EBFD9_0D9F92D0320CDD78_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""A05CB7F170AE0AC5"""
+"""6BA09A6B55E644A6_78E0F0E2482079CF_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""A05CB7F170AE0AC5"""
+"""172233FE43DE8DDE_8707376E9F218722_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""A05CB7F170AE0AC5"""
+"""CF5E2EBE1A45130F_7080DE9BB458AA3C_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""A05CB7F170AE0AC5"""
+"""21F4F90E819FFA4A_068BF0877C34AD57_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""A05CB7F170AE0AC5"""
+"""9AE5AA8B75130757_C3BB61BDE5D0C428_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""A05CB7F170AE0AC5"""
+"""65EB298F7883309E_A9DF549B1AE6CF48_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""A05CB7F170AE0AC5"""
+"""FA6D5B52A4CE093D_D8E4E6EE0BED41BB_6004_UN""","""NCCC1=CC(=CN=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""A05CB7F170AE0AC5"""
+"""F761867E911D9D5F_6A2F0A9BC9A448F9_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""A05CB7F170AE0AC5"""
+"""9C222A314D426023_1FE19813F308D8CB_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""A05CB7F170AE0AC5"""
+"""68C05977DB7F145A_4C1DC04ACD7A79DA_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""A05CB7F170AE0AC5"""
+"""969C0DF68179F64E_D4C990CB71C89A60_6004_UN""","""NCCC1=CC(=CN=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""A05CB7F170AE0AC5"""
+"""EF8BEBED8FC22C1F_DECEBAC828B57E9D_6004_UN""","""NCCC1=CC(=CN=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""A05CB7F170AE0AC5"""
+"""54E4A2A9D02F4ADD_A1817C2BBF6EE615_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=CC=C2)OC3CCCC3""",21,"""A0712D7F4EF51FC9"""
+"""B26DAAB104BF1662_0EF68407447E4AE9_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=C(OCC)C=C2)OCC""",21,"""A0712D7F4EF51FC9"""
+"""781222CD6661AC51_F2F6F3C0DB95BDC3_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2)OCCC(C)C""",21,"""A0712D7F4EF51FC9"""
+"""3B97F3519368C6E5_AECC0B9648B98BC7_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""A0712D7F4EF51FC9"""
+"""0CBA91F608AAFCCC_9DE46457CFD77D6F_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)OC3CCOC3""",21,"""A0712D7F4EF51FC9"""
+"""F640FD5A9E5D861C_5605802317A0899C_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""A0712D7F4EF51FC9"""
+"""76922A9994861660_8E6AA42F43649814_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2)COCCOC""",21,"""A0712D7F4EF51FC9"""
+"""7F457C816E230730_0707292E4DD89378_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""A0712D7F4EF51FC9"""
+"""CD4F6EACAB66859F_181C3DCD7A92741D_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2)OC(COC)C""",21,"""A0712D7F4EF51FC9"""
+"""F420247D51E4BB78_4A5DC5F9F127D431_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""A0712D7F4EF51FC9"""
+"""A53303FE68ACC4DB_5FA423CD6A5A7573_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""A0712D7F4EF51FC9"""
+"""C42F92EFA722E4DF_261F4CE19D60490E_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=CC=C2)CN3CCCC3""",21,"""A0712D7F4EF51FC9"""
+"""42DF416ACC895EAE_3F3B68E3F50CA68E_6005_UN""","""OC1=C(C=CC(=C1)C#N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""A0712D7F4EF51FC9"""
+"""0AEF03125635AE90_42CF3701721A17E7_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2)OCCN(C)C""",21,"""A0712D7F4EF51FC9"""
+"""5E26B607A6057648_B512FBC3E378B4DC_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""A0712D7F4EF51FC9"""
+"""99779C41CD7EA3B4_8235C3471412B768_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""A0712D7F4EF51FC9"""
+"""2FC1343C5871BA44_50F93DC33E1D9DDB_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""A0712D7F4EF51FC9"""
+"""60DB02C1030C56BB_802CF34BCB47A9C8_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""A0712D7F4EF51FC9"""
+"""6B6E0E3C438E7FDA_AFB9C704D860CB0D_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A0712D7F4EF51FC9"""
+"""E70DFD128510039D_AA8239A104501924_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""A0712D7F4EF51FC9"""
+"""C57CE2D219C79367_6F799F5664D08510_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""A0712D7F4EF51FC9"""
+"""95A16E237DB2BA6C_7F550F07BB3E31E4_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A0712D7F4EF51FC9"""
+"""508D1A09EC4482D5_A246563E159DC59E_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""A0712D7F4EF51FC9"""
+"""FE6A8A18F660276B_3235B2448C604F4B_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""A0712D7F4EF51FC9"""
+"""340A41745363FBD8_171402F76C6F8190_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""A0712D7F4EF51FC9"""
+"""ED843C1E3C487D97_71E9B2B645E630F0_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=C(OCCC(C)C)C=C2""",21,"""A0712D7F4EF51FC9"""
+"""582C9D9E77B39F23_8C84D1A0BBACA0A0_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)OC3CCCC3""",21,"""A0712D7F4EF51FC9"""
+"""5487A2E00A386D99_0DB2085E0C57C874_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""A0712D7F4EF51FC9"""
+"""8107295DD281FBAF_78CD6A6C767B6CC3_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""A0712D7F4EF51FC9"""
+"""003A1BB574CF7524_872AADE0A17A922E_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""A0712D7F4EF51FC9"""
+"""DA2A723797161316_70AD44158A03BF30_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""A0712D7F4EF51FC9"""
+"""C969743BE3B2A2E2_06A66A09426FB85B_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""A0712D7F4EF51FC9"""
+"""8468B59879CE4943_C396FB33DB8BD124_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""A0712D7F4EF51FC9"""
+"""B869792613414066_A9F2CE1524BDDA44_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""A0712D7F4EF51FC9"""
+"""E30005BC2F7DB669_D8C97C6035B654B7_6005_UN""","""OC1=C(C=CC(=C1)C#N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""A0712D7F4EF51FC9"""
+"""DC855AEC26F5D611_6A029015F7FF5DF5_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""A0712D7F4EF51FC9"""
+"""9E0A3D3F83C0F594_1FCC029DCD53CDC7_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""A0712D7F4EF51FC9"""
+"""ED01624F9AF6F130_4C305AC4F3216CD6_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(C=CC=C2)CN3CCCC3""",21,"""A0712D7F4EF51FC9"""
+"""38861BDFD858BB0F_D4E40A454F938F6C_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""A0712D7F4EF51FC9"""
+"""EE2870144D487F40_DEE3204616EE6B91_6005_UN""","""OC1=C(C=CC(=C1)C#N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""A0712D7F4EF51FC9"""
+"""B27F4C4F52F677AE_A0B25F91E06D0A47_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=CC=C2)OC3CCCC3""",21,"""A1420EC511F6F39B"""
+"""B6A9B81ACE135202_0FC5A7BD1B7DA6BB_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=C(OCC)C=C2)OCC""",21,"""A1420EC511F6F39B"""
+"""7E7E74618EACF39E_F3C5D07A84965191_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=CC(=C2)OCCC(C)C""",21,"""A1420EC511F6F39B"""
+"""1C1F7E1C50744973_AFFF282C17BA6795_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""A1420EC511F6F39B"""
+"""0EEFBA1F19C86675_9CD747ED90D4913D_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=C(C=C2)OC3CCOC3""",21,"""A1420EC511F6F39B"""
+"""20713A37632CE65A_5736A39948A365CE_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""A1420EC511F6F39B"""
+"""2605701E721A349F_8F5987951C677446_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=CC(=C2)COCCOC""",21,"""A1420EC511F6F39B"""
+"""AE6C9CD065491823_06340A9412DB7F2A_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""A1420EC511F6F39B"""
+"""1FE3596C1889B543_192F1E772591984F_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=CC(=C2)OC(COC)C""",21,"""A1420EC511F6F39B"""
+"""203B8924BA8E00BF_4B6EE643AE243863_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""A1420EC511F6F39B"""
+"""D9D12B0184A46E64_5E97007735599921_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""A1420EC511F6F39B"""
+"""D6C6851DBAC0EC8F_272C6F5BC263A55C_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=CC=C2)CN3CCCC3""",21,"""A1420EC511F6F39B"""
+"""A20A21DE18550F75_3E084B59AA0F4ADC_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""A1420EC511F6F39B"""
+"""8AB974C3C6F60887_43FC14BB2D19FBB5_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=CC(=C2)OCCN(C)C""",21,"""A1420EC511F6F39B"""
+"""879F485682EE8F32_B421D879BC7B588E_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""A1420EC511F6F39B"""
+"""6FEADFA99E591DCB_8306E0FD4B115B3A_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""A1420EC511F6F39B"""
+"""F40EEBAF75D93634_51CA1E79611E7189_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""A1420EC511F6F39B"""
+"""E45598BC8D1AD7CF_811FD0F19444459A_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""A1420EC511F6F39B"""
+"""B17226B48025CCDB_AE8AE4BE8763275F_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A1420EC511F6F39B"""
+"""8F37E0A113AF9833_ABB11A1B5B53F576_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""A1420EC511F6F39B"""
+"""B5F68C50A0177E17_6E4ABCEC3BD36942_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""A1420EC511F6F39B"""
+"""35B60409FAFB5EE9_7E662CBDE43DDDB6_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A1420EC511F6F39B"""
+"""536010D793F6B73F_A37575844A9E29CC_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""A1420EC511F6F39B"""
+"""3DE1B7FD52DA6A10_330691FED363A319_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""A1420EC511F6F39B"""
+"""DA65C5A4D57905D9_1627214D336C6DC2_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""A1420EC511F6F39B"""
+"""207F2F4FA9CB7A81_70DA910C1AE5DCA2_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=C(OCCC(C)C)C=C2""",21,"""A1420EC511F6F39B"""
+"""42CDCBF980A9AC0E_8DB7F21AE4AF4CF2_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=C(C=C2)OC3CCCC3""",21,"""A1420EC511F6F39B"""
+"""63A2DBADAD91BA4A_0C812BE453542426_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""A1420EC511F6F39B"""
+"""5E0C94A65FB428CB_79FE49D629788091_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""A1420EC511F6F39B"""
+"""B757D266B4DDA49C_86198E5AFE797E7C_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""A1420EC511F6F39B"""
+"""2F55A726897BABBF_719E67AFD5005362_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""A1420EC511F6F39B"""
+"""23CCBAE34F2AB7F5_079549B31D6C5409_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""A1420EC511F6F39B"""
+"""C59FC33AA45453E4_C2A5D88984883D76_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""A1420EC511F6F39B"""
+"""7A5873178AA61BE0_A8C1EDAF7BBE3616_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""A1420EC511F6F39B"""
+"""5BE1587022EF9ADE_D9FA5FDA6AB5B8E5_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""A1420EC511F6F39B"""
+"""1D0D03AA294FE228_6B31B3AFA8FCB1A7_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""A1420EC511F6F39B"""
+"""39F408EAE5BF6BBE_1EFF212792502195_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""A1420EC511F6F39B"""
+"""00F0885F744FF1BB_4D03797EAC228084_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(C=CC=C2)CN3CCCC3""",21,"""A1420EC511F6F39B"""
+"""BED3E29F4809A62C_D5D729FF1090633E_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=CC(=N[N]2C3CCCCO3)C""",21,"""A1420EC511F6F39B"""
+"""CF0534D6F82C16E9_DFD003FC49ED87C3_6005_UN""","""FC1=C(C(=C(C=C1)Br)F)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""A1420EC511F6F39B"""
+"""6E59B7898BC7FE68_5F404A4BF3CD64C1_6036_UN""","""CC(C)C(C1=C(C=CC=C1)N)N([S](CCN)(=O)=O)C2CC2""",21,"""A18834A42D3609D9"""
+"""FABDC9C7E49690F0_C4399AC15E6E6B6F_6036_UN""","""CC(C)C(C1=C(C=CC=C1)N)N(C(C)C)[S](=O)(=O)CCN""",21,"""A18834A42D3609D9"""
+"""5F7EFA9D172EFF4B_93B67674B02E4833_6036_UN""","""CC(C)C(C1=C(C=CC=C1)N)N([S](C)(=O)=O)CCN=C=S""",21,"""A18834A42D3609D9"""
+"""04C66E14636A65D3_8EA077CCFE8631FB_6036_UN""","""CC(C)C(C1=C(C=CC=C1)N)N([S](CC)(=O)=O)CCCN""",21,"""A18834A42D3609D9"""
+"""FB9EB6BBAB66681E_047FD221085204DA_6036_UN""","""CC(C)C(C1=C(C=CC=C1)N)N([S](C)(=O)=O)C2CC(C2)N""",21,"""A18834A42D3609D9"""
+"""0FE32B80112AB7BA_42A5DA263867865B_6036_UN""","""CC(C)C(C1=C(C=CC=C1)N)N(CCCN)[S](=O)(=O)CCl""",21,"""A18834A42D3609D9"""
+"""2CFBF50F1275E7E6_B7445660EAF5131A_6036_UN""","""CC(C)C(C1=C(C=CC=C1)N)N(C)[S](=O)(=O)C2CNCC2""",21,"""A18834A42D3609D9"""
+"""58749D3BFC93AA7C_091C5D77551AB6DE_6036_UN""","""CC(C)C(C1=C(C=CC=C1)N)N([S](CC)(=O)=O)CCCBr""",21,"""A18834A42D3609D9"""
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+"""EEE512D2CDA7390C_A3BB27B2064696D9_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""A18C5CF35D2E4C8E"""
+"""F9033F385E748BB4_33C8C3C89FBB1C0C_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""A18C5CF35D2E4C8E"""
+"""BA3C0DF1FE575568_16E9737B7FB4D2D7_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""A18C5CF35D2E4C8E"""
+"""E49C55D02D9F4FBB_7014C33A563D63B7_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=CC=C(OCCC(C)C)C=C3""",21,"""A18C5CF35D2E4C8E"""
+"""B3AE5407D762B3B6_8D79A02CA877F3E7_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=CC=C(C=C3)OC4CCCC4""",21,"""A18C5CF35D2E4C8E"""
+"""237968A7DB82EFFD_0C4F79D21F8C9B33_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""A18C5CF35D2E4C8E"""
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+"""76FDF21B2CF61987_86D7DC6CB2A1C169_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""A18C5CF35D2E4C8E"""
+"""0A4FCC644BD564C0_7150359999D8EC77_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""A18C5CF35D2E4C8E"""
+"""933921AA01515761_075B1B8551B4EB1C_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""A18C5CF35D2E4C8E"""
+"""4147EF83386AF9D4_C26B8ABFC8508263_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""A18C5CF35D2E4C8E"""
+"""6BFE00AD3B5DE7DB_A80FBF9937668903_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""A18C5CF35D2E4C8E"""
+"""B766D1538254E688_D9340DEC266D07F0_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""A18C5CF35D2E4C8E"""
+"""C107377FDB71673C_6BFFE199E4240EB2_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""A18C5CF35D2E4C8E"""
+"""598E8D0C724E9891_1E317311DE889E80_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""A18C5CF35D2E4C8E"""
+"""5F60FB58FE4CD0F3_4DCD2B48E0FA3F91_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=C(C=CC=C3)CN4CCCC4""",21,"""A18C5CF35D2E4C8E"""
+"""859156CF4FF107B1_D5197BC95C48DC2B_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""A18C5CF35D2E4C8E"""
+"""3D0C18FA66EA2C3A_DF1E51CA053538D6_6004_UN""","""C1(=C[N](N=C1)C2CNC2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""A18C5CF35D2E4C8E"""
+"""BD960C54B91FDAD6_A23B4B3803BF0497_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""A3CB1A6CF224FD4B"""
+"""A3D0CEF3EBCFC418_0D4CB314F8AFA86B_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""A3CB1A6CF224FD4B"""
+"""5B4F500F4100261F_F14CC4D367445F41_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""A3CB1A6CF224FD4B"""
+"""920ABE88D8D7C63C_AD763C85F4686945_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""A3CB1A6CF224FD4B"""
+"""DCEC4E2CF2E4DC91_9E5E534473069FED_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""A3CB1A6CF224FD4B"""
+"""86F4C72DFB624D1B_55BFB730AB716B1E_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""A3CB1A6CF224FD4B"""
+"""41DB1557A265058F_8DD0933CFFB57A96_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=CC(=C2)COCCOC)N""",21,"""A3CB1A6CF224FD4B"""
+"""67970280C6607DF3_04BD1E3DF10971FA_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""A3CB1A6CF224FD4B"""
+"""7001948E0A4B05E4_1BA60ADEC643969F_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=CC(=C2)OC(COC)C)N""",21,"""A3CB1A6CF224FD4B"""
+"""05728455A31922FE_49E7F2EA4DF636B3_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""A3CB1A6CF224FD4B"""
+"""D25F276B398B6FA6_5C1E14DED68B97F1_6004_UN""","""COC1=CC(=C(N=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""A3CB1A6CF224FD4B"""
+"""A7ECBD5E877BDE7E_25A57BF221B1AB8C_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""A3CB1A6CF224FD4B"""
+"""FEE081A605F54F1A_3C815FF049DD440C_6004_UN""","""COC1=CC(=C(N=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""A3CB1A6CF224FD4B"""
+"""2EA6C586D7726072_41750012CECBF565_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""A3CB1A6CF224FD4B"""
+"""5D61FFEE60FF1303_B6A8CCD05FA9565E_6004_UN""","""COC1=CC(=C(N=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""A3CB1A6CF224FD4B"""
+"""41C8D0DD23928732_818FF454A8C355EA_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""A3CB1A6CF224FD4B"""
+"""73355353BA732020_53430AD082CC7F59_6004_UN""","""COC1=CC(=C(N=C1)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""A3CB1A6CF224FD4B"""
+"""D9D9AE0D997045BE_8396C45877964B4A_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""A3CB1A6CF224FD4B"""
+"""3F7A0E1EC9D1FB88_AC03F01764B1298F_6004_UN""","""COC1=CC(=C(N=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""A3CB1A6CF224FD4B"""
+"""73957F763F0CF916_A9380EB2B881FBA6_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""A3CB1A6CF224FD4B"""
+"""356D1FDE8113927D_6CC3A845D8016792_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""A3CB1A6CF224FD4B"""
+"""EACFFDEA7170AEA3_7CEF381407EFD366_6004_UN""","""COC1=CC(=C(N=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""A3CB1A6CF224FD4B"""
+"""AFA353B28337A49D_A1FC612DA94C271C_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""A3CB1A6CF224FD4B"""
+"""F62B1513FD145E99_318F855730B1ADC9_6004_UN""","""COC1=CC(=C(N=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""A3CB1A6CF224FD4B"""
+"""7328884FDFE4FD93_14AE35E4D0BE6312_6004_UN""","""COC1=CC(=C(N=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""A3CB1A6CF224FD4B"""
+"""E108223A6631FD34_725385A5F937D272_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=C(OCCC(C)C)C=C2)N""",21,"""A3CB1A6CF224FD4B"""
+"""3F0268F26493A172_8F3EE6B3077D4222_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=C(C=C2)OC3CCCC3)N""",21,"""A3CB1A6CF224FD4B"""
+"""28F05952BA6C7581_0E083F4DB0862AF6_6004_UN""","""COC1=CC(=C(N=C1)C2=C(C=C(OC)C=C2)CN(C)C)N""",21,"""A3CB1A6CF224FD4B"""
+"""0714E5639454B59B_7B775D7FCAAA8E41_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)N""",21,"""A3CB1A6CF224FD4B"""
+"""F9E67413CF534E7C_84909AF31DAB70AC_6004_UN""","""COC1=CC(=C(N=C1)C2=C(C)C=C(C=C2)OCC3CC3)N""",21,"""A3CB1A6CF224FD4B"""
+"""54B85904F584A770_7317730636D25DB2_6004_UN""","""COC1=CC(=C(N=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)N""",21,"""A3CB1A6CF224FD4B"""
+"""88E49A8DCF96E0EC_051C5D1AFEBE5AD9_6004_UN""","""COC1=CC(=C(N=C1)C2=C(OCC(C)(C)C)N=CC=C2)N""",21,"""A3CB1A6CF224FD4B"""
+"""05D2E9B72FBD73B4_C02CCC20675A33A6_6004_UN""","""COC1=CC(=C(N=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)N""",21,"""A3CB1A6CF224FD4B"""
+"""72452AFEB2222FC7_AA48F906986C38C6_6004_UN""","""COC1=CC(=C(N=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)N""",21,"""A3CB1A6CF224FD4B"""
+"""76753CF6FB0C02E2_DB734B738967B635_6004_UN""","""COC1=CC(=C(N=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)N""",21,"""A3CB1A6CF224FD4B"""
+"""F1719F5E0EBEF1C3_69B8A7064B2EBF77_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)N""",21,"""A3CB1A6CF224FD4B"""
+"""00FE2DD23044B7AE_1C76358E71822F45_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=CC=C2)C3=CC=NC=C3)N""",21,"""A3CB1A6CF224FD4B"""
+"""1234FD8BD9371491_4F8A6DD74FF08E54_6004_UN""","""COC1=CC(=C(N=C1)C2=C(C=CC=C2)CN3CCCC3)N""",21,"""A3CB1A6CF224FD4B"""
+"""C9213AFC1C7EDE82_D75E3D56F3426DEE_6004_UN""","""COC1=CC(=C(N=C1)C2=CC(=N[N]2C3CCCCO3)C)N""",21,"""A3CB1A6CF224FD4B"""
+"""A650B6D36898FC2C_DD591755AA3F8913_6004_UN""","""COC1=CC(=C(N=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)N""",21,"""A3CB1A6CF224FD4B"""
+"""150FEE671EA4857C_A23BB0F464381084_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""A3CBE1A095A3E958"""
+"""94F2AF24F33ED49D_0D4C48D89F28BC78_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""A3CBE1A095A3E958"""
+"""9F111B05D2AA39BB_F14C3F1F00C34B52_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""A3CBE1A095A3E958"""
+"""ABA6D359E21DEA9D_AD76C74993EF7D56_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""A3CBE1A095A3E958"""
+"""FC9FBAC9F56E8212_9E5EA88814818BFE_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""A3CBE1A095A3E958"""
+"""2A817430E384589B_55BF4CFCCCF67F0D_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""A3CBE1A095A3E958"""
+"""26A091F83C62E7AC_8DD068F098326E85_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=CC(=C2)COCCOC""",21,"""A3CBE1A095A3E958"""
+"""973E199582B25472_04BDE5F1968E65E9_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""A3CBE1A095A3E958"""
+"""C9DBEF1C59BBB35D_1BA6F112A1C4828C_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""A3CBE1A095A3E958"""
+"""7FBBDA5AB8D8C75A_49E709262A7122A0_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""A3CBE1A095A3E958"""
+"""B7D0F67F448B238C_5C1EEF12B10C83E2_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""A3CBE1A095A3E958"""
+"""FAC109777403CFD1_25A5803E4636BF9F_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""A3CBE1A095A3E958"""
+"""20A4D21A110EE87D_3C81A43C2E5A501F_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""A3CBE1A095A3E958"""
+"""0DF46F901FDFD485_4175FBDEA94CE176_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""A3CBE1A095A3E958"""
+"""3784A13BAA7715CF_B6A8371C382E424D_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""A3CBE1A095A3E958"""
+"""97DC81496F21AD09_818F0F98CF4441F9_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""A3CBE1A095A3E958"""
+"""597EDB4FFB90693A_5343F11CE54B6B4A_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""A3CBE1A095A3E958"""
+"""5A9596201F24F392_83963F9410115F59_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""A3CBE1A095A3E958"""
+"""AF73A85120DD7782_38198F84CA9EB7F7_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""A3CBE1A095A3E958"""
+"""7B0C1AB719DEE053_AC030BDB03363D9C_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A3CBE1A095A3E958"""
+"""5F2891FB9EBD5EE8_A938F57EDF06EFB5_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""A3CBE1A095A3E958"""
+"""94D97722DC9DCFCA_6CC35389BF867381_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""A3CBE1A095A3E958"""
+"""1C5636BFF0A5BAC1_7CEFC3D86068C775_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A3CBE1A095A3E958"""
+"""22B48FBAFF7AA56B_A1FC9AE1CECB330F_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""A3CBE1A095A3E958"""
+"""E049901C71B06093_318F7E9B5736B9DA_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""A3CBE1A095A3E958"""
+"""C6B1E5B31C3F0608_14AECE28B7397701_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""A3CBE1A095A3E958"""
+"""2B59F8D75971AE9D_72537E699EB0C661_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""A3CBE1A095A3E958"""
+"""17D8F6312DE09F3F_8F3E1D7F60FA5631_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""A3CBE1A095A3E958"""
+"""68293462F7B81BDC_0E08C481D7013EE5_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""A3CBE1A095A3E958"""
+"""DE6DCA318BE2B2AB_7B77A6B3AD2D9A52_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""A3CBE1A095A3E958"""
+"""A586DDFE1E24FF14_8490613F7A2C64BF_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""A3CBE1A095A3E958"""
+"""A6A358AFEBA51B8C_731788CA515549A1_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""A3CBE1A095A3E958"""
+"""6C728C8A06B8E0BB_051CA6D699394ECA_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""A3CBE1A095A3E958"""
+"""CFF00E79E719953C_C02C37EC00DD27B5_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""A3CBE1A095A3E958"""
+"""46D76B59432F10EE_AA4802CAFFEB2CD5_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""A3CBE1A095A3E958"""
+"""B167FC5F70FD780D_DB73B0BFEEE0A226_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""A3CBE1A095A3E958"""
+"""79C78F819868A5E3_69B85CCA2CA9AB64_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""A3CBE1A095A3E958"""
+"""266986C06E2CF1E7_1C76CE4216053B56_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""A3CBE1A095A3E958"""
+"""537DB76DDD1A8846_4F8A961B28779A47_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(C=CC=C2)CN3CCCC3""",21,"""A3CBE1A095A3E958"""
+"""C4EC8BD8AE492758_DD59EC99CDB89D00_6025_UN""","""C1(=NC(=C(C(=N1)Cl)C)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""A3CBE1A095A3E958"""
+"""B2353C5816DE71CF_A5EC83B9A752E066_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""A41CD2ED56C919BA"""
+"""6E7D1BED1F9401D3_0A9B7B955C424C9A_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""A41CD2ED56C919BA"""
+"""722F68250F83D33B_F69B0C52C3A9BBB0_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""A41CD2ED56C919BA"""
+"""3011FA5242E58A72_AAA1F40450858DB4_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""A41CD2ED56C919BA"""
+"""94DBE9E903C1B79A_99899BC5D7EB7B1C_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""A41CD2ED56C919BA"""
+"""4D0BF576BE05F8C4_52687FB10F9C8FEF_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""A41CD2ED56C919BA"""
+"""EB5B53D20C06B4BF_8A075BBD5B589E67_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=CC(=C2)COCCOC)N""",21,"""A41CD2ED56C919BA"""
+"""CDB6527BE3834319_036AD6BC55E4950B_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""A41CD2ED56C919BA"""
+"""0600C7713A0BFC9C_1C71C25F62AE726E_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=CC(=C2)OC(COC)C)N""",21,"""A41CD2ED56C919BA"""
+"""28409CC30B24F196_4E303A6BE91BD242_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""A41CD2ED56C919BA"""
+"""F43FE59E2218BE59_5BC9DC5F72667300_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""A41CD2ED56C919BA"""
+"""23446AEE681969AB_2272B373855C4F7D_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""A41CD2ED56C919BA"""
+"""810AFD8F0973C2D5_3B569771ED30A0FD_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""A41CD2ED56C919BA"""
+"""703FF0A48742AA7E_46A2C8936A261194_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""A41CD2ED56C919BA"""
+"""707FFCDAA2A113C2_B17F0451FB44B2AF_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""A41CD2ED56C919BA"""
+"""9246CAB2E91C53A6_86583CD50C2EB11B_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""A41CD2ED56C919BA"""
+"""A91BDA8A8008BDF1_5494C25126219BA8_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""A41CD2ED56C919BA"""
+"""34A021671CC8A849_84410CD9D37BAFBB_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""A41CD2ED56C919BA"""
+"""3F78C4F1C1F06B7D_ABD43896C05CCD7E_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""A41CD2ED56C919BA"""
+"""25304C04ACBA651C_AEEFC6331C6C1F57_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""A41CD2ED56C919BA"""
+"""CF0F73DFC32782BF_6B1460C47CEC8363_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""A41CD2ED56C919BA"""
+"""6DC96D85D1107F87_7B38F095A3023797_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""A41CD2ED56C919BA"""
+"""236B751EDF39C076_A62BA9AC0DA1C3ED_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""A41CD2ED56C919BA"""
+"""61450427C865277D_36584DD6945C4938_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""A41CD2ED56C919BA"""
+"""AA533798130476DD_1379FD65745387E3_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""A41CD2ED56C919BA"""
+"""4AE40C9B7138631C_75844D245DDA3683_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=C(OCCC(C)C)C=C2)N""",21,"""A41CD2ED56C919BA"""
+"""65EDBFB44674AD97_88E92E32A390A6D3_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=CC=C(C=C2)OC3CCCC3)N""",21,"""A41CD2ED56C919BA"""
+"""A9FAF77F030E34E4_09DFF7CC146BCE07_6005_UN""","""NC1=C(C=C(C(=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C)N""",21,"""A41CD2ED56C919BA"""
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+"""BEB91FB26D404534_5B226AE13EEBC5C9_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""A4F764531A44AF73"""
+"""05C4EAD24FD5B87B_229905CDC9D1F9B4_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC(=CC=C2)CN3CCCC3""",21,"""A4F764531A44AF73"""
+"""FEE8F46BC234DB8F_3BBD21CFA1BD1634_6004_UN""","""N[S](=O)(=O)C1=COC=C1C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""A4F764531A44AF73"""
+"""A262CCA78D6755A3_46497E2D26ABA75D_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC=CC(=C2)OCCN(C)C""",21,"""A4F764531A44AF73"""
+"""D13BC7ACB58FB575_B194B2EFB7C90466_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""A4F764531A44AF73"""
+"""B99C9E1C53E0FEE4_86B38A6B40A307D2_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""A4F764531A44AF73"""
+"""49E39017ED18550D_547F74EF6AAC2D61_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(C=CC=C2F)OC(F)(F)F""",21,"""A4F764531A44AF73"""
+"""2C182462297A3FB2_84AABA679FF61972_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""A4F764531A44AF73"""
+"""29FA85D0117EBE2C_AB3F8E288CD17BB7_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A4F764531A44AF73"""
+"""6E84DACCCCBB3C66_AE04708D50E1A99E_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""A4F764531A44AF73"""
+"""845EE4650FC2BF18_6BFFD67A306135AA_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""A4F764531A44AF73"""
+"""AB0C889151F4D536_7BD3462BEF8F815E_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A4F764531A44AF73"""
+"""507E6F77D441A748_A6C01F12412C7524_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""A4F764531A44AF73"""
+"""8868C84C9A73626D_36B3FB68D8D1FFF1_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""A4F764531A44AF73"""
+"""12BD25B2C60600BF_13924BDB38DE312A_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""A4F764531A44AF73"""
+"""523A55693FFD8533_756FFB9A1157804A_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC=C(OCCC(C)C)C=C2""",21,"""A4F764531A44AF73"""
+"""35B0C879861C9AF6_8802988CEF1D101A_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC=C(C=C2)OC3CCCC3""",21,"""A4F764531A44AF73"""
+"""136AA3EB02E28660_0934417258E678CE_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(C=C(OC)C=C2)CN(C)C""",21,"""A4F764531A44AF73"""
+"""7828B037CC74D10B_7C4B234022CADC79_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""A4F764531A44AF73"""
+"""2BBA5786238D7265_83ACE4CCF5CB2294_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(C)C=C(C=C2)OCC3CC3""",21,"""A4F764531A44AF73"""
+"""DF8A146EB53B77CC_742B0D39DEB20F8A_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""A4F764531A44AF73"""
+"""DFE83B6338FABC8C_0220232516DE08E1_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(OCC(C)(C)C)N=CC=C2""",21,"""A4F764531A44AF73"""
+"""08C37D31F5A9FA93_C710B21F8F3A619E_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""A4F764531A44AF73"""
+"""2B370CB9EF465F11_AD748739700C6AFE_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""A4F764531A44AF73"""
+"""D34489D6B0555D98_DC4F354C6107E40D_6004_UN""","""N[S](=O)(=O)C1=COC=C1C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""A4F764531A44AF73"""
+"""592BC86BA3D731C6_6E84D939A34EED4F_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""A4F764531A44AF73"""
+"""4E8C074B3EB9D099_1B4A4BB199E27D7D_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""A4F764531A44AF73"""
+"""8646644CF7955552_48B613E8A790DC6C_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=C(C=CC=C2)CN3CCCC3""",21,"""A4F764531A44AF73"""
+"""874BB69CDE3F6C9A_D06243691B223FD6_6004_UN""","""N[S](=O)(=O)C1=COC=C1C2=CC(=N[N]2C3CCCCO3)C""",21,"""A4F764531A44AF73"""
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+"""49C36C7D69723BC5_2E1272BE5908C454_6006_UN""","""CC(=O)OCC(=O)C1=NC=C(C=C1)C2=CN=C(OC)C=C2""",21,"""A5298AC4F2E4C333"""
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+"""9A1783EDDE5F3346_7DE702992D3C81EF_6004_UN""","""Cl[S](=O)(=O)C1=C(C=N[NH]1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""A55B458A15B2F2E5"""
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+"""D1E3EABB5015B2AD_75872CE0D144521C_6004_UN""","""Cl[S](=O)(=O)C1=C(C=N[NH]1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""A55B458A15B2F2E5"""
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+"""1A92E1356CE232DC_DDE314956EF1B99B_6004_UN""","""Cl[S](=O)(=O)C1=C(C=N[NH]1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""A55B458A15B2F2E5"""
+"""1651910761CC02DC_6F28F8E0ACB8B0D9_6004_UN""","""Cl[S](=O)(=O)C1=C(C=N[NH]1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""A55B458A15B2F2E5"""
+"""93BDDC3163C478D8_1AE66A68961420EB_6004_UN""","""Cl[S](=O)(=O)C1=C(C=N[NH]1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""A55B458A15B2F2E5"""
+"""FB2581AFADFCBD37_491A3231A86681FA_6004_UN""","""Cl[S](=O)(=O)C1=C(C=N[NH]1)C2=C(C=CC=C2)CN3CCCC3""",21,"""A55B458A15B2F2E5"""
+"""9523A9E882E178A2_D1CE62B014D46240_6004_UN""","""Cl[S](=O)(=O)C1=C(C=N[NH]1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""A55B458A15B2F2E5"""
+"""1E820E4E2979EC2C_DBC948B34DA986BD_6004_UN""","""Cl[S](=O)(=O)C1=C(C=N[NH]1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""A55B458A15B2F2E5"""
+"""DE0606AD153BEEAA_A6D404D5958360CA_6004_UN""","""CC1=C(C(=NC(=C1)N)C)C2=CC(=CC=C2)OC3CCCC3""",21,"""A724558164189916"""
+"""26AC3EB29FB15DDC_09A3FCF96E93CC36_6004_UN""","""CC1=C(C(=NC(=C1)N)C)C2=CC(=C(OCC)C=C2)OCC""",21,"""A724558164189916"""
+"""916029A374630F70_F5A38B3EF1783B1C_6004_UN""","""CC1=C(C(=NC(=C1)N)C)C2=CC=CC(=C2)OCCC(C)C""",21,"""A724558164189916"""
+"""5920AFD0920B65C0_A999736862540D18_6004_UN""","""CC1=C(C(=NC(=C1)N)C)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""A724558164189916"""
+"""40158B20D74610AA_9AB11CA9E53AFBB0_6004_UN""","""CC1=C(C(=NC(=C1)N)C)C2=CC=C(C=C2)OC3CCOC3""",21,"""A724558164189916"""
+"""E3A6652F08442A5C_5150F8DD3D4D0F43_6004_UN""","""CC1=C(C(=NC(=C1)N)C)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""A724558164189916"""
+"""762AEF40BF0E42CA_893FDCD169891ECB_6004_UN""","""CC1=C(C(=NC(=C1)N)C)C2=CC=CC(=C2)COCCOC""",21,"""A724558164189916"""
+"""E39459AFDE5D138D_005251D0673515A7_6004_UN""","""CC1=C(C(=NC(=C1)N)C)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""A724558164189916"""
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+"""95663327B1785ECF_A89F3706CF223801_6005_UN""","""CCOC1=C(C=CC=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A757DD7D59B7ECC5"""
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+"""BD4FDFBA3C7C30E4_7873FF05AC7CC2E8_6005_UN""","""CCOC1=C(C=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A757DD7D59B7ECC5"""
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+"""DD22E26985873711_D3C2FA4758D17C60_6005_UN""","""CCOC1=C(C=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""A757DD7D59B7ECC5"""
+"""460DB8DA1F1855A2_D9C5D04401AC989D_6005_UN""","""CCOC1=C(C=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""A757DD7D59B7ECC5"""
+"""D3FB4BA197EACD2B_A624A1A94A7BDA5C_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""A7D4F0FDBBE02380"""
+"""B4F29059BE5E1A84_09535985B16B76A0_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""A7D4F0FDBBE02380"""
+"""646F887978B96BC8_F5532E422E80818A_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""A7D4F0FDBBE02380"""
+"""AE7F70E0A2EDF698_A969D614BDACB78E_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""A7D4F0FDBBE02380"""
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+"""888AA7BEE6884545_51A05DA1E2B5B5D5_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""A7D4F0FDBBE02380"""
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+"""52C367A24000BD66_1FB9E04F8F874854_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""A7D4F0FDBBE02380"""
+"""E68FFF594352D755_4DF8187B0432E878_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""A7D4F0FDBBE02380"""
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+"""E869632DC37B2FE2_21BA916368757547_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""A7D4F0FDBBE02380"""
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+"""62F206D5A94F6223_456AEA83870F2BAE_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""A7D4F0FDBBE02380"""
+"""D8D19A7E39877F80_B2B72641166D8895_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""A7D4F0FDBBE02380"""
+"""11B8A07E6E53E2D6_85901EC5E1078B21_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""A7D4F0FDBBE02380"""
+"""55EC645ECE069EBF_575CE041CB08A192_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""A7D4F0FDBBE02380"""
+"""E1565B2890F2640D_87892EC93E529581_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""A7D4F0FDBBE02380"""
+"""7E60F415D0D882C7_A81C1A862D75F744_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A7D4F0FDBBE02380"""
+"""C44CD22F7781B0A7_AD27E423F145256D_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""A7D4F0FDBBE02380"""
+"""D0F727F541E19116_68DC42D491C5B959_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""A7D4F0FDBBE02380"""
+"""B9926073317FF8E8_78F0D2854E2B0DAD_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A7D4F0FDBBE02380"""
+"""9C8EF4D2F68D17F1_A5E38BBCE088F9D7_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""A7D4F0FDBBE02380"""
+"""81B7DA88CD9787B4_35906FC679757302_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""A7D4F0FDBBE02380"""
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+"""F2011F23ED18D7D7_C43326B12E9EED6D_6005_UN""","""FC(F)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""A7D4F0FDBBE02380"""
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+"""E0AD7ADE2AAC679D_A963D1A048A9B813_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""A7DEF7494EE52C1D"""
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+"""4F7199CA5A38B2A1_89C57E194374ABC0_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC=CC(=C2)COCCOC""",21,"""A7DEF7494EE52C1D"""
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+"""3DD2C64B18891B7C_4DF21FCFF137E7E5_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""A7DEF7494EE52C1D"""
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+"""3FB46D14BB133184_B2BD21F5E3688708_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""A7DEF7494EE52C1D"""
+"""0143E9691FC3A70B_859A1971140284BC_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""A7DEF7494EE52C1D"""
+"""D4161907E3C09861_5756E7F53E0DAE0F_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""A7DEF7494EE52C1D"""
+"""A818785DBF663147_8783297DCB579A1C_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""A7DEF7494EE52C1D"""
+"""CB07AAF7A138BDC2_A8161D32D870F8D9_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A7DEF7494EE52C1D"""
+"""3B738BD390FE3ED7_AD2DE39704402AF0_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""A7DEF7494EE52C1D"""
+"""9009E1FB7FC0D76C_68D6456064C0B6C4_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""A7DEF7494EE52C1D"""
+"""05AB1BC025652A05_78FAD531BB2E0230_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A7DEF7494EE52C1D"""
+"""EE86BE7760ADD5FE_A5E98C08158DF64A_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""A7DEF7494EE52C1D"""
+"""64C50B1302D3EF10_359A68728C707C9F_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""A7DEF7494EE52C1D"""
+"""A247698327611FDC_10BBD8C16C7FB244_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""A7DEF7494EE52C1D"""
+"""68CC701531D95277_7646688045F60324_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC=C(OCCC(C)C)C=C2""",21,"""A7DEF7494EE52C1D"""
+"""B78424AA2E04D14D_8B2B0B96BBBC9374_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC=C(C=C2)OC3CCCC3""",21,"""A7DEF7494EE52C1D"""
+"""8E4D0CD51BBB199F_0A1DD2680C47FBA0_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""A7DEF7494EE52C1D"""
+"""2F9CB004C6270DF0_7F62B05A766B5F17_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""A7DEF7494EE52C1D"""
+"""FACDBCDEC5097930_808577D6A16AA1FA_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""A7DEF7494EE52C1D"""
+"""8FE8E8AF22B6FA05_77029E238A138CE4_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""A7DEF7494EE52C1D"""
+"""83AF0CF4A689938D_0109B03F427F8B8F_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""A7DEF7494EE52C1D"""
+"""E7B6E4B94485F3FB_C4392105DB9BE2F0_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""A7DEF7494EE52C1D"""
+"""76C05E66AD1443EF_AE5D142324ADE990_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""A7DEF7494EE52C1D"""
+"""0F24565AFD36C2E1_DF66A65635A66763_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""A7DEF7494EE52C1D"""
+"""5E5EFC29517AA0D5_6DAD4A23F7EF6E21_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""A7DEF7494EE52C1D"""
+"""88E2BEA1F8F44708_1863D8ABCD43FE13_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""A7DEF7494EE52C1D"""
+"""6120A8830F7AEFE6_4B9F80F2F3315F02_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(C=CC=C2)CN3CCCC3""",21,"""A7DEF7494EE52C1D"""
+"""427153C01B6BE843_D34BD0734F83BCB8_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""A7DEF7494EE52C1D"""
+"""553BFF281ED3AF6B_D94CFA7016FE5845_6005_UN""","""F[S](=O)(=O)C1=CC=C(S1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""A7DEF7494EE52C1D"""
+"""62DFBAAF4E76E6FF_A60319401A5B65FC_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC(=CC=C2)OC3CCCC3""",21,"""A7F34814EBC09C20"""
+"""2EF65B8002230FED_0974E16CE14BC900_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC(=C(OCC)C=C2)OCC""",21,"""A7F34814EBC09C20"""
+"""16E55D88024FE344_F57496AB7EA03E2A_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=CC(=C2)OCCC(C)C""",21,"""A7F34814EBC09C20"""
+"""A89A4259989BCE8D_A94E6EFDED8C082E_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""A7F34814EBC09C20"""
+"""027DBF5FF4D321AC_9A66013C6AE2FE86_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=C(C=C2)OC3CCOC3""",21,"""A7F34814EBC09C20"""
+"""DF83EFA3BC727499_5187E548B2950A75_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""A7F34814EBC09C20"""
+"""9B087BD141BA47DB_89E8C144E6511BFD_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=CC(=C2)COCCOC""",21,"""A7F34814EBC09C20"""
+"""1FA52379B9D57387_00854C45E8ED1091_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""A7F34814EBC09C20"""
+"""AACDB0FACB3DEBDD_1F9E58A6DFA7F7F4_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=CC(=C2)OC(COC)C""",21,"""A7F34814EBC09C20"""
+"""7179D5B1BF639D75_4DDFA092541257D8_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""A7F34814EBC09C20"""
+"""F9A497016F91BF19_582646A6CF6FF69A_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""A7F34814EBC09C20"""
+"""554ECEC5A23D6408_219D298A3855CAE7_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC(=CC=C2)CN3CCCC3""",21,"""A7F34814EBC09C20"""
+"""BAC4ADB49CF535BA_38B90D8850392567_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""A7F34814EBC09C20"""
+"""58740A227C0972CE_454D526AD72F940E_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=CC(=C2)OCCN(C)C""",21,"""A7F34814EBC09C20"""
+"""8F4B7817DA57FC4C_B2909EA8464D3735_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""A7F34814EBC09C20"""
+"""55788F724C7FA037_85B7A62CB1273481_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""A7F34814EBC09C20"""
+"""C0EDEA8BD5FAA45F_577B58A89B281E32_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""A7F34814EBC09C20"""
+"""BCBB43553071D890_87AE96206E722A21_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""A7F34814EBC09C20"""
+"""D2AE60EB7EC1FDA4_A83BA26F7D5548E4_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A7F34814EBC09C20"""
+"""EF3D5378F4BFB7AD_AD005CCAA1659ACD_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""A7F34814EBC09C20"""
+"""A661C31DDDAF9161_68FBFA3DC1E506F9_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""A7F34814EBC09C20"""
+"""470A639E974B43F8_78D76A6C1E0BB20D_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A7F34814EBC09C20"""
+"""EE08435539D53BFF_A5C43355B0A84677_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""A7F34814EBC09C20"""
+"""C8C2DA1C60BF3DF5_35B7D72F2955CCA2_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""A7F34814EBC09C20"""
+"""465AF455DD17533A_1096679CC95A0279_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""A7F34814EBC09C20"""
+"""F90DD78E0C053855_766BD7DDE0D3B319_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=C(OCCC(C)C)C=C2""",21,"""A7F34814EBC09C20"""
+"""EC66CB3A886B2528_8B06B4CB1E992349_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=C(C=C2)OC3CCCC3""",21,"""A7F34814EBC09C20"""
+"""4234FF7363F8FB52_0A306D35A9624B9D_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""A7F34814EBC09C20"""
+"""736BB145176659AB_7F4F0F07D34EEF2A_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""A7F34814EBC09C20"""
+"""B03775FD84D18166_80A8C88B044F11C7_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""A7F34814EBC09C20"""
+"""B7EFC6A1705B82E4_772F217E2F363CD9_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""A7F34814EBC09C20"""
+"""3A263ECB5EEA4EE3_01240F62E75A3BB2_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""A7F34814EBC09C20"""
+"""E4D7F0AFA314D01C_C4149E587EBE52CD_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""A7F34814EBC09C20"""
+"""169D435A62E60222_AE70AB7E818859AD_6005_UN""","""NC1=C(C(=C(C=C1)F)F)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""A7F34814EBC09C20"""
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+"""E113D0B1B77249CB_BD673BAA3E120D74_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""A804ED16939FA661"""
+"""CB14478206071B2F_8A40032EC9780EC0_6005_UN""","""CCCC1=C(C=CC=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""A804ED16939FA661"""
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+"""C6A2408CFDACEED4_A7CC076D050A72A5_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A804ED16939FA661"""
+"""14CA9C2B77CB4823_A2F7F9C8D93AA08C_6005_UN""","""CCCC1=C(C=CC=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""A804ED16939FA661"""
+"""1B9ED9BC123C4306_670C5F3FB9BA3CB8_6005_UN""","""CCCC1=C(C=CC=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""A804ED16939FA661"""
+"""D132D105A86F4CAA_7720CF6E6654884C_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A804ED16939FA661"""
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+"""7C7D247F647885C3_3A40722D510AF6E3_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""A804ED16939FA661"""
+"""AFE726FC9A0B3AB6_1F61C29EB1053838_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""A804ED16939FA661"""
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+"""EC70CF16652DBD1D_84F111C966C61908_6005_UN""","""CCCC1=C(C=CC=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""A804ED16939FA661"""
+"""2D7D96D3AECB8BED_05C7C837D13D71DC_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""A804ED16939FA661"""
+"""15D95E6529EDC4AF_70B8AA05AB11D56B_6005_UN""","""CCCC1=C(C=CC=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""A804ED16939FA661"""
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+"""EFA5375E21775487_78D8847C57690698_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""A804ED16939FA661"""
+"""E427B3C393A2C395_0ED3AA609F0501F3_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""A804ED16939FA661"""
+"""DAF8D79F1422C6E4_CBE33B5A06E1688C_6005_UN""","""CCCC1=C(C=CC=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""A804ED16939FA661"""
+"""8CBFF26A426936DD_A1870E7CF9D763EC_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""A804ED16939FA661"""
+"""AACFE8E59B92A549_D0BCBC09E8DCED1F_6005_UN""","""CCCC1=C(C=CC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""A804ED16939FA661"""
+"""014000457E34ABFD_6277507C2A95E45D_6005_UN""","""CCCC1=C(C=CC=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""A804ED16939FA661"""
+"""2AAF65F5F3C5DED8_17B9C2F41039746F_6005_UN""","""CCCC1=C(C=CC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""A804ED16939FA661"""
+"""9FC7D51F84D7951B_44459AAD2E4BD57E_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""A804ED16939FA661"""
+"""48CCE95F0A01C646_DC91CA2C92F936C4_6005_UN""","""CCCC1=C(C=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""A804ED16939FA661"""
+"""54CA40D83C21C88B_D696E02FCB84D239_6005_UN""","""CCCC1=C(C=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""A804ED16939FA661"""
+"""64456C74DBD8CBBE_56E05C8D59DC1432_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](CCN)(=O)=O)C2CC2""",21,"""A82822628727792A"""
+"""4E3B13F7B0863E41_CD998C07F47F1B9C_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C(C)C)[S](=O)(=O)CCN""",21,"""A82822628727792A"""
+"""60A62A72810CC7C9_9A1660B21A3F38C0_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](C)(=O)=O)CCN=C=S""",21,"""A82822628727792A"""
+"""26582E76B4DD3600_8700610A54974108_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](CC)(=O)=O)CCCN""",21,"""A82822628727792A"""
+"""4E6FE7A0736051B2_0DDFC4E7A2437429_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](C)(=O)=O)C2CC(C2)N""",21,"""A82822628727792A"""
+"""6D715B331E9D9393_4B05CCE09276F6A8_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(CCCN)[S](=O)(=O)CCl""",21,"""A82822628727792A"""
+"""C012B9CA52FC5C7D_BEE440A640E463E9_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2CNCC2""",21,"""A82822628727792A"""
+"""8E2756F47618B018_00BC4BB1FF0BC62D_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](CC)(=O)=O)CCCBr""",21,"""A82822628727792A"""
+"""72BEBD73013F4D5D_B466CAB15A0545A3_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(CCCNC)[S](=O)(=O)C""",21,"""A82822628727792A"""
+"""F83FDD10F8F225C4_510BC2D7D3CC5FFB_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""A82822628727792A"""
+"""98E96666F8047122_0340A8CC8FF38C33_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](=O)(=O)CC#N)C2CC2""",21,"""A82822628727792A"""
+"""45AD0812025436A3_8094C3BA6755CE24_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""A82822628727792A"""
+"""5F0C5D23B596AFBA_4692944A830B7AD7_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""A82822628727792A"""
+"""FEF90C0CB2787B9F_E434C9D393446896_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""A82822628727792A"""
+"""8B04905CDB61D4DE_2953929A4C0A48C9_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""A82822628727792A"""
+"""E7EB61F3C7E6913D_DD2E3D2D830A1860_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""A82822628727792A"""
+"""0164485E9AB408DE_D7DADA2D1F712066_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""A82822628727792A"""
+"""AC6F190C2201DE8A_D5F48F0C1D7A904D_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""A82822628727792A"""
+"""0D6C5ADA6AFA40A0_46369040C7824BA9_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""A82822628727792A"""
+"""AEBBFEF2708D42EC_9687A7E6C1FF4F8D_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""A82822628727792A"""
+"""BBEECF1F757438B6_DC88C0575631C800_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""A82822628727792A"""
+"""ACDBBE1B37DB2328_30B55E355C1B6C0F_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""A82822628727792A"""
+"""756D049EFB52E0F1_3958EA51F74E41B5_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](=O)(=O)C2CC2)CC#C""",21,"""A82822628727792A"""
+"""48476639E41EA274_6D58F0DA10408473_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""A82822628727792A"""
+"""C3840ACCAA9BE2AD_4533BF273544C89B_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N2CCCC(C)(C)[S]2(=O)=O""",21,"""A82822628727792A"""
+"""896E1AFE09AE465E_8E1A4473BC820388_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N2CCCC(CC)[S]2(=O)=O""",21,"""A82822628727792A"""
+"""7DA445A65E9FB45C_BF7334A9D93BB527_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""A82822628727792A"""
+"""2ACD463CA3223D25_606D5307A3338C09_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""A82822628727792A"""
+"""FE83D84D7C140593_CB559D9E77A31125_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""A82822628727792A"""
+"""9CC408766AE997E6_8B392DCE7299C89B_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""A82822628727792A"""
+"""747CA3411F7C62BC_2376B71A8984D7F3_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N2[S](CCN(C)CC2)(=O)=O""",21,"""A82822628727792A"""
+"""35812EAFF39B36D3_AFE19197E12D3C10_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N2CC(=O)NCC[S]2(=O)=O""",21,"""A82822628727792A"""
+"""36B4B0EE578F7FD2_FA1A8C9E4C88FB84_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N2[S](CCCCC2C)(=O)=O""",21,"""A82822628727792A"""
+"""CBEC7BB624B77B78_80B2C952E268147A_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(CCN)[S](=O)(=O)C2CC2""",21,"""A82822628727792A"""
+"""3787337C22401ECF_E648EF934644868D_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(CCN)[S](=O)(=O)C(F)F""",21,"""A82822628727792A"""
+"""BFD47B6ACE4064EE_464D73F6784F786F_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N([S](CC)(=O)=O)C2CNC2""",21,"""A82822628727792A"""
+"""355239566F06EF8A_74D4A7CAEFA62C12_6036_DP""","""C(CNCC1=CC(=CC=C1)F)N3CC2(CNC2)C[S]3(=O)=O""",21,"""A82822628727792A"""
+"""BECC3FB9B13D8A6F_CEA1DE5836656878_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""A82822628727792A"""
+"""878962E53000C14D_324A46083F0778C8_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""A82822628727792A"""
+"""3368EF3F596AB275_0C2B21BFF239B053_6036_UN""","""C(CNCC1=CC(=CC=C1)F)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""A82822628727792A"""
+"""2D4996174D3781FA_A99843738F022A40_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=CC=C2)OC3CCCC3""",21,"""A86812277E99D39C"""
+"""C102844E1C21B02A_06EFBB5F741286BC_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=C(OCC)C=C2)OCC""",21,"""A86812277E99D39C"""
+"""3005136240840F89_FAEFCC98EBF97196_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=CC(=C2)OCCC(C)C""",21,"""A86812277E99D39C"""
+"""D33A0DFBEF52383D_A6D534CE78D54792_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""A86812277E99D39C"""
+"""184252F4FC98001D_95FD5B0FFFBBB13A_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=C(C=C2)OC3CCOC3""",21,"""A86812277E99D39C"""
+"""4EC95A136344FE7B_5E1CBF7B27CC45C9_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=C(OC)C=C2)CN(C)C""",21,"""A86812277E99D39C"""
+"""5E4AE021EAE99A24_86739B7773085441_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=CC(=C2)COCCOC""",21,"""A86812277E99D39C"""
+"""C1824E27A5CD2D9D_0F1E16767DB45F2D_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=CC(=C2)CN(C)C3CC3""",21,"""A86812277E99D39C"""
+"""EA393359AE314CA2_100502954AFEB848_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=CC(=C2)OC(COC)C""",21,"""A86812277E99D39C"""
+"""1D8765C6EFD93D00_4244FAA1C14B1864_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""A86812277E99D39C"""
+"""6895493DEC4418D2_57BD1C955A36B926_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""A86812277E99D39C"""
+"""BB838E0094761794_2E0673B9AD0C855B_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=CC=C2)CN3CCCC3""",21,"""A86812277E99D39C"""
+"""1C6AECF440AFD058_372257BBC5606ADB_6004_UN""","""CNCC1=N[N](C)C=C1C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""A86812277E99D39C"""
+"""3E650EF64ABEAEAF_4AD608594276DBB2_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=CC(=C2)OCCN(C)C""",21,"""A86812277E99D39C"""
+"""D87E77A407622071_BD0BC49BD3147889_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""A86812277E99D39C"""
+"""4324B351DED89E2E_8A2CFC1F247E7B3D_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""A86812277E99D39C"""
+"""C5282DDD64EFDF96_58E0029B0E71518E_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(C=CC=C2F)OC(F)(F)F""",21,"""A86812277E99D39C"""
+"""28DB8C13218D0CC0_8835CC13FB2B659D_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""A86812277E99D39C"""
+"""C8228E69AC1C3631_A7A0F85CE80C0758_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""A86812277E99D39C"""
+"""890518C1B1E7F45C_A29B06F9343CD571_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""A86812277E99D39C"""
+"""7355F8283F576043_6760A00E54BC4945_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""A86812277E99D39C"""
+"""CB04D8C63B742F61_774C305F8B52FDB1_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""A86812277E99D39C"""
+"""C98EAE1AC9BFC65E_AA5F696625F109CB_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""A86812277E99D39C"""
+"""07BF0021DA31B017_3A2C8D1CBC0C831E_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""A86812277E99D39C"""
+"""811C1A2B698EB5CA_1F0D3DAF5C034DC5_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""A86812277E99D39C"""
+"""F23798740EB4E835_79F08DEE758AFCA5_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=C(OCCC(C)C)C=C2""",21,"""A86812277E99D39C"""
+"""A1135356DD171C8B_849DEEF88BC06CF5_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=C(C=C2)OC3CCCC3""",21,"""A86812277E99D39C"""
+"""C106555FDDAB5625_05AB37063C3B0421_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(C=C(OC)C=C2)CN(C)C""",21,"""A86812277E99D39C"""
+"""30AECFD18B18CF9B_70D455344617A096_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""A86812277E99D39C"""
+"""9717D62808258B7C_8F3392B891165E7B_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(C)C=C(C=C2)OCC3CC3""",21,"""A86812277E99D39C"""
+"""C4EB5803CC9E1174_78B47B4DBA6F7365_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""A86812277E99D39C"""
+"""F73EE33AB4321F81_0EBF55517203740E_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(OCC(C)(C)C)N=CC=C2""",21,"""A86812277E99D39C"""
+"""7E131D57902A7E7C_CB8FC46BEBE71D71_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""A86812277E99D39C"""
+"""D1D0E33ECF545950_A1EBF14D14D11611_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""A86812277E99D39C"""
+"""E7D165657EF80EE7_D0D0433805DA98E2_6004_UN""","""CNCC1=N[N](C)C=C1C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""A86812277E99D39C"""
+"""C984406878F79A47_621BAF4DC79391A0_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""A86812277E99D39C"""
+"""6451B09ADB3D2C6D_17D53DC5FD3F0192_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""A86812277E99D39C"""
+"""001F0C67C45EDFED_4429659CC34DA083_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(C=CC=C2)CN3CCCC3""",21,"""A86812277E99D39C"""
+"""FFECCB41EC0E583D_DCFD351D7FFF4339_6004_UN""","""CNCC1=N[N](C)C=C1C2=CC(=N[N]2C3CCCCO3)C""",21,"""A86812277E99D39C"""
+"""6FFAFFBA80DF6705_D6FA1F1E2682A7C4_6004_UN""","""CNCC1=N[N](C)C=C1C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""A86812277E99D39C"""
+"""AE60D7FACE39661C_555D2AB0AFC251B5_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](CCN)(=O)=O)C2CC2""",21,"""AB95545F71393CAD"""
+"""BC995D997308234A_CE24FA3A02615E1B_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C(C)C)[S](=O)(=O)CCN""",21,"""AB95545F71393CAD"""
+"""2DA542FD0F5C0402_99AB168FEC217D47_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)CCN=C=S""",21,"""AB95545F71393CAD"""
+"""7D91655E4404B893_84BD1737A289048F_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](CC)(=O)=O)CCCN""",21,"""AB95545F71393CAD"""
+"""56EFA7A255667980_0E62B2DA545D31AE_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)C2CC(C2)N""",21,"""AB95545F71393CAD"""
+"""E6414CED6C1DD437_48B8BADD6468B32F_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(CCCN)[S](=O)(=O)CCl""",21,"""AB95545F71393CAD"""
+"""551A3749EF6D2D85_BD59369BB6FA266E_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2CNCC2""",21,"""AB95545F71393CAD"""
+"""3A9476A0013E6882_03013D8C091583AA_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](CC)(=O)=O)CCCBr""",21,"""AB95545F71393CAD"""
+"""FCD5FE5AF192CB33_B7DBBC8CAC1B0024_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(CCCNC)[S](=O)(=O)C""",21,"""AB95545F71393CAD"""
+"""9743116BC6206123_52B6B4EA25D21A7C_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""AB95545F71393CAD"""
+"""6D3D6E7903331A08_00FDDEF179EDC9B4_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](=O)(=O)CC#N)C2CC2""",21,"""AB95545F71393CAD"""
+"""BBF2584051433242_8329B587914B8BA3_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""AB95545F71393CAD"""
+"""92411AAB9180ACC9_452FE27775153F50_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""AB95545F71393CAD"""
+"""181E9E3229900988_E789BFEE655A2D11_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""AB95545F71393CAD"""
+"""EEEFE51A3E79E0E2_2AEEE4A7BA140D4E_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""AB95545F71393CAD"""
+"""DAAE0A943BDBCA15_DE934B1075145DE7_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""AB95545F71393CAD"""
+"""81EAFA2BA1F31085_D467AC10E96F65E1_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""AB95545F71393CAD"""
+"""5D702E2B825581E7_D649F931EB64D5CA_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""AB95545F71393CAD"""
+"""DC6C0ED31E309E9F_458BE67D319C0E2E_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""AB95545F71393CAD"""
+"""958DDB92CD88ACB4_953AD1DB37E10A0A_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""AB95545F71393CAD"""
+"""FC0A6A8179586CAC_DF35B66AA02F8D87_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""AB95545F71393CAD"""
+"""26BBC12D546CF6EE_33082808AA052988_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""AB95545F71393CAD"""
+"""716828D6FC660203_3AE59C6C01500432_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](=O)(=O)C2CC2)CC#C""",21,"""AB95545F71393CAD"""
+"""F56EF470124E89DB_6EE586E7E65EC1F4_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""AB95545F71393CAD"""
+"""BEF3509F10B7FC3F_468EC91AC35A8D1C_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N2CCCC(C)(C)[S]2(=O)=O""",21,"""AB95545F71393CAD"""
+"""B4E821387A5E3C78_8DA7324E4A9C460F_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N2CCCC(CC)[S]2(=O)=O""",21,"""AB95545F71393CAD"""
+"""10E4CA62C0B64BF9_BCCE42942F25F0A0_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""AB95545F71393CAD"""
+"""409E9349A35B504A_63D0253A552DC98E_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""AB95545F71393CAD"""
+"""9CE8E9CC7270E9F0_C8E8EBA381BD54A2_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""AB95545F71393CAD"""
+"""432756833D76ADE8_88845BF384878D1C_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""AB95545F71393CAD"""
+"""7E6EEA2F781CA77A_20CBC1277F9A9274_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N2[S](CCN(C)CC2)(=O)=O""",21,"""AB95545F71393CAD"""
+"""41F5A096D78BA494_AC5CE7AA17337997_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N2CC(=O)NCC[S]2(=O)=O""",21,"""AB95545F71393CAD"""
+"""0C0D027FD9CA70CF_F9A7FAA3BA96BE03_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N2[S](CCCCC2C)(=O)=O""",21,"""AB95545F71393CAD"""
+"""35BCBB7E16913488_830FBF6F147651FD_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(CCN)[S](=O)(=O)C2CC2""",21,"""AB95545F71393CAD"""
+"""19E14CE9E9AEBB1A_E5F599AEB05AC30A_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(CCN)[S](=O)(=O)C(F)F""",21,"""AB95545F71393CAD"""
+"""D268CB99ABE88BE9_45F005CB8E513DE8_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N([S](CC)(=O)=O)C2CNC2""",21,"""AB95545F71393CAD"""
+"""5D0845B7DFE2B14F_7769D1F719B86995_6036_DP""","""CC(CC1=CC(=C(C=C1)Br)F)N3CC2(CNC2)C[S]3(=O)=O""",21,"""AB95545F71393CAD"""
+"""2C5AC0DA7C80B7A3_CD1CA865C07B2DFF_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""AB95545F71393CAD"""
+"""3844E3283F274975_31F73035C9193D4F_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""AB95545F71393CAD"""
+"""F78063D199983605_0F9657820427F5D4_6036_UN""","""CC(CC1=CC(=C(C=C1)Br)F)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""AB95545F71393CAD"""
+"""9A9DDFE2C3CA2D59_55705810E54982DB_6036_UN""","""CC[N]1N=CC(=C1)CNCCN([S](CCN)(=O)=O)C2CC2""",21,"""ABB826FF3BB2EFC3"""
+"""FFF59D119891FF03_CE09889A48EA8D75_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(C(C)C)[S](=O)(=O)CCN""",21,"""ABB826FF3BB2EFC3"""
+"""C0732C512532E192_9986642FA6AAAE29_6036_UN""","""CC[N]1N=CC(=C1)CNCCN([S](C)(=O)=O)CCN=C=S""",21,"""ABB826FF3BB2EFC3"""
+"""4B2F962AA1B33B0D_84906597E802D7E1_6036_UN""","""CC[N]1N=CC(=C1)CNCCN([S](CC)(=O)=O)CCCN""",21,"""ABB826FF3BB2EFC3"""
+"""97029B4B62AE7C4E_0E4FC07A1ED6E2C0_6036_UN""","""CC[N]1N=CC(=C1)CNCCN([S](C)(=O)=O)C2CC(C2)N""",21,"""ABB826FF3BB2EFC3"""
+"""837240BE1969FC8C_4895C87D2EE36041_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(CCCN)[S](=O)(=O)CCl""",21,"""ABB826FF3BB2EFC3"""
+"""39D65462DE4CB679_BD74443BFC71F500_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(C)[S](=O)(=O)C2CNCC2""",21,"""ABB826FF3BB2EFC3"""
+"""92195F83774CF250_032C4F2C439E50C4_6036_UN""","""CC[N]1N=CC(=C1)CNCCN([S](CC)(=O)=O)CCCBr""",21,"""ABB826FF3BB2EFC3"""
+"""1F691272AB9F6DD2_B7F6CE2CE690D34A_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(CCCNC)[S](=O)(=O)C""",21,"""ABB826FF3BB2EFC3"""
+"""D4AEB38F6C4B1BAF_529BC64A6F59C912_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""ABB826FF3BB2EFC3"""
+"""DE4D8F5917AD6C41_00D0AC5133661ADA_6036_UN""","""CC[N]1N=CC(=C1)CNCCN([S](=O)(=O)CC#N)C2CC2""",21,"""ABB826FF3BB2EFC3"""
+"""3BBDAA8F6D09AE61_8304C727DBC058CD_6036_UN""","""CC[N]1N=CC(=C1)CNCCN([S](C)(=O)=O)C(=O)CCN""",21,"""ABB826FF3BB2EFC3"""
+"""52270B9892B3D9E0_450290D73F9EEC3E_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(C)[S](=O)(=O)C2=CC=CS2""",21,"""ABB826FF3BB2EFC3"""
+"""11632C6213E61CE6_E7A4CD4E2FD1FE7F_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""ABB826FF3BB2EFC3"""
+"""86868C920F828382_2AC39607F09FDE20_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""ABB826FF3BB2EFC3"""
+"""AD84AEB7830A0F87_DEBE39B03F9F8E89_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""ABB826FF3BB2EFC3"""
+"""7D18B244CBC8B108_D44ADEB0A3E4B68F_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(CC(CC)N)[S](=O)(=O)C""",21,"""ABB826FF3BB2EFC3"""
+"""C8548616C28A2B03_D6648B91A1EF06A4_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""ABB826FF3BB2EFC3"""
+"""55E09D3D421D41B5_45A694DD7B17DD40_6036_UN""","""CC[N]1N=CC(=C1)CNCCN([S](C)(=O)=O)CCN=[N]#N""",21,"""ABB826FF3BB2EFC3"""
+"""327AE9509F2BEAAE_9517A37B7D6AD964_6036_UN""","""CC[N]1N=CC(=C1)CNCCN(CC(C)(C)N)[S](=O)(=O)C""",21,"""ABB826FF3BB2EFC3"""
+"""9B35790F7172B1E0_DF18C4CAEAA45EE9_6036_UN""","""CC[N]1N=CC(=C1)CNCCN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""ABB826FF3BB2EFC3"""
+"""FEBE314E0EA7769E_33255AA8E08EFAE6_6036_UN""","""CC[N]1N=CC(=C1)CNCCN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""ABB826FF3BB2EFC3"""
+"""6E2CAEA8A75A3F02_3AC8EECC4BDBD75C_6036_UN""","""CC[N]1N=CC(=C1)CNCCN([S](=O)(=O)C2CC2)CC#C""",21,"""ABB826FF3BB2EFC3"""
+"""ACE47BB3441724B7_6EC8F447ACD5129A_6036_UN""","""CC[N]1N=CC(=C1)CNCCN2[S](=O)(=O)C3(CCC2)CC3""",21,"""ABB826FF3BB2EFC3"""
+"""CF645438871A9B33_46A3BBBA89D15E72_6036_UN""","""CC[N]1N=CC(=C1)CNCCN2CCCC(C)(C)[S]2(=O)=O""",21,"""ABB826FF3BB2EFC3"""
+"""C359035F0A25549B_8D8A40EE00179561_6036_UN""","""CC[N]1N=CC(=C1)CNCCN2CCCC(CC)[S]2(=O)=O""",21,"""ABB826FF3BB2EFC3"""
+"""4066DF81CFBCF011_BCE3303465AE23CE_6036_UN""","""CC[N]1N=CC(=C1)CNCCN2C(C(N)CC[S]2(=O)=O)=O""",21,"""ABB826FF3BB2EFC3"""
+"""1F2DD5AE1A7406D4_63FD579A1FA61AE0_6036_UN""","""CC[N]1N=CC(=C1)CNCCN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""ABB826FF3BB2EFC3"""
+"""B02F93935AAF0AA9_C8C59903CB3687CC_6036_UN""","""CC[N]1N=CC(=C1)CNCCN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""ABB826FF3BB2EFC3"""
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+"""40BA4E18BF326322_734EB38875399344_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""ABF2F49B4DB7E04E"""
+"""41F2CA5610F2D23C_8CA97404A2386DA9_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""ABF2F49B4DB7E04E"""
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+"""3E1A5BF62FDBD220_D34AA58436F4AB30_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""ABF2F49B4DB7E04E"""
+"""B66711658557E036_618149F1F4BDA272_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""ABF2F49B4DB7E04E"""
+"""6564FA09B9433581_144FDB79CE113240_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""ABF2F49B4DB7E04E"""
+"""A02D6885E7BC26E6_47B38320F0639351_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C2=C(C=CC=C2)CN3CCCC3""",21,"""ABF2F49B4DB7E04E"""
+"""49A8189A3EE32C9C_DF67D3A14CD170EB_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""ABF2F49B4DB7E04E"""
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+"""CCDD240A45FC49B1_D51D9BDF9AE7167A_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(C=CC(=C2)C)C)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""ECD31158AD7B3958_83C8355FAC62F486_6006_UN""","""CC1=CC3=C(C(=C1)C2=CC=C(SC)C=C2)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""6EA244081C57B299_6427639E82F40362_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(C(=CC=C2)Cl)Cl)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""F497A24CBDE5EFA1_D3A1B51E31A2D68E_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(N=C(C=C2)O)F)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
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+"""E208AE10489E3039_FBDD49F18FC0F511_6006_UN""","""CC1=CC3=C(C(=C1)C2=CC(=C(C=C2)F)Cl)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""5B0EE53BB64B818B_BA373AF65052E327_6006_UN""","""CC1=CC3=C(C(=C1)C2=CC(=CC=C2)CF)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""614F06DE17D70385_AB0B103C08EEFF53_6006_UN""","""CC1=CC3=C(C(=C1)C2=CC=C(C=C2)CF)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""5B6A48C96BF4666D_CC294FB8E97F40E5_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(C)C=C(C=C2)F)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""B5082FB64DE63322_7F576B47554C06A6_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(CC)C=CC=C2)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""99589E70A4DFD41E_AD13856EE761427A_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(C=CC(=C2)F)F)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""AD097746D9855C50_00935E3ABB4CE085_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(OC)N=CC=C2)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""88A53EA04E4EC72C_6D2C35DDBFEEE213_6006_UN""","""CC1=CC3=C(C(=C1)C2=CC(=NC=C2)OC)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""13F4ED90D2E9306E_0A8DFE8C24E219C3_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(C=C(C)C=C2)F)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""697403970288D4C5_219B99BC5A72EA9E_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(C(=CC=C2)Br)F)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""E77918924EFACE8B_355CCEF39E990ADD_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(C=C(C)C=C2)C)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""00AA634F286672D2_8D23B8000B00344C_6006_UN""","""CC1=CC3=C(C(=C1)C2=CC=CC(=C2)CC)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""96C625EF64AB18FE_4F3BE45DD4D818C1_6006_UN""","""CC1=CC3=C(C(=C1)C2=C([N](C)N=C2)C#N)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""F62D40A1EAD4B8C1_A91D6166B474D25E_6006_UN""","""CC1=CC3=C(C(=C1)C2=C(C)C=CC(=C2)F)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""CBD68433DEFF8DCF_AC96E8A6316982C2_6006_UN""","""CC1=CC3=C(C(=C1)C2=CC(=C(C=C2)Cl)F)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""75C321B74C2F53DF_B0AB03A35D987B33_6006_UN""","""CC1=CC3=C(C(=C1)C2=CN=C(NC)C=C2)OCCCC3=O""",21,"""ACD6CF1D703C7C45"""
+"""85F33C5FFC379182_0CD3DFF8955C7562_2201_UN""","""CC1=CC2=C(C(=C1)Cl)OCCC3=CC4=C(N=C23)N=CC=C4""",21,"""ACD6CF1D703C7C45"""
+"""FE310C6A7606E02F_BA4E22D3F12BA28B_2201_UN""","""CC1=CC2=C(C(=C1)Cl)OCCC3=CC4=C(N=C23)C=CN=C4""",21,"""ACD6CF1D703C7C45"""
+"""2796F459A70319B4_60026A5682F45BF8_2201_UN""","""CC1=CC3=C(C(=C1)Cl)OCCC4=C(C)C2=NON=C2N=C34""",21,"""ACD6CF1D703C7C45"""
+"""31B1D1FC3D792C28_8DE65B1C6FD31AC1_2201_UN""","""CC1=CC3=C(C(=C1)Cl)OCCC4=C(C)C2=C(SC=C2)N=C34""",21,"""ACD6CF1D703C7C45"""
+"""BBCEE6DE23F7E7B4_85DBA1A38CA38B2F_2201_UN""","""CC1=CC3=C(C(=C1)Cl)OCCC4=CC2=C([N](C)N=C2)N=C34""",21,"""ACD6CF1D703C7C45"""
+"""E9BB1A92F40D87C8_795C7CEC6B3275FA_2201_UN""","""CC1=CC2=C(C(=C1)Cl)OCCC3=CC4=C(N=C23)C=NC=C4""",21,"""ACD6CF1D703C7C45"""
+"""3516DAE17470C680_A603A114A4BD15ED_2201_UN""","""CC1=CC3=C(C(=C1)Cl)OCCC4=CC2=C(ON=C2C)N=C34""",21,"""ACD6CF1D703C7C45"""
+"""707E512EEC6378C5_E0DD6367B8413622_2201_UN""","""CC1=CC3=C(C(=C1)Cl)OCCC4=CC2=C(C)[NH]N=C2N=C34""",21,"""ACD6CF1D703C7C45"""
+"""B68563C61F208F77_727BF0D2F26874C1_2201_UN""","""CC1=CC2=C(C(=C1)Cl)OCCC3=CC4=C(N=C23)N=CN=C4""",21,"""ACD6CF1D703C7C45"""
+"""A1C447A5F93FE1EA_5214A2A906B09664_6036_UN""","""NC1=NC=CC(=C1)CSCCN([S](CCN)(=O)=O)C2CC2""",21,"""ACDCDC46D84BFB7C"""
+"""9100998A6EA41EBA_C96D7223AB1399CA_6036_UN""","""NC1=NC=CC(=C1)CSCCN(C(C)C)[S](=O)(=O)CCN""",21,"""ACDCDC46D84BFB7C"""
+"""EBB0A3AA5FE95547_9EE29E964553BA96_6036_UN""","""NC1=NC=CC(=C1)CSCCN([S](C)(=O)=O)CCN=C=S""",21,"""ACDCDC46D84BFB7C"""
+"""AA180B84BA278EDB_83F49F2E0BFBC35E_6036_UN""","""NC1=NC=CC(=C1)CSCCN([S](CC)(=O)=O)CCCN""",21,"""ACDCDC46D84BFB7C"""
+"""8932CF4BFFF01C7C_092B3AC3FD2FF67F_6036_UN""","""NC1=NC=CC(=C1)CSCCN([S](C)(=O)=O)C2CC(C2)N""",21,"""ACDCDC46D84BFB7C"""
+"""2CF24B2FB71AD973_4FF132C4CD1A74FE_6036_UN""","""NC1=NC=CC(=C1)CSCCN(CCCN)[S](=O)(=O)CCl""",21,"""ACDCDC46D84BFB7C"""
+"""30B2E274C4FFC1E3_BA10BE821F88E1BF_6036_UN""","""NC1=NC=CC(=C1)CSCCN(C)[S](=O)(=O)C2CNCC2""",21,"""ACDCDC46D84BFB7C"""
+"""12619393DB78D4D1_0448B595A067447B_6036_UN""","""NC1=NC=CC(=C1)CSCCN([S](CC)(=O)=O)CCCBr""",21,"""ACDCDC46D84BFB7C"""
+"""28E2D30BCCB9D2E9_B09234950569C7F5_6036_UN""","""NC1=NC=CC(=C1)CSCCN(CCCNC)[S](=O)(=O)C""",21,"""ACDCDC46D84BFB7C"""
+"""47CE85A45462BE76_55FF3CF38CA0DDAD_6036_UN""","""NC1=NC=CC(=C1)CSCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""ACDCDC46D84BFB7C"""
+"""1BDC4B916B758659_07B456E8D09F0E65_6036_UN""","""NC1=NC=CC(=C1)CSCCN([S](=O)(=O)CC#N)C2CC2""",21,"""ACDCDC46D84BFB7C"""
+"""E4227D739B791ECF_84603D9E38394C72_6036_UN""","""NC1=NC=CC(=C1)CSCCN([S](C)(=O)=O)C(=O)CCN""",21,"""ACDCDC46D84BFB7C"""
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+"""7F0BB15653CFDD1E_7EEB9399DA375A76_6004_UN""","""CC1=C(C(=NC(=C1)N)O)C2=CC=C(OCCC(C)C)C=C2""",21,"""AF730C50D124754F"""
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+"""2682D193461123DC_1E9F5532A46BE41B_6004_UN""","""CC1=C(C=NC(=C1)C2=CC(=C(OCC)C=C2)OCC)CN""",21,"""B018FC4AAEE0B13B"""
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+"""87C13453F7B2B27B_BEA5DAA3A8AC2535_6004_UN""","""CC1=C(C=NC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)CN""",21,"""B018FC4AAEE0B13B"""
+"""3EAB72E705B93FB6_8D8DB5622FC2D39D_6004_UN""","""CC1=C(C=NC(=C1)C2=CC=C(C=C2)OC3CCOC3)CN""",21,"""B018FC4AAEE0B13B"""
+"""0BF81C65F66407EE_466C5116F7B5276E_6004_UN""","""CC1=C(C=NC(=C1)C2=CC(=C(OC)C=C2)CN(C)C)CN""",21,"""B018FC4AAEE0B13B"""
+"""43714F63BDFEB262_9E03751AA37136E6_6004_UN""","""CC1=C(C=NC(=C1)C2=CC=CC(=C2)COCCOC)CN""",21,"""B018FC4AAEE0B13B"""
+"""7AD900E9D39C4812_176EF81BADCD3D8A_6004_UN""","""CC1=C(C=NC(=C1)C2=CC=CC(=C2)CN(C)C3CC3)CN""",21,"""B018FC4AAEE0B13B"""
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+"""B58CE27A6833A694_5A3414CC11327AC3_6004_UN""","""CC1=C(C=NC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)CN""",21,"""B018FC4AAEE0B13B"""
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+"""7158957DC8CA99D4_2F52B9D61519087C_6004_UN""","""CC1=C(C=NC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)CN""",21,"""B018FC4AAEE0B13B"""
+"""6583C5112248763F_52A6E634920FB915_6004_UN""","""CC1=C(C=NC(=C1)C2=CC=CC(=C2)OCCN(C)C)CN""",21,"""B018FC4AAEE0B13B"""
+"""5BE47D172A9524B1_A57B2AF6036D1A2E_6004_UN""","""CC1=C(C=NC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)CN""",21,"""B018FC4AAEE0B13B"""
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+"""588BCB971261AAAE_BFD01631387565FF_6004_UN""","""CC1=C(C=NC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)CN""",21,"""B018FC4AAEE0B13B"""
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+"""152F59572D14ED27_7F104E6384C52BE2_6004_UN""","""CC1=C(C=NC(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)CN""",21,"""B018FC4AAEE0B13B"""
+"""06289CDDDAC55F00_6F3CDE325B2B9F16_6004_UN""","""CC1=C(C=NC(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)CN""",21,"""B018FC4AAEE0B13B"""
+"""0AFB83A431B016EA_B22F870BF5886B6C_6004_UN""","""CC1=C(C=NC(=C1)C2=CC(=CC=C2)C3=CC=CC=C3)CN""",21,"""B018FC4AAEE0B13B"""
+"""79745EAE15E598DF_225C63716C75E1B9_6004_UN""","""CC1=C(C=NC(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)CN""",21,"""B018FC4AAEE0B13B"""
+"""C5FCADE953A37EC6_077DD3C28C7A2F62_6004_UN""","""CC1=C(C=NC(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)CN""",21,"""B018FC4AAEE0B13B"""
+"""E535FC0A764A1748_61806383A5F39E02_6004_UN""","""CC1=C(C=NC(=C1)C2=CC=C(OCCC(C)C)C=C2)CN""",21,"""B018FC4AAEE0B13B"""
+"""06E671073DE78062_9CED00955BB90E52_6004_UN""","""CC1=C(C=NC(=C1)C2=CC=C(C=C2)OC3CCCC3)CN""",21,"""B018FC4AAEE0B13B"""
+"""615FCA642F20916B_1DDBD96BEC426686_6004_UN""","""CC1=C(C=NC(=C1)C2=C(C=C(OC)C=C2)CN(C)C)CN""",21,"""B018FC4AAEE0B13B"""
+"""B1FE571818B5CFE7_68A4BB59966EC231_6004_UN""","""CC1=C(C=NC(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)CN""",21,"""B018FC4AAEE0B13B"""
+"""02241C5F45513BD4_97437CD5416F3CDC_6004_UN""","""CC1=C(C=NC(=C1)C2=C(C)C=C(C=C2)OCC3CC3)CN""",21,"""B018FC4AAEE0B13B"""
+"""07ADEDBB3E541285_60C495206A1611C2_6004_UN""","""CC1=C(C=NC(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)CN""",21,"""B018FC4AAEE0B13B"""
+"""6FF378D8BEBD6F92_16CFBB3CA27A16A9_6004_UN""","""CC1=C(C=NC(=C1)C2=C(OCC(C)(C)C)N=CC=C2)CN""",21,"""B018FC4AAEE0B13B"""
+"""1752805920B9D3E3_D3FF2A063B9E7FD6_6004_UN""","""CC1=C(C=NC(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)CN""",21,"""B018FC4AAEE0B13B"""
+"""8D0C585E55620382_B99B1F20C4A874B6_6004_UN""","""CC1=C(C=NC(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)CN""",21,"""B018FC4AAEE0B13B"""
+"""DF53CB7A0C781872_C8A0AD55D5A3FA45_6004_UN""","""CC1=C(C=NC(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)CN""",21,"""B018FC4AAEE0B13B"""
+"""EF7196B1F325718F_7A6B412017EAF307_6004_UN""","""CC1=C(C=NC(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)CN""",21,"""B018FC4AAEE0B13B"""
+"""91E8B867672258C5_0FA5D3A82D466335_6004_UN""","""CC1=C(C=NC(=C1)C2=CC(=CC=C2)C3=CC=NC=C3)CN""",21,"""B018FC4AAEE0B13B"""
+"""7FCFC59686F7D813_5C598BF11334C224_6004_UN""","""CC1=C(C=NC(=C1)C2=C(C=CC=C2)CN3CCCC3)CN""",21,"""B018FC4AAEE0B13B"""
+"""6DA433180BF54174_C48DDB70AF86219E_6004_UN""","""CC1=C(C=NC(=C1)C2=CC(=N[N]2C3CCCCO3)C)CN""",21,"""B018FC4AAEE0B13B"""
+"""A4DC57D518D8508A_CE8AF173F6FBC563_6004_UN""","""CC1=C(C=NC(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)CN""",21,"""B018FC4AAEE0B13B"""
+"""10300CA66C4AAC91_B1746127818D27C7_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=CC=C2)OC3CCCC3)F""",21,"""B08430737016DE1B"""
+"""D30FE4B565375F09_1E03990B7A9D8B3B_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=C(OCC)C=C2)OCC)F""",21,"""B08430737016DE1B"""
+"""668E05689E9718AA_E203EECCE5767C11_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=CC(=C2)OCCC(C)C)F""",21,"""B08430737016DE1B"""
+"""2D6ED03538DDDDD9_BE39169A765A4A15_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)F""",21,"""B08430737016DE1B"""
+"""36BB38DEA29BF997_8D11795BF134BCBD_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=C(C=C2)OC3CCOC3)F""",21,"""B08430737016DE1B"""
+"""80B223C2DE9F64CC_46F09D2F2943484E_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=C(OC)C=C2)CN(C)C)F""",21,"""B08430737016DE1B"""
+"""C93F39EB7931C84C_9E9FB9237D8759C6_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=CC(=C2)COCCOC)F""",21,"""B08430737016DE1B"""
+"""20B25790FBB4F440_17F23422733B52AA_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=CC(=C2)CN(C)C3CC3)F""",21,"""B08430737016DE1B"""
+"""C0474A332F768F0D_08E920C14471B5CF_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=CC(=C2)OC(COC)C)F""",21,"""B08430737016DE1B"""
+"""B6018F022D009394_5AA8D8F5CFC415E3_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)F""",21,"""B08430737016DE1B"""
+"""2E55F6C67549E531_4F513EC154B9B4A1_6005_UN""","""COC1=NC(=CC(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)F""",21,"""B08430737016DE1B"""
+"""5AF933D9160AB6C4_36EA51EDA38388DC_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=CC=C2)CN3CCCC3)F""",21,"""B08430737016DE1B"""
+"""C091A7C4B89CDFE1_2FCE75EFCBEF675C_6005_UN""","""COC1=NC(=CC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)F""",21,"""B08430737016DE1B"""
+"""CA888755AE704F99_523A2A0D4CF9D635_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=CC(=C2)OCCN(C)C)F""",21,"""B08430737016DE1B"""
+"""9A47B854DC698152_A5E7E6CFDD9B750E_6005_UN""","""COC1=NC(=CC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)F""",21,"""B08430737016DE1B"""
+"""BC0C57581F9F0541_92C0DE4B2AF176BA_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=C(C=C2)C3=CC=CC=C3)F""",21,"""B08430737016DE1B"""
+"""2C35EFBFD9AFBDE0_400C20CF00FE5C09_6005_UN""","""COC1=NC(=CC(=C1)C2=C(C=CC=C2F)OC(F)(F)F)F""",21,"""B08430737016DE1B"""
+"""8A5E53C4BE3C3E42_90D9EE47F5A4681A_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)F""",21,"""B08430737016DE1B"""
+"""2FB45C1CB527FDEB_BF4CDA08E6830ADF_6005_UN""","""COC1=NC(=CC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)F""",21,"""B08430737016DE1B"""
+"""46265703C5B4F8D8_BA7724AD3AB3D8F6_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=CC(=C2F)C(N(C)C)=O)F""",21,"""B08430737016DE1B"""
+"""941FEF81FD4FB3A8_7F8C825A5A3344C2_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)F""",21,"""B08430737016DE1B"""
+"""F1CB1E34F470E668_6FA0120B85DDF036_6005_UN""","""COC1=NC(=CC(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)F""",21,"""B08430737016DE1B"""
+"""9BA17A7ED6154792_B2B34B322B7E044C_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=CC=C2)C3=CC=CC=C3)F""",21,"""B08430737016DE1B"""
+"""BC6AF560F46BFD55_22C0AF48B2838E99_6005_UN""","""COC1=NC(=CC(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)F""",21,"""B08430737016DE1B"""
+"""3CEB245C4393AE8F_07E11FFB528C4042_6005_UN""","""COC1=NC(=CC(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)F""",21,"""B08430737016DE1B"""
+"""A5EB2C17E94C585C_611CAFBA7B05F122_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=C(OCCC(C)C)C=C2)F""",21,"""B08430737016DE1B"""
+"""431F9F13767AFD70_9C71CCAC854F6172_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=C(C=C2)OC3CCCC3)F""",21,"""B08430737016DE1B"""
+"""A436BF27E9F50C38_1D47155232B409A6_6005_UN""","""COC1=NC(=CC(=C1)C2=C(C=C(OC)C=C2)CN(C)C)F""",21,"""B08430737016DE1B"""
+"""395599C9D0F1C08F_683877604898AD11_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)F""",21,"""B08430737016DE1B"""
+"""A4A374BB2BFCF0E0_97DFB0EC9F9953FC_6005_UN""","""COC1=NC(=CC(=C1)C2=C(C)C=C(C=C2)OCC3CC3)F""",21,"""B08430737016DE1B"""
+"""9759FD4D5EE25654_60585919B4E07EE2_6005_UN""","""COC1=NC(=CC(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)F""",21,"""B08430737016DE1B"""
+"""E4C9E96048F876A9_165377057C8C7989_6005_UN""","""COC1=NC(=CC(=C1)C2=C(OCC(C)(C)C)N=CC=C2)F""",21,"""B08430737016DE1B"""
+"""EEAD4FE9ED56A593_D363E63FE56810F6_6005_UN""","""COC1=NC(=CC(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)F""",21,"""B08430737016DE1B"""
+"""FF9162CC902022E1_B907D3191A5E1B96_6005_UN""","""COC1=NC(=CC(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)F""",21,"""B08430737016DE1B"""
+"""D7CD9351AF341D5D_C83C616C0B559565_6005_UN""","""COC1=NC(=CC(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)F""",21,"""B08430737016DE1B"""
+"""8135A3F87C653078_7AF78D19C91C9C27_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)F""",21,"""B08430737016DE1B"""
+"""6EBDBF031180372F_0F391F91F3B00C15_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=CC=C2)C3=CC=NC=C3)F""",21,"""B08430737016DE1B"""
+"""F109F56759EDFC7A_5CC547C8CDC2AD04_6005_UN""","""COC1=NC(=CC(=C1)C2=C(C=CC=C2)CN3CCCC3)F""",21,"""B08430737016DE1B"""
+"""B646E7291719E4F8_C411174971704EBE_6005_UN""","""COC1=NC(=CC(=C1)C2=CC(=N[N]2C3CCCCO3)C)F""",21,"""B08430737016DE1B"""
+"""FFB836D305B3E482_CE163D4A280DAA43_6005_UN""","""COC1=NC(=CC(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)F""",21,"""B08430737016DE1B"""
+"""C04817A575E66CD1_B1274EAC9AD1B61F_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""B0D71FF86B4A4FC3"""
+"""AFD2666F92AF53EA_1E50B68061C11AE3_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""B0D71FF86B4A4FC3"""
+"""DBD201CEA0863EE8_E250C147FE2AEDC9_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""B0D71FF86B4A4FC3"""
+"""BDF88A0D672E8A7D_BE6A39116D06DBCD_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""B0D71FF86B4A4FC3"""
+"""26A7BC926E735E55_8D4256D0EA682D65_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""B0D71FF86B4A4FC3"""
+"""C1A08CB5D21200D1_46A3B2A4321FD996_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""B0D71FF86B4A4FC3"""
+"""B214C4A6A3A00921_9ECC96A866DBC81E_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=CC(=C2)COCCOC)N""",21,"""B0D71FF86B4A4FC3"""
+"""C10D914A38CA956F_17A11BA96867C372_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""B0D71FF86B4A4FC3"""
+"""CF40A4E71BD022A9_08BA0F4A5F2D2417_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=CC(=C2)OC(COC)C)N""",21,"""B0D71FF86B4A4FC3"""
+"""6CFAF1DF8994AC04_5AFBF77ED498843B_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""B0D71FF86B4A4FC3"""
+"""3F2F631F0248CA02_4F02114A4FE52579_6005_UN""","""COC1=C(C=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""B0D71FF86B4A4FC3"""
+"""EBCC1DDD3133D968_36B97E66B8DF1904_6005_UN""","""COC1=C(C=C(C=C1)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""B0D71FF86B4A4FC3"""
+"""99BA12AFF8A6CA79_2F9D5A64D0B3F684_6005_UN""","""COC1=C(C=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""B0D71FF86B4A4FC3"""
+"""8FF8F0562D7744BA_5269058657A547ED_6005_UN""","""COC1=C(C=C(C=C1)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""B0D71FF86B4A4FC3"""
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+"""586E80733580551D_33320E026288F190_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""B249BEFAA9A5C073"""
+"""171A7F3173BF945E_C74FA1B5AD88A139_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""B249BEFAA9A5C073"""
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+"""6E87974E4741A796_CF95139433F82914_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""B249BEFAA9A5C073"""
+"""BC8063BC5638E8CA_5C570CD8E900F2F0_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N([S](C)(=O)=O)CCN=[N]#N""",21,"""B249BEFAA9A5C073"""
+"""6A401708510B349D_8CE63B7EEF7DF6D4_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""B249BEFAA9A5C073"""
+"""D565DA7DB0353E6B_C6E95CCF78B37159_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""B249BEFAA9A5C073"""
+"""EBB05325E827595D_2AD4C2AD7299D556_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""B249BEFAA9A5C073"""
+"""A667EE8BA29887E3_233976C9D9CCF8EC_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N([S](=O)(=O)C2CC2)CC#C""",21,"""B249BEFAA9A5C073"""
+"""722B5429F2633B08_77396C423EC23D2A_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""B249BEFAA9A5C073"""
+"""C3FF78D191621E65_5F5223BF1BC671C2_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N2CCCC(C)(C)[S]2(=O)=O""",21,"""B249BEFAA9A5C073"""
+"""730A51C7D140667C_947BD8EB9200BAD1_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N2CCCC(CC)[S]2(=O)=O""",21,"""B249BEFAA9A5C073"""
+"""8A37E151450382BA_A512A831F7B90C7E_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""B249BEFAA9A5C073"""
+"""BDC35D946070E9F0_7A0CCF9F8DB13550_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""B249BEFAA9A5C073"""
+"""150803CCB5928FA7_D13401065921A87C_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""B249BEFAA9A5C073"""
+"""873FFABB3B2E42C1_9158B1565C1B71C2_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""B249BEFAA9A5C073"""
+"""5BCC75B08DD39641_39172B82A7066EAA_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N2[S](CCN(C)CC2)(=O)=O""",21,"""B249BEFAA9A5C073"""
+"""545233F8F0154A01_B5800D0FCFAF8549_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N2CC(=O)NCC[S]2(=O)=O""",21,"""B249BEFAA9A5C073"""
+"""A0262E929C3CB683_E07B1006620A42DD_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N2[S](CCCCC2C)(=O)=O""",21,"""B249BEFAA9A5C073"""
+"""8BA1F319EF7B7AE4_9AD355CACCEAAD23_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N(CCN)[S](=O)(=O)C2CC2""",21,"""B249BEFAA9A5C073"""
+"""3E6E845B6DB720CC_FC29730B68C63FD4_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N(CCN)[S](=O)(=O)C(F)F""",21,"""B249BEFAA9A5C073"""
+"""0DD2E71D8A2E0052_5C2CEF6E56CDC136_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N([S](CC)(=O)=O)C2CNC2""",21,"""B249BEFAA9A5C073"""
+"""534108BD25579041_6EB53B52C124954B_6036_DP""","""CC1=CC(=CC(=C1)C)C(CN)N3CC2(CNC2)C[S]3(=O)=O""",21,"""B249BEFAA9A5C073"""
+"""7A621E04D96F45D2_D4C042C018E7D121_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""B249BEFAA9A5C073"""
+"""486951650BAF1AF2_282BDA901185C191_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""B249BEFAA9A5C073"""
+"""C4DCC0A3577A3364_164ABD27DCBB090A_6036_UN""","""CC1=CC(=CC(=C1)C)C(CN)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""B249BEFAA9A5C073"""
+"""1DA86A76D6975CB1_B34734900E59146C_6004_UN""","""NC1=C(C(=CC=N1)C2=CC(=CC=C2)OC3CCCC3)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""83A7359EC4FEA7FF_1C30CCBCF549B890_6004_UN""","""NC1=C(C(=CC=N1)C2=CC(=C(OCC)C=C2)OCC)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""71396E2229BBEBF0_E030BB7B6AA24FBA_6004_UN""","""NC1=C(C(=CC=N1)C2=CC=CC(=C2)OCCC(C)C)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""4407F2FBD5FEAE88_BC0A432DF98E79BE_6004_UN""","""NC1=C(C(=CC=N1)C2=CC=C(C=C2)C[N]3C=CN=C3)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""C9D80C39EF400129_8F222CEC7EE08F16_6004_UN""","""NC1=C(C(=CC=N1)C2=CC=C(C=C2)OC3CCOC3)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""DFA42F272417E8DD_44C3C898A6977BE5_6004_UN""","""NC1=C(C(=CC=N1)C2=CC(=C(OC)C=C2)CN(C)C)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""BE0D6D20EBB3C568_9CACEC94F2536A6D_6004_UN""","""NC1=C(C(=CC=N1)C2=CC=CC(=C2)COCCOC)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""AAB54DD763B07BB7_15C16195FCEF6101_6004_UN""","""NC1=C(C(=CC=N1)C2=CC=CC(=C2)CN(C)C3CC3)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""E87EC41F700A2C26_0ADA7576CBA58664_6004_UN""","""NC1=C(C(=CC=N1)C2=CC=CC(=C2)OC(COC)C)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""D183584E1279DABD_589B8D4240102648_6004_UN""","""NC1=C(C(=CC=N1)C2=CC(=C(C(NOC)=O)C=C2)F)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""525E243FEF476A8F_4D626B76DB6D870A_6004_UN""","""NC1=C(C(=CC=N1)C2=C(OC)N=C(C=C2)C(F)(F)F)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""DE4B8DBFC2D8B357_34D9045A2C57BB77_6004_UN""","""NC1=C(C(=CC=N1)C2=CC(=CC=C2)CN3CCCC3)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""C65570D5D2CEF950_2DFD2058443B54F7_6004_UN""","""NC1=C(C(=CC=N1)C3=CC=C([N]2C=C(C)C=N2)C=C3)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""486B4A1DD5CF650E_50097FBAC32DE59E_6004_UN""","""NC1=C(C(=CC=N1)C2=CC=CC(=C2)OCCN(C)C)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""196272770D1E4110_A7D4B378524F46A5_6004_UN""","""NC1=C(C(=CC=N1)C2=C(C=C(C(C)C)C=C2)C(C)C)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""04B7BBE6FC6DE7F1_90F38BFCA5254511_6004_UN""","""NC1=C(C(=CC=N1)C2=CC=C(C=C2)C3=CC=CC=C3)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""EB14390F57AAE0FD_423F75788F2A6FA2_6004_UN""","""NC1=C(C(=CC=N1)C2=C(C=CC=C2F)OC(F)(F)F)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""795E72D4B4D0F02B_92EABBF07A705BB1_6004_UN""","""NC1=C(C(=CC=N1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""4CE3350796A5C8B9_BD7F8FBF69573974_6004_UN""","""NC1=C(C(=CC=N1)C2=C(C=C(OC)C=C2)C(F)(F)F)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""DCD5A287AE5CD4A8_B844711AB567EB5D_6004_UN""","""NC1=C(C(=CC=N1)C2=CC=CC(=C2F)C(N(C)C)=O)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""969E0AF5E99317FF_7DBFD7EDD5E77769_6004_UN""","""NC1=C(C(=CC=N1)C2=CC(=C(OC)C=C2)C(F)(F)F)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""1145FBFEEF3E6A5C_6D9347BC0A09C39D_6004_UN""","""NC1=C(C(=CC=N1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""C415ECBDE5EB3287_B0801E85A4AA37E7_6004_UN""","""NC1=C(C(=CC=N1)C2=CC(=CC=C2)C3=CC=CC=C3)C#N""",21,"""B2B765C4FFC2EDB0"""
+"""F1A8BF10CBF13C4D_20F3FAFF3D57BD32_6004_UN""","""NC1=C(C(=CC=N1)C2=C(OC)C=C(C=C2)C(F)(F)F)C#N""",21,"""B2B765C4FFC2EDB0"""
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+"""1D13E2FF80C2B90C_B7B3D747EFA3D3BE_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC(=CC=C2)OC3CCCC3""",21,"""B64386131E382A62"""
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+"""B18B7090E0287B9A_B8FEA0FA1874BE6C_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""B64386131E382A62"""
+"""F56A31F05A8E79F9_8BD6CF3B9F1A48C4_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=C(C=C2)OC3CCOC3""",21,"""B64386131E382A62"""
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+"""9F077B552829242D_98580F4313A9ADBF_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=CC(=C2)COCCOC""",21,"""B64386131E382A62"""
+"""628E902AAC162ECF_113582421D15A6D3_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""B64386131E382A62"""
+"""226B80C8FB006B70_0E2E96A12A5F41B6_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=CC(=C2)OC(COC)C""",21,"""B64386131E382A62"""
+"""6DA1CF81F1E9F762_5C6F6E95A1EAE19A_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""B64386131E382A62"""
+"""5EB673179D51E95F_499688A13A9740D8_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""B64386131E382A62"""
+"""E40B53384E5B3162_302DE78DCDAD7CA5_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC(=CC=C2)CN3CCCC3""",21,"""B64386131E382A62"""
+"""FC6B17C562FB8408_2909C38FA5C19325_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""B64386131E382A62"""
+"""4EFE29CA849A1F95_54FD9C6D22D7224C_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=CC(=C2)OCCN(C)C""",21,"""B64386131E382A62"""
+"""512DB6F9061E0979_A32050AFB3B58177_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""B64386131E382A62"""
+"""5947DDEB5EAC1BAD_9407682B44DF82C3_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""B64386131E382A62"""
+"""C4947BC740DD0A4F_46CB96AF6ED0A870_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""B64386131E382A62"""
+"""38E98BBC06544682_961E58279B8A9C63_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""B64386131E382A62"""
+"""0053787AC477F339_B98B6C6888ADFEA6_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""B64386131E382A62"""
+"""85E8C4A42613ED96_BCB092CD549D2C8F_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""B64386131E382A62"""
+"""FE4F3F3575993E69_794B343A341DB0BB_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""B64386131E382A62"""
+"""FBDEF185BC29EC35_6967A46BEBF3044F_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""B64386131E382A62"""
+"""C25AA7E306B4F4DE_B474FD524550F035_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""B64386131E382A62"""
+"""707C41B6E176638A_24071928DCAD7AE0_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""B64386131E382A62"""
+"""4B4E43C72AA3C1B1_0126A99B3CA2B43B_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""B64386131E382A62"""
+"""A43CC7FB82B1195C_67DB19DA152B055B_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=C(OCCC(C)C)C=C2""",21,"""B64386131E382A62"""
+"""A6F8DFEA035E0065_9AB67ACCEB61950B_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=C(C=C2)OC3CCCC3""",21,"""B64386131E382A62"""
+"""96C3521D6D3EDD13_1B80A3325C9AFDDF_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""B64386131E382A62"""
+"""A06767AFDC3AF024_6EFFC10026B65968_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""B64386131E382A62"""
+"""4EAC4A8ED682260A_9118068CF1B7A785_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""B64386131E382A62"""
+"""7F3CBDC795A2D72F_669FEF79DACE8A9B_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""B64386131E382A62"""
+"""215DF1B268F6FA48_1094C16512A28DF0_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""B64386131E382A62"""
+"""1D8BE5ADFC15DC8B_D5A4505F8B46E48F_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""B64386131E382A62"""
+"""AA5E747F22F5B262_BFC065797470EFEF_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""B64386131E382A62"""
+"""28C9F5331E1F5C06_CEFBD70C657B611C_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""B64386131E382A62"""
+"""E95B41228E331546_7C303B79A732685E_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""B64386131E382A62"""
+"""CDE646F192DBCD47_09FEA9F19D9EF86C_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""B64386131E382A62"""
+"""EB6D991182A24DA5_5A02F1A8A3EC597D_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(C=CC=C2)CN3CCCC3""",21,"""B64386131E382A62"""
+"""BEA60633F0ADD8B1_C2D6A1291F5EBAC7_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=CC(=N[N]2C3CCCCO3)C""",21,"""B64386131E382A62"""
+"""ADC0D0CEDFF66903_C8D18B2A46235E3A_6005_UN""","""NC1=C(C=C(C(=C1)F)F)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""B64386131E382A62"""
+"""6A8A6B857C0184C5_4890FAF69629434F_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](CCN)(=O)=O)C2CC2""",21,"""B658841948D22E57"""
+"""9A455AAB29AAF4A2_D3E92A7C3B8A4CE1_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""B658841948D22E57"""
+"""BDE9E438FD3A746E_8466C6C9D5CA6FBD_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""B658841948D22E57"""
+"""F9427C0FEDC2D6B1_9970C7719B621675_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](CC)(=O)=O)CCCN""",21,"""B658841948D22E57"""
+"""838CFC16208C637C_13AF629C6DB62354_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](C)(=O)=O)C2CC(C2)N""",21,"""B658841948D22E57"""
+"""C442ADCD0D33F276_55756A9B5D83A1D5_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""B658841948D22E57"""
+"""D6973FD783A509DD_A094E6DD8F113494_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C)[S](=O)(=O)C2CNCC2""",21,"""B658841948D22E57"""
+"""2A36C10B96434B48_1ECCEDCA30FE9150_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](CC)(=O)=O)CCCBr""",21,"""B658841948D22E57"""
+"""0DC7D880AE420F31_AA166CCA95F012DE_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(CCCNC)[S](=O)(=O)C""",21,"""B658841948D22E57"""
+"""A9DD0F8A825C885D_4F7B64AC1C390886_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""B658841948D22E57"""
+"""740517FFE8FDA000_1D300EB74006DB4E_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](=O)(=O)CC#N)C2CC2""",21,"""B658841948D22E57"""
+"""F1963D6F161400C6_9EE465C1A8A09959_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""B658841948D22E57"""
+"""5BF0782698BBC7DA_58E232314CFE2DAA_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""B658841948D22E57"""
+"""E37905B8A33ABC40_FA446FA85CB13FEB_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""B658841948D22E57"""
+"""4DFA6337E96B218C_372334E183FF1FB4_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""B658841948D22E57"""
+"""742916F21F6775D1_C35E9B564CFF4F1D_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""B658841948D22E57"""
+"""CDAEBA2DD398C15A_C9AA7C56D084771B_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""B658841948D22E57"""
+"""A605D528CB797349_CB842977D28FC730_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""B658841948D22E57"""
+"""0654B157BB33E783_5846363B08771CD4_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""B658841948D22E57"""
+"""167A8AF9805F4FB9_88F7019D0E0A18F0_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""B658841948D22E57"""
+"""B9A9ECFB12231189_C2F8662C99C49F7D_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""B658841948D22E57"""
+"""479C7D4A538E4CF3_2EC5F84E93EE3B72_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""B658841948D22E57"""
+"""9A5512185F3FC7A6_27284C2A38BB16C8_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](=O)(=O)C2CC2)CC#C""",21,"""B658841948D22E57"""
+"""50E59A122047322F_732856A1DFB5D30E_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""B658841948D22E57"""
+"""57239115B7846CCC_5B43195CFAB19FE6_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N2CCCC(C)(C)[S]2(=O)=O""",21,"""B658841948D22E57"""
+"""C6415C7EB6593E6F_906AE208737754F5_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N2CCCC(CC)[S]2(=O)=O""",21,"""B658841948D22E57"""
+"""09AEA4DD9F8C6418_A10392D216CEE25A_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""B658841948D22E57"""
+"""0FF282BD0E330656_7E1DF57C6CC6DB74_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""B658841948D22E57"""
+"""11C19945459CD623_D5253BE5B8564658_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""B658841948D22E57"""
+"""957EB85D38A32FAD_95498BB5BD6C9FE6_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""B658841948D22E57"""
+"""76A3C4C9E54067C6_3D0611614671808E_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N2[S](CCN(C)CC2)(=O)=O""",21,"""B658841948D22E57"""
+"""1F0D40FA310E51AC_B19137EC2ED86B6D_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N2CC(=O)NCC[S]2(=O)=O""",21,"""B658841948D22E57"""
+"""9A8FFCB608112348_E46A2AE5837DACF9_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N2[S](CCCCC2C)(=O)=O""",21,"""B658841948D22E57"""
+"""41D3EB71E16865A0_9EC26F292D9D4307_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(CCN)[S](=O)(=O)C2CC2""",21,"""B658841948D22E57"""
+"""074C2CC5A3C5CBE3_F83849E889B1D1F0_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""B658841948D22E57"""
+"""7D92F51117FC46CA_583DD58DB7BA2F12_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N([S](CC)(=O)=O)C2CNC2""",21,"""B658841948D22E57"""
+"""200D61374B0B9F87_6AA401B120537B6F_6036_DP""","""CC(CC1=C(C(=CC=C1)F)Br)N3CC2(CNC2)C[S]3(=O)=O""",21,"""B658841948D22E57"""
+"""C28B515172E5289C_D0D17823F9903F05_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""B658841948D22E57"""
+"""6CA4296901B42170_2C3AE073F0F22FB5_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""B658841948D22E57"""
+"""72BAC3398479B5D2_125B87C43DCCE72E_6036_UN""","""CC(CC1=C(C(=CC=C1)F)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""B658841948D22E57"""
+"""AAFE2431ADD90B22_3CF3930FE6D4CBBC_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=CN=C(OC)C=C3""",21,"""B7C86B754D38CCDB"""
+"""11EC643F1D3E85AB_3E22F16E14073E8D_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=CC(=C(N=C3)O)C""",21,"""B7C86B754D38CCDB"""
+"""04B6596A34FE54CB_E2243AF06462E2C1_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(C=CC=C3F)F""",21,"""B7C86B754D38CCDB"""
+"""53D67D81F389C9E7_CE033FB7A7E3A6E4_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(C=CC(=C3)C)C""",21,"""B7C86B754D38CCDB"""
+"""7AEB9608302E768C_98D6913791664418_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=CC=C(SC)C=C3""",21,"""B7C86B754D38CCDB"""
+"""C49F4AE8497B388F_7F39C7F6BFF0B3FC_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(C(=CC=C3)Cl)Cl""",21,"""B7C86B754D38CCDB"""
+"""8AC88D5ED316898F_C8BF11760CA66610_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(N=C(C=C3)O)F""",21,"""B7C86B754D38CCDB"""
+"""19AEBB65B98CB912_8F0CE57F3A98DDAE_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(C)C=NC(=C3)F""",21,"""B7C86B754D38CCDB"""
+"""D01FB82010AE0689_E569AACDBC6DE6A2_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=CC(=C(C=C3)F)F""",21,"""B7C86B754D38CCDB"""
+"""C6E74A0988BE8039_CCD0EBD71A8E6874_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=CC(=C(C)C=C3)C""",21,"""B7C86B754D38CCDB"""
+"""E842B6DB4EBE5BA1_1CC28CAE6E0DB218_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(SC)C=CC=C3""",21,"""B7C86B754D38CCDB"""
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+"""9006BF8A8AAD0FCE_6449CF2F6848B638_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(CC)C=CC=C3""",21,"""B7C86B754D38CCDB"""
+"""70E021FC5ACD20B1_B60D2106DA65F2E4_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(C=CC(=C3)F)F""",21,"""B7C86B754D38CCDB"""
+"""FDBE2F8AE8DE25FA_1B8DFA528648501B_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(OC)N=CC=C3""",21,"""B7C86B754D38CCDB"""
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+"""E022F376A7B49EC5_3A853DD467765A00_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(C(=CC=C3)Br)F""",21,"""B7C86B754D38CCDB"""
+"""08CF06F30A9A4DE2_2E426A9BA39DBA43_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(C=C(C)C=C3)C""",21,"""B7C86B754D38CCDB"""
+"""B742098D3344E4B4_963D1C68360484D2_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=CC=CC(=C3)CC""",21,"""B7C86B754D38CCDB"""
+"""D5C31E979F7C7060_54254035E9DCA85F_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C([N](C)N=C3)C#N""",21,"""B7C86B754D38CCDB"""
+"""310188ABB156D3B7_B203C50E897062C0_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=C(C)C=CC(=C3)F""",21,"""B7C86B754D38CCDB"""
+"""13B81C4004240783_B7884CCE0C6D325C_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=CC(=C(C=C3)Cl)F""",21,"""B7C86B754D38CCDB"""
+"""C756A049F173F87D_ABB5A7CB609CCBAD_6006_UN""","""CCC(=O)C2=C1OCCC1=CC(=C2)C3=CN=C(NC)C=C3""",21,"""B7C86B754D38CCDB"""
+"""3912A87C915A04A7_17CD7B90A858C5FC_2201_UN""","""CC1=CC4=C(N=C1C3=C2OCCC2=CC(=C3)Cl)N=CC=C4""",21,"""B7C86B754D38CCDB"""
+"""9950AC29CD74BF40_A15086BBCC2F1215_2201_UN""","""CC1=CC4=C(N=C1C3=C2OCCC2=CC(=C3)Cl)C=CN=C4""",21,"""B7C86B754D38CCDB"""
+"""9CE9558045EEAD6F_7B1CCE3EBFF0EB66_2201_UN""","""CC2=C(C)C1=NON=C1N=C2C4=C3OCCC3=CC(=C4)Cl""",21,"""B7C86B754D38CCDB"""
+"""7D8C73995FBD06F4_96F8FF7452D7AA5F_2201_UN""","""CC2=C(C)C1=C(SC=C1)N=C2C4=C3OCCC3=CC(=C4)Cl""",21,"""B7C86B754D38CCDB"""
+"""AC3814F8D7700660_9EC505CBB1A73BB1_2201_UN""","""CC2=CC1=C([N](C)N=C1)N=C2C4=C3OCCC3=CC(=C4)Cl""",21,"""B7C86B754D38CCDB"""
+"""A84176AF5D33B41C_6242D8845636C564_2201_UN""","""CC1=CC4=C(N=C1C3=C2OCCC2=CC(=C3)Cl)C=NC=C4""",21,"""B7C86B754D38CCDB"""
+"""BE8BB334B9A6059B_BD1D057C99B9A573_2201_UN""","""CC2=CC1=C(ON=C1C)N=C2C4=C3OCCC3=CC(=C4)Cl""",21,"""B7C86B754D38CCDB"""
+"""157D5BACC5F94C2A_FBC3C70F854586BC_2201_UN""","""CC2=CC1=C(C)[NH]N=C1N=C2C4=C3OCCC3=CC(=C4)Cl""",21,"""B7C86B754D38CCDB"""
+"""B0B931F01A270ECF_696554BACF6CC45F_2201_UN""","""CC1=CC4=C(N=C1C3=C2OCCC2=CC(=C3)Cl)N=CN=C4""",21,"""B7C86B754D38CCDB"""
+"""A5CC56B6A165571E_4929178C9AD05CF4_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](CCN)(=O)=O)C3CC3""",21,"""B7E16963442B31EC"""
+"""D6E60C427363A308_D250C7063773535A_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""B7E16963442B31EC"""
+"""85C60080778A2817_85DF2BB3D9337006_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""B7E16963442B31EC"""
+"""F85E3813A2842F05_98C92A0B979B09CE_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](CC)(=O)=O)CCCN""",21,"""B7E16963442B31EC"""
+"""45D06396909FD0E3_12168FE6614F3CEF_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](C)(=O)=O)C3CC(C3)N""",21,"""B7E16963442B31EC"""
+"""FA83CA3565AD5A64_54CC87E1517ABE6E_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""B7E16963442B31EC"""
+"""97F86DB4464B3E0A_A12D0BA783E82B2F_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C)[S](=O)(=O)C3CNCC3""",21,"""B7E16963442B31EC"""
+"""C5608430A05851CA_1F7500B03C078EEB_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](CC)(=O)=O)CCCBr""",21,"""B7E16963442B31EC"""
+"""0BEE89A94B71D4B6_ABAF81B099090D65_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(CCCNC)[S](=O)(=O)C""",21,"""B7E16963442B31EC"""
+"""516094F4BF0D137E_4EC289D610C0173D_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""B7E16963442B31EC"""
+"""655CE116F23F8729_1C89E3CD4CFFC4F5_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](=O)(=O)CC#N)C3CC3""",21,"""B7E16963442B31EC"""
+"""1354F1D768A60FB3_9F5D88BBA45986E2_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""B7E16963442B31EC"""
+"""4AFB389AD36DBD19_595BDF4B40073211_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""B7E16963442B31EC"""
+"""93ACA8E51E61014B_FBFD82D250482050_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""B7E16963442B31EC"""
+"""58DBDE03976C2DA7_369AD99B8F06000F_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""B7E16963442B31EC"""
+"""4118EBC780754162_C2E7762C400650A6_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""B7E16963442B31EC"""
+"""0A4EAC7C75DD04D6_C813912CDC7D68A0_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""B7E16963442B31EC"""
+"""A4A58A9CC7FE47AB_CA3DC40DDE76D88B_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""B7E16963442B31EC"""
+"""33C1277773159950_59FFDB41048E036F_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""B7E16963442B31EC"""
+"""27C759EE2806975C_894EECE702F3074B_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""B7E16963442B31EC"""
+"""7AC8F632237544F9_C3418B56953D80C6_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""B7E16963442B31EC"""
+"""7FBF8179D0DA7FE6_2F7C15349F1724C9_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""B7E16963442B31EC"""
+"""EB316803A3083BC9_2691A15034420973_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](=O)(=O)C3CC3)CC#C""",21,"""B7E16963442B31EC"""
+"""8DD58209B97E4CF9_7291BBDBD34CCCB5_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""B7E16963442B31EC"""
+"""1898504844978F6C_5AFAF426F648805D_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N3CCCC(C)(C)[S]3(=O)=O""",21,"""B7E16963442B31EC"""
+"""A3828779A47ADABF_91D30F727F8E4B4E_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N3CCCC(CC)[S]3(=O)=O""",21,"""B7E16963442B31EC"""
+"""3DCD42A909B35095_A0BA7FA81A37FDE1_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""B7E16963442B31EC"""
+"""60D7CC51B6D8E8DB_7FA41806603FC4CF_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""B7E16963442B31EC"""
+"""128D50F8E1B20153_D49CD69FB4AF59E3_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""B7E16963442B31EC"""
+"""E60A31011EEAF7A3_94F066CFB195805D_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""B7E16963442B31EC"""
+"""9CDB6D8C8FFE60C4_3CBFFC1B4A889F35_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N3[S](CCN(C)CC3)(=O)=O""",21,"""B7E16963442B31EC"""
+"""C360324BEB6D2111_B028DA96222174D6_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N3CC(=O)NCC[S]3(=O)=O""",21,"""B7E16963442B31EC"""
+"""AE4F2550A616B5FE_E5D3C79F8F84B342_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N3[S](CCCCC3C)(=O)=O""",21,"""B7E16963442B31EC"""
+"""1B32BDE1B43EDE63_9F7B825321645CBC_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(CCN)[S](=O)(=O)C3CC3""",21,"""B7E16963442B31EC"""
+"""26C3B2439303DF19_F981A4928548CE4B_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""B7E16963442B31EC"""
+"""98C821C5C8739464_598438F7BB4330A9_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N([S](CC)(=O)=O)C3CNC3""",21,"""B7E16963442B31EC"""
+"""E3CFBCCB6381D14A_6B1DECCB2CAA64D4_6036_DP""","""C1(CN(C1)C2=NC=C(C=C2)Br)N4CC3(CNC3)C[S]4(=O)=O""",21,"""B7E16963442B31EC"""
+"""3EBE1679E5269DBF_D1689559F56920BE_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""B7E16963442B31EC"""
+"""BE89F112AD8FA6F6_2D830D09FC0B300E_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""B7E16963442B31EC"""
+"""1B070788291A42F5_13E26ABE3135F895_6036_UN""","""C1(CN(C1)C2=NC=C(C=C2)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""B7E16963442B31EC"""
+"""49E1061C9A122793_B946CDDC4CF7DE21_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""B8B69C88BD6C27FD"""
+"""B3EA1DA9780552D0_163135F0B7E772DD_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""B8B69C88BD6C27FD"""
+"""0EC44ECFED9365F0_EA314237280C85F7_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""B8B69C88BD6C27FD"""
+"""388628CA67BA468A_B60BBA61BB20B3F3_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""B8B69C88BD6C27FD"""
+"""42DF7E0050AD7471_8523D5A03C4E455B_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""B8B69C88BD6C27FD"""
+"""B413D594100511B7_4EC231D4E439B1A8_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""B8B69C88BD6C27FD"""
+"""862E5E8B0CF59936_96AD15D8B0FDA020_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2)COCCOC""",21,"""B8B69C88BD6C27FD"""
+"""1F94EEC7C08E43C0_1FC098D9BE41AB4C_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""B8B69C88BD6C27FD"""
+"""98D847E23515B371_00DB8C3A890B4C29_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""B8B69C88BD6C27FD"""
+"""1CF1EF5D424DA72B_529A740E02BEEC05_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""B8B69C88BD6C27FD"""
+"""61476BEB3363BB05_4763923A99C34D47_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""B8B69C88BD6C27FD"""
+"""D94ED0472664DFDA_3ED8FD166EF9713A_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""B8B69C88BD6C27FD"""
+"""5D5D766ADA6E4B0F_27FCD91406959EBA_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""B8B69C88BD6C27FD"""
+"""C39597E7A6D6F0AB_5A0886F681832FD3_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""B8B69C88BD6C27FD"""
+"""EFA59DC6FBDC73A7_ADD54A3410E18CE8_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""B8B69C88BD6C27FD"""
+"""516A6D17D07775E1_9AF272B0E78B8F5C_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""B8B69C88BD6C27FD"""
+"""2F2412E451652970_483E8C34CD84A5EF_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""B8B69C88BD6C27FD"""
+"""ACFBF0B5A6EA435F_98EB42BC38DE91FC_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""B8B69C88BD6C27FD"""
+"""1D4B3A166B1D5E54_B77E76F32BF9F339_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""B8B69C88BD6C27FD"""
+"""43F353F06DD5ED82_B2458856F7C92110_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""B8B69C88BD6C27FD"""
+"""7B0925B9FD42AB9C_77BE2EA19749BD24_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""B8B69C88BD6C27FD"""
+"""429006BFD5B4F471_6792BEF048A709D0_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""B8B69C88BD6C27FD"""
+"""6AF3EE9CE82EA0A1_BA81E7C9E604FDAA_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""B8B69C88BD6C27FD"""
+"""69B1E10EAA657966_2AF203B37FF9777F_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""B8B69C88BD6C27FD"""
+"""8BDCEDB8E97813F7_0FD3B3009FF6B9A4_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""B8B69C88BD6C27FD"""
+"""0ED4C756D5AB3EEC_692E0341B67F08C4_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""B8B69C88BD6C27FD"""
+"""E3A696D3106402AE_9443605748359894_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""B8B69C88BD6C27FD"""
+"""9213E68D74256475_1575B9A9FFCEF040_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""B8B69C88BD6C27FD"""
+"""F047AE262D347543_600ADB9B85E254F7_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""B8B69C88BD6C27FD"""
+"""E529D468378ED54E_9FED1C1752E3AA1A_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""B8B69C88BD6C27FD"""
+"""2FCC1C7E5C69EB23_686AF5E2799A8704_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""B8B69C88BD6C27FD"""
+"""BC9D136903A3F167_1E61DBFEB1F6806F_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""B8B69C88BD6C27FD"""
+"""C8CCAEDD21E6FCD4_DB514AC42812E910_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""B8B69C88BD6C27FD"""
+"""B88A5320E3337929_B1357FE2D724E270_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""B8B69C88BD6C27FD"""
+"""82F8DCB9F07B7822_C00ECD97C62F6C83_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""B8B69C88BD6C27FD"""
+"""4132F0F42EB61DD2_72C521E2046665C1_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""B8B69C88BD6C27FD"""
+"""32E90CB39BC77A76_070BB36A3ECAF5F3_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""B8B69C88BD6C27FD"""
+"""A7E04335898EFB59_54F7EB3300B854E2_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(C=CC=C2)CN3CCCC3""",21,"""B8B69C88BD6C27FD"""
+"""02ED74D8C71816F8_CC23BBB2BC0AB758_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=CC(=N[N]2C3CCCCO3)C""",21,"""B8B69C88BD6C27FD"""
+"""DF92D960F1C7731C_C62491B1E57753A5_6005_UN""","""OCC1=C(C=CC(=C1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""B8B69C88BD6C27FD"""
+"""D9608C8E034B6B79_B830F3BEDD954AD9_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=CC=C2)OC3CCCC3""",21,"""B9C0A2EA2C0EB305"""
+"""07799FE1E455EB46_17470B922685E625_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=C(OCC)C=C2)OCC""",21,"""B9C0A2EA2C0EB305"""
+"""BC89C9AD1D3D1516_EB477C55B96E110F_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=CC(=C2)OCCC(C)C""",21,"""B9C0A2EA2C0EB305"""
+"""2EBD4CE070371DF1_B77D84032A42270B_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""B9C0A2EA2C0EB305"""
+"""D70DEBC3DA16B0DB_8455EBC2AD2CD1A3_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=C(C=C2)OC3CCOC3""",21,"""B9C0A2EA2C0EB305"""
+"""6711D2CD945B69CF_4FB40FB6755B2550_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""B9C0A2EA2C0EB305"""
+"""F89BAB68F6A3E345_97DB2BBA219F34D8_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=CC(=C2)COCCOC""",21,"""B9C0A2EA2C0EB305"""
+"""93C94488F1993853_1EB6A6BB2F233FB4_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""B9C0A2EA2C0EB305"""
+"""C48C636BDE74E36F_01ADB2581869D8D1_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=CC(=C2)OC(COC)C""",21,"""B9C0A2EA2C0EB305"""
+"""095D259C226DE7B9_53EC4A6C93DC78FD_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""B9C0A2EA2C0EB305"""
+"""0273B3F56F63F381_4615AC5808A1D9BF_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""B9C0A2EA2C0EB305"""
+"""C850045708D1C51F_3FAEC374FF9BE5C2_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=CC=C2)CN3CCCC3""",21,"""B9C0A2EA2C0EB305"""
+"""47370A23D6380D2E_268AE77697F70A42_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""B9C0A2EA2C0EB305"""
+"""F283B455A4DF0FB1_5B7EB89410E1BB2B_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=CC(=C2)OCCN(C)C""",21,"""B9C0A2EA2C0EB305"""
+"""4619E500BB0B7672_ACA3745681831810_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""B9C0A2EA2C0EB305"""
+"""4C9F38CBEE870ECB_9B844CD276E91BA4_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""B9C0A2EA2C0EB305"""
+"""A3DC7AA4FEFEFF25_4948B2565CE63117_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""B9C0A2EA2C0EB305"""
+"""DBEA6C27C70467B5_999D7CDEA9BC0504_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""B9C0A2EA2C0EB305"""
+"""D43CBF81665759AA_B6084891BA9B67C1_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""B9C0A2EA2C0EB305"""
+"""7F730E4CC35D8CA7_B333B63466ABB5E8_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""B9C0A2EA2C0EB305"""
+"""7795597FE278AF1C_76C810C3062B29DC_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""B9C0A2EA2C0EB305"""
+"""55AC1A55C964B1DC_66E48092D9C59D28_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""B9C0A2EA2C0EB305"""
+"""088E3E314192B0C9_BBF7D9AB77666952_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""B9C0A2EA2C0EB305"""
+"""C875D68C3C44D50F_2B843DD1EE9BE387_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""B9C0A2EA2C0EB305"""
+"""70506933F0578E60_0EA58D620E942D5C_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""B9C0A2EA2C0EB305"""
+"""A179B96C54546D9B_68583D23271D9C3C_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=C(OCCC(C)C)C=C2""",21,"""B9C0A2EA2C0EB305"""
+"""691E27192D2FFE67_95355E35D9570C6C_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=C(C=C2)OC3CCCC3""",21,"""B9C0A2EA2C0EB305"""
+"""74E9F256FAED471B_140387CB6EAC64B8_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""B9C0A2EA2C0EB305"""
+"""FE513755A585DF7A_617CE5F91480C00F_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""B9C0A2EA2C0EB305"""
+"""FF10CF11C0E832F6_9E9B2275C3813EE2_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""B9C0A2EA2C0EB305"""
+"""2E3330DD9DD74C87_691CCB80E8F813FC_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""B9C0A2EA2C0EB305"""
+"""104142EA7C397CC0_1F17E59C20941497_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""B9C0A2EA2C0EB305"""
+"""53B08DFE2FF161F8_DA2774A6B9707DE8_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""B9C0A2EA2C0EB305"""
+"""4D7A8FC17B33A03A_B043418046467688_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""B9C0A2EA2C0EB305"""
+"""59BF2115B4E91BB1_C178F3F5574DF87B_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""B9C0A2EA2C0EB305"""
+"""14FF5A4C3E20D2E4_73B31F809504F139_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""B9C0A2EA2C0EB305"""
+"""9BCE771690E4C56A_067D8D08AFA8610B_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""B9C0A2EA2C0EB305"""
+"""97A820FBA5A3A593_5581D55191DAC01A_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(C=CC=C2)CN3CCCC3""",21,"""B9C0A2EA2C0EB305"""
+"""24783CA507DF7293_CD5585D02D6823A0_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""B9C0A2EA2C0EB305"""
+"""FE3C32941E0E61FB_C752AFD37415C75D_6005_UN""","""CC(C)(C)[N]1C=C(C=N1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""B9C0A2EA2C0EB305"""
+"""5A8C584059C1175C_B81A39FF5CF5153F_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=CC=C2)OC3CCCC3)F""",21,"""B9EA68ABAD6EECE3"""
+"""CBFAD2FFC9A57D6C_176DC1D3A7E5B9C3_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=C(OCC)C=C2)OCC)F""",21,"""B9EA68ABAD6EECE3"""
+"""3FFFC17BCCF65097_EB6DB614380E4EE9_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=CC(=C2)OCCC(C)C)F""",21,"""B9EA68ABAD6EECE3"""
+"""95F985963564AA5A_B7574E42AB2278ED_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3)F""",21,"""B9EA68ABAD6EECE3"""
+"""E5ACB58C835819E5_847F21832C4C8E45_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=C(C=C2)OC3CCOC3)F""",21,"""B9EA68ABAD6EECE3"""
+"""F93CF3DE3F361254_4F9EC5F7F43B7AB6_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=C(OC)C=C2)CN(C)C)F""",21,"""B9EA68ABAD6EECE3"""
+"""FEA0E7FE40279660_97F1E1FBA0FF6B3E_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=CC(=C2)COCCOC)F""",21,"""B9EA68ABAD6EECE3"""
+"""56BDE602343AC0A6_1E9C6CFAAE436052_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=CC(=C2)CN(C)C3CC3)F""",21,"""B9EA68ABAD6EECE3"""
+"""032067A590705B06_0187781999098737_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=CC(=C2)OC(COC)C)F""",21,"""B9EA68ABAD6EECE3"""
+"""DD955E3BF782B841_53C6802D12BC271B_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F)F""",21,"""B9EA68ABAD6EECE3"""
+"""BE99F91D96EC647F_463F661989C18659_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F)F""",21,"""B9EA68ABAD6EECE3"""
+"""2D2C035A943BB2EA_3F8409357EFBBA24_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=CC=C2)CN3CCCC3)F""",21,"""B9EA68ABAD6EECE3"""
+"""7CD9188FAA5AD2A2_26A02D37169755A4_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3)F""",21,"""B9EA68ABAD6EECE3"""
+"""45B586839129373F_5B5472D59181E4CD_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=CC(=C2)OCCN(C)C)F""",21,"""B9EA68ABAD6EECE3"""
+"""5EB324C204B8B4F5_AC89BE1700E347F6_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C)F""",21,"""B9EA68ABAD6EECE3"""
+"""F8BBBEFE5A13A075_9BAE8693F7894442_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3)F""",21,"""B9EA68ABAD6EECE3"""
+"""D00C835575EF3C81_49627817DD866EF1_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(C=CC=C2F)OC(F)(F)F)F""",21,"""B9EA68ABAD6EECE3"""
+"""4D7FCC7195332BBB_99B7B69F28DC5AE2_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F)F""",21,"""B9EA68ABAD6EECE3"""
+"""EC86AA39D81916C2_B62282D03BFB3827_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F)F""",21,"""B9EA68ABAD6EECE3"""
+"""BBDC378BCED8AA45_B3197C75E7CBEA0E_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O)F""",21,"""B9EA68ABAD6EECE3"""
+"""C66FFD8AF166E785_76E2DA82874B763A_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F)F""",21,"""B9EA68ABAD6EECE3"""
+"""849818B356FD6988_66CE4AD358A5C2CE_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)F""",21,"""B9EA68ABAD6EECE3"""
+"""77ED516F193A43D6_BBDD13EAF60636B4_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3)F""",21,"""B9EA68ABAD6EECE3"""
+"""2D63B3C74E42880B_2BAEF7906FFBBC61_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F)F""",21,"""B9EA68ABAD6EECE3"""
+"""7335F38019590612_0E8F47238FF472BA_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F)F""",21,"""B9EA68ABAD6EECE3"""
+"""902830B277FDE90F_6872F762A67DC3DA_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=C(OCCC(C)C)C=C2)F""",21,"""B9EA68ABAD6EECE3"""
+"""36C96E8C8D1032DD_951F94745837538A_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=C(C=C2)OC3CCCC3)F""",21,"""B9EA68ABAD6EECE3"""
+"""7388005E8B1C7375_14294D8AEFCC3B5E_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(C=C(OC)C=C2)CN(C)C)F""",21,"""B9EA68ABAD6EECE3"""
+"""47033E1890AAD49F_61562FB895E09FE9_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC)F""",21,"""B9EA68ABAD6EECE3"""
+"""B84228790078B27D_9EB1E83442E16104_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(C)C=C(C=C2)OCC3CC3)F""",21,"""B9EA68ABAD6EECE3"""
+"""01B1C37FC3477C3E_693601C169984C1A_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F)F""",21,"""B9EA68ABAD6EECE3"""
+"""1AF9910BE23282E7_1F3D2FDDA1F44B71_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(OCC(C)(C)C)N=CC=C2)F""",21,"""B9EA68ABAD6EECE3"""
+"""737DF64827A4DE92_DA0DBEE73810220E_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3)F""",21,"""B9EA68ABAD6EECE3"""
+"""6CF7392F39FFEFC4_B0698BC1C726296E_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O)F""",21,"""B9EA68ABAD6EECE3"""
+"""9EC2A2A339B6CC08_C15239B4D62DA79D_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3)F""",21,"""B9EA68ABAD6EECE3"""
+"""EB1D5A607F2F796C_7399D5C11464AEDF_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC)F""",21,"""B9EA68ABAD6EECE3"""
+"""0D0DBA3B4B47DD11_065747492EC83EED_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3)F""",21,"""B9EA68ABAD6EECE3"""
+"""A54AE6E5F94651F7_55AB1F1010BA9FFC_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(C=CC=C2)CN3CCCC3)F""",21,"""B9EA68ABAD6EECE3"""
+"""B1285D8591E97EA1_CD7F4F91AC087C46_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=CC(=N[N]2C3CCCCO3)C)F""",21,"""B9EA68ABAD6EECE3"""
+"""3B4AECF2B22E4904_C7786592F57598BB_6005_UN""","""FC1=C(C(=C(C=N1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F)F""",21,"""B9EA68ABAD6EECE3"""
+"""63CF00979622A557_47393CD3197D3094_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](CCN)(=O)=O)C2CC2""",21,"""B9F1423CC7865D8C"""
+"""DB60CB400C5075F5_DC40EC59B4DE3F3A_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C(C)C)[S](=O)(=O)CCN""",21,"""B9F1423CC7865D8C"""
+"""BE69C7EBA076F93B_8BCF00EC5A9E1C66_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](C)(=O)=O)CCN=C=S""",21,"""B9F1423CC7865D8C"""
+"""A047CBBE4027BC74_96D90154143665AE_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](CC)(=O)=O)CCCN""",21,"""B9F1423CC7865D8C"""
+"""80B702DFB4D46C94_1C06A4B9E2E2508F_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](C)(=O)=O)C2CC(C2)N""",21,"""B9F1423CC7865D8C"""
+"""80081237827B1BED_5ADCACBED2D7D20E_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(CCCN)[S](=O)(=O)CCl""",21,"""B9F1423CC7865D8C"""
+"""360D264E18AADD2D_AF3D20F80045474F_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C)[S](=O)(=O)C2CNCC2""",21,"""B9F1423CC7865D8C"""
+"""978750421784F7E6_11652BEFBFAAE28B_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](CC)(=O)=O)CCCBr""",21,"""B9F1423CC7865D8C"""
+"""558686F09D8D6A7F_A5BFAAEF1AA46105_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(CCCNC)[S](=O)(=O)C""",21,"""B9F1423CC7865D8C"""
+"""1134518E853DFFF4_40D2A289936D7B5D_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""B9F1423CC7865D8C"""
+"""B8BE07D1AE6F56B2_1299C892CF52A895_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](=O)(=O)CC#N)C2CC2""",21,"""B9F1423CC7865D8C"""
+"""3398330CA7A87262_914DA3E427F4EA82_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](C)(=O)=O)C(=O)CCN""",21,"""B9F1423CC7865D8C"""
+"""1B5BEB8075B8884F_574BF414C3AA5E71_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C)[S](=O)(=O)C2=CC=CS2""",21,"""B9F1423CC7865D8C"""
+"""C3D6C321F051A23C_F5EDA98DD3E54C30_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""B9F1423CC7865D8C"""
+"""47BDE780A969D086_388AF2C40CAB6C6F_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""B9F1423CC7865D8C"""
+"""D568C6F61686D742_CCF75D73C3AB3CC6_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""B9F1423CC7865D8C"""
+"""1EF0D661A1A1ED4D_C603BA735FD004C0_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(CC(CC)N)[S](=O)(=O)C""",21,"""B9F1423CC7865D8C"""
+"""AFE7953D85B9AD2A_C42DEF525DDBB4EB_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""B9F1423CC7865D8C"""
+"""646C31BB08D382CE_57EFF01E87236F0F_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](C)(=O)=O)CCN=[N]#N""",21,"""B9F1423CC7865D8C"""
+"""6EB89EDF8C442CAE_875EC7B8815E6B2B_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(CC(C)(C)N)[S](=O)(=O)C""",21,"""B9F1423CC7865D8C"""
+"""EB29EBBF89AD7831_CD51A0091690ECA6_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""B9F1423CC7865D8C"""
+"""926909285D42BB10_216C3E6B1CBA48A9_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""B9F1423CC7865D8C"""
+"""4807EAF584DA2D5A_28818A0FB7EF6513_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](=O)(=O)C2CC2)CC#C""",21,"""B9F1423CC7865D8C"""
+"""29A4075560C0A0D4_7C81908450E1A0D5_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN2[S](=O)(=O)C3(CCC2)CC3""",21,"""B9F1423CC7865D8C"""
+"""B5230FE272B2D858_54EADF7975E5EC3D_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN2CCCC(C)(C)[S]2(=O)=O""",21,"""B9F1423CC7865D8C"""
+"""1C5876AD593D547C_9FC3242DFC23272E_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN2CCCC(CC)[S]2(=O)=O""",21,"""B9F1423CC7865D8C"""
+"""8DD191295077684E_AEAA54F7999A9181_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN2C(C(N)CC[S]2(=O)=O)=O""",21,"""B9F1423CC7865D8C"""
+"""BC416D18BD9B843E_71B43359E392A8AF_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""B9F1423CC7865D8C"""
+"""1ACD88C1F49A419E_DA8CFDC037023583_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""B9F1423CC7865D8C"""
+"""C084885F69FC61F2_9AE04D903238EC3D_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""B9F1423CC7865D8C"""
+"""02290D52833F3F2D_32AFD744C925F355_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN2[S](CCN(C)CC2)(=O)=O""",21,"""B9F1423CC7865D8C"""
+"""AC93B958EDD83087_BE38F1C9A18C18B6_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN2CC(=O)NCC[S]2(=O)=O""",21,"""B9F1423CC7865D8C"""
+"""CE933A0E2FD00CDE_EBC3ECC00C29DF22_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN2[S](CCCCC2C)(=O)=O""",21,"""B9F1423CC7865D8C"""
+"""063A8742A8DF02D8_916BA90CA2C930DC_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(CCN)[S](=O)(=O)C2CC2""",21,"""B9F1423CC7865D8C"""
+"""B263A764F292498B_F7918FCD06E5A22B_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(CCN)[S](=O)(=O)C(F)F""",21,"""B9F1423CC7865D8C"""
+"""F08530EC2428CD1D_579413A838EE5CC9_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN([S](CC)(=O)=O)C2CNC2""",21,"""B9F1423CC7865D8C"""
+"""C0F24AB0F5A843EA_650DC794AF0708B4_6036_DP""","""CN(C)C1=C(C=CC(=C1)Br)CN3CC2(CNC2)C[S]3(=O)=O""",21,"""B9F1423CC7865D8C"""
+"""692DE7575757A666_DF78BE0676C44CDE_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""B9F1423CC7865D8C"""
+"""AE00043A4198D941_239326567FA65C6E_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""B9F1423CC7865D8C"""
+"""FF4A5E5AF050DC71_1DF241E1B29894F5_6036_UN""","""CN(C)C1=C(C=CC(=C1)Br)CN(C(C)(C)CN)[S](=O)(=O)C""",21,"""B9F1423CC7865D8C"""
+"""99A39B181B151B15_BBCB2150F310C38B_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""BA3B7004028B3A57"""
+"""1DE7038BEB633037_14BCD97C08006F77_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""BA3B7004028B3A57"""
+"""3E40552901CD7C33_E8BCAEBB97EB985D_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""BA3B7004028B3A57"""
+"""2F81469F400C90CC_B48656ED04C7AE59_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""BA3B7004028B3A57"""
+"""1BCC5D8AE7FAAF23_87AE392C83A958F1_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""BA3B7004028B3A57"""
+"""78333E813D377C01_4C4FDD585BDEAC02_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""BA3B7004028B3A57"""
+"""724CCE7196B42974_9420F9540F1ABD8A_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=CC(=C2)COCCOC""",21,"""BA3B7004028B3A57"""
+"""98B06C7195C539B4_1D4D745501A6B6E6_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""BA3B7004028B3A57"""
+"""94032A72465742FB_025660B636EC5183_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""BA3B7004028B3A57"""
+"""05AA0CC12257C68B_50179882BD59F1AF_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""BA3B7004028B3A57"""
+"""613DB71F5E2F7945_45EE7EB6262450ED_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""BA3B7004028B3A57"""
+"""B01B0AD8DED80CEC_3C55119AD11E6C90_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""BA3B7004028B3A57"""
+"""171DD42FDD4007CF_25713598B9728310_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""BA3B7004028B3A57"""
+"""6FF1BAC05F13FE8D_58856A7A3E643279_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""BA3B7004028B3A57"""
+"""BAB1DC43B843344C_AF58A6B8AF069142_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""BA3B7004028B3A57"""
+"""ED22DC1FA245204D_987F9E3C586C92F6_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""BA3B7004028B3A57"""
+"""B37E6B1973B45F73_4AB360B87263B845_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""BA3B7004028B3A57"""
+"""4E44AFA90B7EC65B_9A66AE3087398C56_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""BA3B7004028B3A57"""
+"""DFFFE96404800655_B5F39A7F941EEE93_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""BA3B7004028B3A57"""
+"""51E8940613D90638_B0C864DA482E3CBA_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""BA3B7004028B3A57"""
+"""DA149A7FFD46AE2E_7533C22D28AEA08E_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""BA3B7004028B3A57"""
+"""8B175DDDF9EAEFA4_651F527CF740147A_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""BA3B7004028B3A57"""
+"""3AD0440B60875BDB_B80C0B4559E3E000_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""BA3B7004028B3A57"""
+"""25075CACAAA71183_287FEF3FC01E6AD5_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""BA3B7004028B3A57"""
+"""2E824A4032648B89_0D5E5F8C2011A40E_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""BA3B7004028B3A57"""
+"""F7994861982B074E_6BA3EFCD0998156E_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""BA3B7004028B3A57"""
+"""131087645E58A45B_96CE8CDBF7D2853E_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""BA3B7004028B3A57"""
+"""BCBACA2D432885EE_17F855254029EDEA_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""BA3B7004028B3A57"""
+"""1AFEF6D850A13446_628737173A05495D_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""BA3B7004028B3A57"""
+"""65FB4662E4D8D7CF_9D60F09BED04B7B0_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""BA3B7004028B3A57"""
+"""F61C1131585E731D_6AE7196EC67D9AAE_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""BA3B7004028B3A57"""
+"""4761907507676E41_1CEC37720E119DC5_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""BA3B7004028B3A57"""
+"""4DA89857058E8828_D9DCA64897F5F4BA_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""BA3B7004028B3A57"""
+"""B3C3CC8C1DB194AD_B3B8936E68C3FFDA_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""BA3B7004028B3A57"""
+"""88E50234FEDE6F25_C283211B79C87129_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""BA3B7004028B3A57"""
+"""A55F4205210C32B7_7048CD6EBB81786B_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""BA3B7004028B3A57"""
+"""C0A1BF98638F5886_05865FE6812DE859_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""BA3B7004028B3A57"""
+"""04467C033467DBB8_567A07BFBF5F4948_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(C=CC=C2)CN3CCCC3""",21,"""BA3B7004028B3A57"""
+"""5AC602DA14C35852_CEAE573E03EDAAF2_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=CC(=N[N]2C3CCCCO3)C""",21,"""BA3B7004028B3A57"""
+"""A5BA6E7EAC2F2A05_C4A97D3D5A904E0F_6005_UN""","""NCC1=C(C=C(C=C1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""BA3B7004028B3A57"""
+"""B83831107CC4B633_448AB7FA2EAC9367_6036_UN""","""C(C2CNC1=C(C=CC=C1)C2)N([S](CCN)(=O)=O)C3CC3""",21,"""BA42C915F057FE7F"""
+"""B092D09218B8912D_DFF36770830F9CC9_6036_UN""","""C(C2CNC1=C(C=CC=C1)C2)N(C(C)C)[S](=O)(=O)CCN""",21,"""BA42C915F057FE7F"""
+"""030D1F09253EC29A_887C8BC56D4FBF95_6036_UN""","""C(C2CNC1=C(C=CC=C1)C2)N([S](C)(=O)=O)CCN=C=S""",21,"""BA42C915F057FE7F"""
+"""B85F4A8181F6394D_956A8A7D23E7C65D_6036_UN""","""C(C2CNC1=C(C=CC=C1)C2)N([S](CC)(=O)=O)CCCN""",21,"""BA42C915F057FE7F"""
+"""DB0BFCB2B20DD3BE_1FB52F90D533F37C_6036_UN""","""C(C2CNC1=C(C=CC=C1)C2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""BA42C915F057FE7F"""
+"""64BF1F1F44AAE2A8_596F2797E50671FD_6036_UN""","""C(C2CNC1=C(C=CC=C1)C2)N(CCCN)[S](=O)(=O)CCl""",21,"""BA42C915F057FE7F"""
+"""854B71B88C9C7C2A_AC8EABD13794E4BC_6036_UN""","""C(C2CNC1=C(C=CC=C1)C2)N(C)[S](=O)(=O)C3CNCC3""",21,"""BA42C915F057FE7F"""
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+"""998C0A431129CF06_42A4160AB5CCA71C_6036_UN""","""NC(=O)C1=C([N](N=C1)CCN(C(C)(C)C#N)[S](=O)(=O)C)N""",21,"""BB87F6BFE12781CD"""
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+"""DB7B4DB060035153_933B1767015536C3_6036_UN""","""NC(=O)C1=C([N](N=C1)CCN([S](C)(=O)=O)C(=O)CCN)N""",21,"""BB87F6BFE12781CD"""
+"""46474CEC3CE2E7B6_553D4097E50B8230_6036_UN""","""NC(=O)C1=C([N](N=C1)CCN(C)[S](=O)(=O)C2=CC=CS2)N""",21,"""BB87F6BFE12781CD"""
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+"""BFD751D23E6FA3A8_3AFC46472A0AB02E_6036_UN""","""NC(=O)C1=C([N](N=C1)CCN(C(C)(C)C)[S](=O)(=O)CBr)N""",21,"""BB87F6BFE12781CD"""
+"""722CC8999027F6CD_CE81E9F0E50AE087_6036_UN""","""NC(=O)C1=C([N](N=C1)CCN(C(C)(C)C#C)[S](=O)(=O)C)N""",21,"""BB87F6BFE12781CD"""
+"""97E75B57629AE8CE_C4750EF07971D881_6036_UN""","""NC(=O)C1=C([N](N=C1)CCN(CC(CC)N)[S](=O)(=O)C)N""",21,"""BB87F6BFE12781CD"""
+"""BB328E8896DFB02F_C65B5BD17B7A68AA_6036_UN""","""NC(=O)C1=C([N](N=C1)CCN(C)[S](=O)(=O)C2=C[NH]C=N2)N""",21,"""BB87F6BFE12781CD"""
+"""7CC5421B768ABAB7_5599449DA182B34E_6036_UN""","""NC(=O)C1=C([N](N=C1)CCN([S](C)(=O)=O)CCN=[N]#N)N""",21,"""BB87F6BFE12781CD"""
+"""48ADCD6592C8936F_8528733BA7FFB76A_6036_UN""","""NC(=O)C1=C([N](N=C1)CCN(CC(C)(C)N)[S](=O)(=O)C)N""",21,"""BB87F6BFE12781CD"""
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+"""101DE7950222F39F_903A6A1C88DF5012_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC=CC(=C2)COCCOC""",21,"""BE21E34C854ED7CF"""
+"""C9D15E986EE840A4_1957E71D86635B7E_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""BE21E34C854ED7CF"""
+"""5611AC4B6F7E5127_064CF3FEB129BC1B_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC=CC(=C2)OC(COC)C""",21,"""BE21E34C854ED7CF"""
+"""54C909E9C90937C7_540D0BCA3A9C1C37_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""BE21E34C854ED7CF"""
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+"""87D66AE3C625734C_4EA9F3F0F5A655DD_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""BE21E34C854ED7CF"""
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+"""93FB787AD002C928_B1E9093713DB030B_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""BE21E34C854ED7CF"""
+"""8314782492002A2F_B4D2F792CFEBD122_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""BE21E34C854ED7CF"""
+"""8FAE85B588DF93F0_71295165AF6B4D16_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""BE21E34C854ED7CF"""
+"""FDDDF64F679F69D8_6105C1347085F9E2_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""BE21E34C854ED7CF"""
+"""FBC5356B259AA2F1_BC16980DDE260D98_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""BE21E34C854ED7CF"""
+"""1AD0E10274EED98B_2C657C7747DB874D_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""BE21E34C854ED7CF"""
+"""5CEC7E30CE3DE43C_0944CCC4A7D44996_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""BE21E34C854ED7CF"""
+"""D00B959BD6C9E341_6FB97C858E5DF8F6_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC=C(OCCC(C)C)C=C2""",21,"""BE21E34C854ED7CF"""
+"""97093FF01ED5C035_92D41F93701768A6_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC=C(C=C2)OC3CCCC3""",21,"""BE21E34C854ED7CF"""
+"""0D7245BE8F54FB89_13E2C66DC7EC0072_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""BE21E34C854ED7CF"""
+"""8DDE0FABD799B781_669DA45FBDC0A4C5_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""BE21E34C854ED7CF"""
+"""3ABC3592CD49B75F_997A63D36AC15A28_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""BE21E34C854ED7CF"""
+"""A1AA44F7AD1DE15D_6EFD8A2641B87736_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""BE21E34C854ED7CF"""
+"""56A24AC7C228EAF9_18F6A43A89D4705D_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""BE21E34C854ED7CF"""
+"""8DD58E05C8A4A59B_DDC6350010301922_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""BE21E34C854ED7CF"""
+"""9E3862FBA4C8E724_B7A20026EF061242_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""BE21E34C854ED7CF"""
+"""D7B71C4CCC944744_C699B253FE0D9CB1_6005_UN""","""C[N]1C=C(C(=N1)C(=O)O)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""BE21E34C854ED7CF"""
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+"""DB9D44913FE5EA36_06FDB0D101B9F57D_6005_UN""","""COC1=CC(=C(C=C1)N)C2=CC=CC(=C2)OC(COC)C""",21,"""BE90A06335DE9EA9"""
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+"""2B0C94A0978795FC_38FEC1FDE64BC86E_6005_UN""","""COC1=CC(=C(C=C1)N)C2=CC(=CC=C2)CN3CCCC3""",21,"""BE90A06335DE9EA9"""
+"""0CF08FA781A78C3A_21DAE5FF8E2727EE_6005_UN""","""COC1=CC(=C(C=C1)N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""BE90A06335DE9EA9"""
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+"""8D55F589F75077B9_B1584A18A34B4A6D_6005_UN""","""COC1=CC(=C(C=C1)N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""BE90A06335DE9EA9"""
+"""30ADDA563DF38B47_B463B4BD7F7B9844_6005_UN""","""COC1=CC(=C(C=C1)N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""BE90A06335DE9EA9"""
+"""9B9CDF1A3174D6B2_7198124A1FFB0470_6005_UN""","""COC1=CC(=C(C=C1)N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""BE90A06335DE9EA9"""
+"""FA1FF5758ADBCF29_61B4821BC015B084_6005_UN""","""COC1=CC(=C(C=C1)N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""BE90A06335DE9EA9"""
+"""F31C92ECAFB503F0_BCA7DB226EB644FE_6005_UN""","""COC1=CC(=C(C=C1)N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""BE90A06335DE9EA9"""
+"""C2043BFFEC95D51D_2CD43F58F74BCE2B_6005_UN""","""COC1=CC(=C(C=C1)N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""BE90A06335DE9EA9"""
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+"""5048C053F9BBF48B_6F083FAA3ECDB190_6005_UN""","""COC1=CC(=C(C=C1)N)C2=CC=C(OCCC(C)C)C=C2""",21,"""BE90A06335DE9EA9"""
+"""C5A5393D700A4938_92655CBCC08721C0_6005_UN""","""COC1=CC(=C(C=C1)N)C2=CC=C(C=C2)OC3CCCC3""",21,"""BE90A06335DE9EA9"""
+"""82450F6883337205_13538542777C4914_6005_UN""","""COC1=CC(=C(C=C1)N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""BE90A06335DE9EA9"""
+"""49F464684392C7D1_662CE7700D50EDA3_6005_UN""","""COC1=CC(=C(C=C1)N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""BE90A06335DE9EA9"""
+"""39BEF100B1FF7B57_99CB20FCDA51134E_6005_UN""","""COC1=CC(=C(C=C1)N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""BE90A06335DE9EA9"""
+"""3AC81BE63158BEB1_6E4CC909F1283E50_6005_UN""","""COC1=CC(=C(C=C1)N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""BE90A06335DE9EA9"""
+"""4E2489282E6E001B_1847E7153944393B_6005_UN""","""COC1=CC(=C(C=C1)N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""BE90A06335DE9EA9"""
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+"""63965D857A278869_B71343095F965B24_6005_UN""","""COC1=CC(=C(C=C1)N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""BE90A06335DE9EA9"""
+"""4C68E2FFF3338F2B_C628F17C4E9DD5D7_6005_UN""","""COC1=CC(=C(C=C1)N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""BE90A06335DE9EA9"""
+"""A433451E0C60249B_74E31D098CD4DC95_6005_UN""","""COC1=CC(=C(C=C1)N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""BE90A06335DE9EA9"""
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+"""EECA9321AA5B4CFC_52D1D7D8880AEDB6_6005_UN""","""COC1=CC(=C(C=C1)N)C2=C(C=CC=C2)CN3CCCC3""",21,"""BE90A06335DE9EA9"""
+"""F29563A44C4DCE82_CA05875934B80E0C_6005_UN""","""COC1=CC(=C(C=C1)N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""BE90A06335DE9EA9"""
+"""15577861A2CBF9FB_C002AD5A6DC5EAF1_6005_UN""","""COC1=CC(=C(C=C1)N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""BE90A06335DE9EA9"""
+"""2EFFB84A39E818EF_406D0CEBAAB747CD_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](CCN)(=O)=O)C2CC2""",21,"""BEA57204744C2AD5"""
+"""A4C666ED66514D62_DB14DC6107144863_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C(C)C)[S](=O)(=O)CCN""",21,"""BEA57204744C2AD5"""
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+"""243F6D96CE2A85A3_918D316CA7FC12F7_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](CC)(=O)=O)CCCN""",21,"""BEA57204744C2AD5"""
+"""E75700D1115C8B8E_1B529481512827D6_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](C)(=O)=O)C2CC(C2)N""",21,"""BEA57204744C2AD5"""
+"""F75A375AFC0F3693_5D889C86611DA557_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(CCCN)[S](=O)(=O)CCl""",21,"""BEA57204744C2AD5"""
+"""654992D14F60B70D_A86910C0B38F3016_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C)[S](=O)(=O)C2CNCC2""",21,"""BEA57204744C2AD5"""
+"""49C49B1787A94D87_16311BD70C6095D2_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](CC)(=O)=O)CCCBr""",21,"""BEA57204744C2AD5"""
+"""68BC0F195D752ADD_A2EB9AD7A96E165C_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(CCCNC)[S](=O)(=O)C""",21,"""BEA57204744C2AD5"""
+"""29D8E53358C60248_478692B120A70C04_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""BEA57204744C2AD5"""
+"""1913FC29C030AE70_15CDF8AA7C98DFCC_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](=O)(=O)CC#N)C2CC2""",21,"""BEA57204744C2AD5"""
+"""4405EB3A129B0E37_961993DC943E9DDB_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](C)(=O)=O)C(=O)CCN""",21,"""BEA57204744C2AD5"""
+"""2E25C3F02FB98BE2_501FC42C70602928_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""BEA57204744C2AD5"""
+"""FD5AB3BC9FB2D73B_F2B999B5602F3B69_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""BEA57204744C2AD5"""
+"""9941058843BE5119_3FDEC2FCBF611B36_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""BEA57204744C2AD5"""
+"""B0DE7528CEF8E771_CBA36D4B70614B9F_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""BEA57204744C2AD5"""
+"""001178B58985DBD7_C1578A4BEC1A7399_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(CC(CC)N)[S](=O)(=O)C""",21,"""BEA57204744C2AD5"""
+"""94BF75AEEEAB7651_C379DF6AEE11C3B2_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""BEA57204744C2AD5"""
+"""0A2F87FD077808FA_50BBC02634E91856_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](C)(=O)=O)CCN=[N]#N""",21,"""BEA57204744C2AD5"""
+"""3E908933946B1FA5_800AF78032941C72_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""BEA57204744C2AD5"""
+"""6111FBF199F0DCCE_CA059031A55A9BFF_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""BEA57204744C2AD5"""
+"""B1168DEC2D0022A3_26380E53AF703FF0_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""BEA57204744C2AD5"""
+"""2DC0FEC411E96C77_2FD5BA370425124A_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](=O)(=O)C2CC2)CC#C""",21,"""BEA57204744C2AD5"""
+"""143B3E2CA26FDB22_7BD5A0BCE32BD78C_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""BEA57204744C2AD5"""
+"""1588A99451D045FA_53BEEF41C62F9B64_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N2CCCC(C)(C)[S]2(=O)=O""",21,"""BEA57204744C2AD5"""
+"""3C1AEF067AC53372_989714154FE95077_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N2CCCC(CC)[S]2(=O)=O""",21,"""BEA57204744C2AD5"""
+"""04FBB8603E58FBA1_A9FE64CF2A50E6D8_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""BEA57204744C2AD5"""
+"""48B23DB6AED1313B_76E003615058DFF6_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""BEA57204744C2AD5"""
+"""598B3C492A265F89_DDD8CDF884C842DA_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""BEA57204744C2AD5"""
+"""4151DBE016C1202D_9DB47DA881F29B64_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""BEA57204744C2AD5"""
+"""FA40ADDD19262629_35FBE77C7AEF840C_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N2[S](CCN(C)CC2)(=O)=O""",21,"""BEA57204744C2AD5"""
+"""7CD0EC41B4383DC9_B96CC1F112466FEF_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N2CC(=O)NCC[S]2(=O)=O""",21,"""BEA57204744C2AD5"""
+"""D17A7833CB3DF6D1_EC97DCF8BFE3A87B_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N2[S](CCCCC2C)(=O)=O""",21,"""BEA57204744C2AD5"""
+"""5BA37AC0E99A927A_963F993411034785_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(CCN)[S](=O)(=O)C2CC2""",21,"""BEA57204744C2AD5"""
+"""C75682A6DF712B1D_F0C5BFF5B52FD572_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(CCN)[S](=O)(=O)C(F)F""",21,"""BEA57204744C2AD5"""
+"""5C1D47FCCBC7367A_50C023908B242B90_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N([S](CC)(=O)=O)C2CNC2""",21,"""BEA57204744C2AD5"""
+"""F7967C43416EC256_6259F7AC1CCD7FED_6036_DP""","""C(CNC1=C(C=CC=N1)C#N)N3CC2(CNC2)C[S]3(=O)=O""",21,"""BEA57204744C2AD5"""
+"""C29A9BC8E2AAEF5B_D82C8E3EC50E3B87_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""BEA57204744C2AD5"""
+"""285EEE5D529D6505_24C7166ECC6C2B37_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""BEA57204744C2AD5"""
+"""AB130728AB2893E8_1AA671D90152E3AC_6036_UN""","""C(CNC1=C(C=CC=N1)C#N)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""BEA57204744C2AD5"""
+"""683FBC2FFB8E7D24_BEA7B2AE6EFAA44A_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""BF57E3FA9F615D96"""
+"""E84009D397D5815D_11D04A8295EA08B6_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""BF57E3FA9F615D96"""
+"""D906AC41F6ADE333_EDD03D450A01FF9C_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""BF57E3FA9F615D96"""
+"""6B7481CCB858A7BB_B1EAC513992DC998_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""BF57E3FA9F615D96"""
+"""A5D22C9FC411F898_82C2AAD21E433F30_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""BF57E3FA9F615D96"""
+"""F9E0A1439E055A65_49234EA6C634CBC3_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""BF57E3FA9F615D96"""
+"""24E730FFE115CA02_914C6AAA92F0DA4B_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=CC(=C2)COCCOC""",21,"""BF57E3FA9F615D96"""
+"""000253123EEB2E33_1821E7AB9C4CD127_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""BF57E3FA9F615D96"""
+"""04A31520A248339A_073AF348AB063642_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""BF57E3FA9F615D96"""
+"""2FC144BB1DDB7A75_557B0B7C20B3966E_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""BF57E3FA9F615D96"""
+"""0E9D6BCBC408013B_4082ED48BBCE372C_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""BF57E3FA9F615D96"""
+"""6C4F4CF3D0EF2858_393982644CF40B51_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""BF57E3FA9F615D96"""
+"""8BF9D0CFAAEFACC0_201DA6662498E4D1_6005_UN""","""NC(=N)C1=CC=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""BF57E3FA9F615D96"""
+"""BE532C96A680CDCE_5DE9F984A38E55B8_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""BF57E3FA9F615D96"""
+"""C8E5571F5B89BBAF_AA34354632ECF683_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""BF57E3FA9F615D96"""
+"""12189A2DDBCDF2F6_9D130DC2C586F537_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""BF57E3FA9F615D96"""
+"""19525EC8BED44A15_4FDFF346EF89DF84_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""BF57E3FA9F615D96"""
+"""E18F0222D6297E7C_9F0A3DCE1AD3EB97_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""BF57E3FA9F615D96"""
+"""176AAA4B097C3E74_B09F098109F48952_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""BF57E3FA9F615D96"""
+"""1A5455B25E6229BB_B5A4F724D5C45B7B_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""BF57E3FA9F615D96"""
+"""A726CD884950C3C9_705F51D3B544C74F_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""BF57E3FA9F615D96"""
+"""2A0CC811D323B2C5_6073C1826AAA73BB_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""BF57E3FA9F615D96"""
+"""11A08FB6F5EEA550_BD6098BBC40987C1_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""BF57E3FA9F615D96"""
+"""797741FFEE08FA2B_2D137CC15DF40D14_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""BF57E3FA9F615D96"""
+"""E110D80245AA3F48_0832CC72BDFBC3CF_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""BF57E3FA9F615D96"""
+"""C27A3CCC14C57128_6ECF7C33947272AF_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""BF57E3FA9F615D96"""
+"""7F304497E3BB262B_93A21F256A38E2FF_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""BF57E3FA9F615D96"""
+"""3FC49C18E2653FD8_1294C6DBDDC38A2B_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""BF57E3FA9F615D96"""
+"""20113FF42CD348D6_67EBA4E9A7EF2E9C_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""BF57E3FA9F615D96"""
+"""AC1446124E4ACA16_980C636570EED071_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""BF57E3FA9F615D96"""
+"""E91CE8D1DE29018C_6F8B8A905B97FD6F_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""BF57E3FA9F615D96"""
+"""B5E8BD127180931A_1980A48C93FBFA04_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""BF57E3FA9F615D96"""
+"""7102D480B1765DD8_DCB035B60A1F937B_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""BF57E3FA9F615D96"""
+"""F053875B0628D747_B6D40090F529981B_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""BF57E3FA9F615D96"""
+"""52AB45F5D099D893_C7EFB2E5E42216E8_6005_UN""","""NC(=N)C1=CC=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""BF57E3FA9F615D96"""
+"""5166526B4363E4E3_75245E90266B1FAA_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""BF57E3FA9F615D96"""
+"""3680875454706B79_00EACC181CC78F98_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""BF57E3FA9F615D96"""
+"""1ACB83CB607EA5C3_5316944122B52E89_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""BF57E3FA9F615D96"""
+"""0CC15DC60119AA7A_CBC2C4C09E07CD33_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""BF57E3FA9F615D96"""
+"""3601D1EBCE7634BA_C1C5EEC3C77A29CE_6005_UN""","""NC(=N)C1=CC=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""BF57E3FA9F615D96"""
+"""AE052F69105D9F5A_411B5C9C8D70852F_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](CCN)(=O)=O)C3CC3""",21,"""BFD32273538BE837"""
+"""290D9D5784C06417_DA628C1620D38A81_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""BFD32273538BE837"""
+"""B69CD256E8D537F4_8DED60A3CE93A9DD_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""BFD32273538BE837"""
+"""A8518596B739C614_90FB611B803BD015_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](CC)(=O)=O)CCCN""",21,"""BFD32273538BE837"""
+"""FAAC4F7A74542606_1A24C4F676EFE534_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](C)(=O)=O)C3CC(C3)N""",21,"""BFD32273538BE837"""
+"""5CB86EDB665EBA99_5CFECCF146DA67B5_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""BFD32273538BE837"""
+"""491A1FD0EF47C5FC_A91F40B79448F2F4_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C)[S](=O)(=O)C3CNCC3""",21,"""BFD32273538BE837"""
+"""3E3229E25046F505_17474BA02BA75730_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](CC)(=O)=O)CCCBr""",21,"""BFD32273538BE837"""
+"""417058442816BAED_A39DCAA08EA9D4BE_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(CCCNC)[S](=O)(=O)C""",21,"""BFD32273538BE837"""
+"""980CC2B31896705E_46F0C2C60760CEE6_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""BFD32273538BE837"""
+"""E12285C47A92FB7E_14BBA8DD5B5F1D2E_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](=O)(=O)CC#N)C3CC3""",21,"""BFD32273538BE837"""
+"""71FB6B701E52DB48_976FC3ABB3F95F39_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""BFD32273538BE837"""
+"""ABA09FB0EEDAB93A_5169945B57A7EBCA_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""BFD32273538BE837"""
+"""2993B8978061B704_F3CFC9C247E8F98B_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""BFD32273538BE837"""
+"""BDA84D5BBE6BB660_3EA8928B98A6D9D4_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""BFD32273538BE837"""
+"""CECA6FBFB2BC5467_CAD53D3C57A6897D_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""BFD32273538BE837"""
+"""374FDD44B13EE22D_C021DA3CCBDDB17B_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""BFD32273538BE837"""
+"""588C434E9BDAE60A_C20F8F1DC9D60150_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""BFD32273538BE837"""
+"""476E31629A226B8A_51CD9051132EDAB4_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""BFD32273538BE837"""
+"""CDA0290086C9B160_817CA7F71553DE90_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""BFD32273538BE837"""
+"""56EFD9FC40A1A535_CB73C046829D591D_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""BFD32273538BE837"""
+"""D52FC7BA7C84E3CB_274E5E2488B7FD12_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""BFD32273538BE837"""
+"""8813459DE045BF90_2EA3EA4023E2D0A8_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](=O)(=O)C3CC3)CC#C""",21,"""BFD32273538BE837"""
+"""682D837CDCA82C58_7AA3F0CBC4EC156E_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""BFD32273538BE837"""
+"""5B8538BA8F55DDD1_52C8BF36E1E85986_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N3CCCC(C)(C)[S]3(=O)=O""",21,"""BFD32273538BE837"""
+"""1E329FDFAB445121_99E14462682E9295_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N3CCCC(CC)[S]3(=O)=O""",21,"""BFD32273538BE837"""
+"""5EFF40D1AC769485_A88834B80D97243A_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""BFD32273538BE837"""
+"""D2733BDAA4D37D62_77965316779F1D14_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""BFD32273538BE837"""
+"""2D5B467F818EDCC9_DCAE9D8FA30F8038_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""BFD32273538BE837"""
+"""B43B882E22FE1778_9CC22DDFA6355986_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""BFD32273538BE837"""
+"""FC816928EFDF4468_348DB70B5D2846EE_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N3[S](CCN(C)CC3)(=O)=O""",21,"""BFD32273538BE837"""
+"""76DD7EE334C70D0B_B81A91863581AD0D_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N3CC(=O)NCC[S]3(=O)=O""",21,"""BFD32273538BE837"""
+"""4DAC164E7BF6CF4F_EDE18C8F98246A99_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N3[S](CCCCC3C)(=O)=O""",21,"""BFD32273538BE837"""
+"""401532CE4CECB7EC_9749C94336C48567_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(CCN)[S](=O)(=O)C3CC3""",21,"""BFD32273538BE837"""
+"""2A6113B1C9A7F900_F1B3EF8292E81790_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""BFD32273538BE837"""
+"""F969148F319240F9_51B673E7ACE3E972_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N([S](CC)(=O)=O)C3CNC3""",21,"""BFD32273538BE837"""
+"""6FE499036DB118F0_632FA7DB3B0ABD0F_6036_DP""","""C(C1CC1)(C2=CC=C(C=C2)Br)N4CC3(CNC3)C[S]4(=O)=O""",21,"""BFD32273538BE837"""
+"""CDC7F1F0912C1E69_D95ADE49E2C9F965_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""BFD32273538BE837"""
+"""5586CED535218452_25B14619EBABE9D5_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""BFD32273538BE837"""
+"""D578C7FE7382142D_1BD021AE2695214E_6036_UN""","""C(C1CC1)(C2=CC=C(C=C2)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""BFD32273538BE837"""
+"""0F72FA874DC14881_C19AA7805C0CD109_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=CC=C2)OC3CCCC3""",21,"""C06AF6D4AD9728D5"""
+"""C631A5D43D1BED6A_6EED5FACA71C7DF5_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=C(OCC)C=C2)OCC""",21,"""C06AF6D4AD9728D5"""
+"""E97AF39FA9B67C44_92ED286B38F78ADF_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=CC(=C2)OCCC(C)C""",21,"""C06AF6D4AD9728D5"""
+"""77C48279C550FF63_CED7D03DABDBBCDB_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""C06AF6D4AD9728D5"""
+"""9BB6503E90714689_FDFFBFFC2CB54A73_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=C(C=C2)OC3CCOC3""",21,"""C06AF6D4AD9728D5"""
+"""43A4E583A0B80640_361E5B88F4C2BE80_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=C(OC)C=C2)CN(C)C""",21,"""C06AF6D4AD9728D5"""
+"""01C67FB635970A46_EE717F84A006AF08_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=CC(=C2)COCCOC""",21,"""C06AF6D4AD9728D5"""
+"""4E47DA4E498B6D64_671CF285AEBAA464_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=CC(=C2)CN(C)C3CC3""",21,"""C06AF6D4AD9728D5"""
+"""926F3043935D299A_7807E66699F04301_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=CC(=C2)OC(COC)C""",21,"""C06AF6D4AD9728D5"""
+"""FEC55ACCA59B89B9_2A461E521245E32D_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""C06AF6D4AD9728D5"""
+"""FE8B7DEBA1356D09_3FBFF8668938426F_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""C06AF6D4AD9728D5"""
+"""BDB2F737E4FA2A0A_4604974A7E027E12_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=CC=C2)CN3CCCC3""",21,"""C06AF6D4AD9728D5"""
+"""E3852971541045D9_5F20B348166E9192_6005_UN""","""CC(C)C1=N[N](C)C=C1C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""C06AF6D4AD9728D5"""
+"""13FFAD54CD344732_22D4ECAA917820FB_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=CC(=C2)OCCN(C)C""",21,"""C06AF6D4AD9728D5"""
+"""13462A7CE3F486A6_D5092068001A83C0_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""C06AF6D4AD9728D5"""
+"""17572162E2966E3A_E22E18ECF7708074_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""C06AF6D4AD9728D5"""
+"""C4412205DD3F52BD_30E2E668DD7FAAC7_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(C=CC=C2F)OC(F)(F)F""",21,"""C06AF6D4AD9728D5"""
+"""6784D9E6630CE297_E03728E028259ED4_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""C06AF6D4AD9728D5"""
+"""177E37B4AFA7051E_CFA21CAF3B02FC11_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""C06AF6D4AD9728D5"""
+"""43386954B9A30A1D_CA99E20AE7322E38_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""C06AF6D4AD9728D5"""
+"""0866E2476CCC4E45_0F6244FD87B2B20C_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""C06AF6D4AD9728D5"""
+"""3702051698D84024_1F4ED4AC585C06F8_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""C06AF6D4AD9728D5"""
+"""7EF373ECCA13F255_C25D8D95F6FFF282_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""C06AF6D4AD9728D5"""
+"""DE925047CAB885B4_522E69EF6F027857_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""C06AF6D4AD9728D5"""
+"""EA7191D7CDAE92DD_770FD95C8F0DB68C_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""C06AF6D4AD9728D5"""
+"""88827253F54049A3_11F2691DA68407EC_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=C(OCCC(C)C)C=C2""",21,"""C06AF6D4AD9728D5"""
+"""C9C9A8F754D3229A_EC9F0A0B58CE97BC_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=C(C=C2)OC3CCCC3""",21,"""C06AF6D4AD9728D5"""
+"""88C6A89927B01254_6DA9D3F5EF35FF68_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(C=C(OC)C=C2)CN(C)C""",21,"""C06AF6D4AD9728D5"""
+"""A76CA0F91CB15185_18D6B1C795195BDF_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""C06AF6D4AD9728D5"""
+"""0BF85F8ADD6B0AEB_E731764B4218A532_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(C)C=C(C=C2)OCC3CC3""",21,"""C06AF6D4AD9728D5"""
+"""A67CDF2FB2EF732E_10B69FBE6961882C_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""C06AF6D4AD9728D5"""
+"""F0A38C0CD9AEC3C9_66BDB1A2A10D8F47_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(OCC(C)(C)C)N=CC=C2""",21,"""C06AF6D4AD9728D5"""
+"""0825DBA943B86A2A_A38D209838E9E638_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""C06AF6D4AD9728D5"""
+"""9E1117C0E4FAC0F3_C9E915BEC7DFED58_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""C06AF6D4AD9728D5"""
+"""CD9662CA97493D2A_B8D2A7CBD6D463AB_6005_UN""","""CC(C)C1=N[N](C)C=C1C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""C06AF6D4AD9728D5"""
+"""E905A38E99E38B70_0A194BBE149D6AE9_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""C06AF6D4AD9728D5"""
+"""71253B6AECE910CA_7FD7D9362E31FADB_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""C06AF6D4AD9728D5"""
+"""9B6FDE44079BB573_2C2B816F10435BCA_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(C=CC=C2)CN3CCCC3""",21,"""C06AF6D4AD9728D5"""
+"""6DC28D7F831F6D33_B4FFD1EEACF1B870_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=CC(=N[N]2C3CCCCO3)C""",21,"""C06AF6D4AD9728D5"""
+"""2F3FAD0236515A3E_BEF8FBEDF58C5C8D_6005_UN""","""CC(C)C1=N[N](C)C=C1C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""C06AF6D4AD9728D5"""
+"""10E92327EB98447C_3FFA1C8F687999D2_6036_UN""","""NC(CN([S](CCN)(=O)=O)C1CC1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""9865B1C0C9F71EB9_A483CC05C5DA967C_6036_UN""","""NC(CN(C(C)C)[S](=O)(=O)CCN)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""D213353B322DD7EF_F30C20B02B9AB520_6036_UN""","""NC(CN([S](C)(=O)=O)CCN=C=S)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""B71C666DA0CAF122_EE1A21086532CCE8_6036_UN""","""NC(CN([S](CC)(=O)=O)CCCN)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""6F339D2BDE6A9AD2_64C584E593E6F9C9_6036_UN""","""NC(CN([S](C)(=O)=O)C1CC(C1)N)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""BD6243DFBF9B6EC0_221F8CE2A3D37B48_6036_UN""","""NC(CN(CCCN)[S](=O)(=O)CCl)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""E13C5844E507539B_D7FE00A47141EE09_6036_UN""","""NC(CN(C)[S](=O)(=O)C1CNCC1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""DB6A66E1C0710050_69A60BB3CEAE4BCD_6036_UN""","""NC(CN([S](CC)(=O)=O)CCCBr)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""F9502E3E71320EC8_DD7C8AB36BA0C843_6036_UN""","""NC(CN(CCCNC)[S](=O)(=O)C)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""4195347F9C9B4B2C_381182D5E269D21B_6036_UN""","""NC(CN(C(C)(C)C#N)[S](=O)(=O)C)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""DB202C92DF47FE3B_6A5AE8CEBE5601D3_6036_UN""","""NC(CN([S](=O)(=O)CC#N)C1CC1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""677508E6DE4FC54F_E98E83B856F043C4_6036_UN""","""NC(CN([S](C)(=O)=O)C(=O)CCN)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""51FC30B29F996381_2F88D448B2AEF737_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=CC=CS1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""5DB28B34453D916F_8D2E89D1A2E1E576_6036_UN""","""NC(CN(C(C)(C)C)[S](=O)(=O)CCl)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""264F0E0D90243B70_4049D2987DAFC529_6036_UN""","""NC(CN(C(C)(C)C)[S](=O)(=O)CBr)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""2C9D33170F9A3F92_B4347D2FB2AF9580_6036_UN""","""NC(CN(C(C)(C)C#C)[S](=O)(=O)C)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""20E8CA81A81962E9_BEC09A2F2ED4AD86_6036_UN""","""NC(CN(CC(CC)N)[S](=O)(=O)C)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""B387F450BA23F8EF_BCEECF0E2CDF1DAD_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=C[NH]C=N1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""9CDECBBB722CDA5D_2F2CD042F627C649_6036_UN""","""NC(CN([S](C)(=O)=O)CCN=[N]#N)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""B7427A3099E04CA3_FF9DE7E4F05AC26D_6036_UN""","""NC(CN(CC(C)(C)N)[S](=O)(=O)C)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""F9931CA1E1C5A0B7_B5928055679445E0_6036_UN""","""NC(CN1[S](CC(C)(C)C1=O)(=O)=O)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""11784D88B3B3649A_59AF1E376DBEE1EF_6036_UN""","""NC(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)C3=C(C=CC=C3F)F""",21,"""C1326260B682F4CA"""
+"""4D8E4F2136503B86_5042AA53C6EBCC55_6036_UN""","""NC(CN([S](=O)(=O)C1CC1)CC#C)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""473EBFAD304705F2_0442B0D821E50993_6036_UN""","""NC(CN1[S](=O)(=O)C2(CCC1)CC2)C3=C(C=CC=C3F)F""",21,"""C1326260B682F4CA"""
+"""2A17CB3D3C3ED7C7_2C29FF2504E1457B_6036_UN""","""NC(CN1CCCC(C)(C)[S]1(=O)=O)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""091524F67382B99D_E70004718D278E68_6036_UN""","""NC(CN1CCCC(CC)[S]1(=O)=O)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""F1BF4C1272C8DD9C_D66974ABE89E38C7_6036_UN""","""NC(CN1C(C(N)CC[S]1(=O)=O)=O)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""33205547083C19DC_09771305929601E9_6036_UN""","""NC(CN([S](C)(=O)=O)[C@@H]1CNCC1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""671161AA4701E3F3_A24FDD9C46069CC5_6036_UN""","""NC(CN1CCCC(Cl)(Cl)[S]1(=O)=O)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""D3A5B09A06206EE9_E2236DCC433C457B_6036_UN""","""NC(CN([S](C)(=O)=O)[C@H]1CNCC1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""8BD4666BED43526C_4A6CF718B8215A13_6036_UN""","""NC(CN1[S](CCN(C)CC1)(=O)=O)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""E6C2A7766BDB3023_C6FBD195D088B1F0_6036_UN""","""NC(CN1CC(=O)NCC[S]1(=O)=O)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""E7A1709FDFDE4409_9300CC9C7D2D7664_6036_UN""","""NC(CN1[S](CCCCC1C)(=O)=O)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""FFC9DC050402D804_E9A88950D3CD999A_6036_UN""","""NC(CN(CCN)[S](=O)(=O)C1CC1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""755BE82551C6DA90_8F52AF9177E10B6D_6036_UN""","""NC(CN(CCN)[S](=O)(=O)C(F)F)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""BB1CB37CFCA59E19_2F5733F449EAF58F_6036_UN""","""NC(CN([S](CC)(=O)=O)C1CNC1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""D5740D5CD8EF8271_1DCEE7C8DE03A1F2_6036_DP""","""NC(CN2CC1(CNC1)C[S]2(=O)=O)C3=C(C=CC=C3F)F""",21,"""C1326260B682F4CA"""
+"""B293DEF4E2DF140A_A7BB9E5A07C0E598_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=N[NH]C=N1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""C180985A36147A94_5B50060A0EA2F528_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=C[NH]N=C1)C2=C(C=CC=C2F)F""",21,"""C1326260B682F4CA"""
+"""A0D949C3379BD018_653161BDC39C3DB3_6036_UN""","""NC(CN(C(C)(C)CN)[S](=O)(=O)C)C1=C(C=CC=C1F)F""",21,"""C1326260B682F4CA"""
+"""89FAD53D452615B8_C3C92E610F547303_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=CC=C2)OC3CCCC3""",21,"""C2397F35FECF8ADF"""
+"""103D98730DBC20FD_6CBED64DF444DFFF_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=C(OCC)C=C2)OCC""",21,"""C2397F35FECF8ADF"""
+"""73B55274DE12E4DA_90BEA18A6BAF28D5_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=CC(=C2)OCCC(C)C""",21,"""C2397F35FECF8ADF"""
+"""948A062E1597568C_CC8459DCF8831ED1_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""C2397F35FECF8ADF"""
+"""E1C0E37109E53835_FFAC361D7FEDE879_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=C(C=C2)OC3CCOC3""",21,"""C2397F35FECF8ADF"""
+"""11EA03DDD7E6D2A9_344DD269A79A1C8A_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""C2397F35FECF8ADF"""
+"""7C325B30F475D5CD_EC22F665F35E0D02_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=CC(=C2)COCCOC""",21,"""C2397F35FECF8ADF"""
+"""5B64625B0A5C2FA3_654F7B64FDE2066E_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""C2397F35FECF8ADF"""
+"""86B00B9CFF07893C_7A546F87CAA8E10B_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=CC(=C2)OC(COC)C""",21,"""C2397F35FECF8ADF"""
+"""5C10D65DCE9C65BB_281597B3411D4127_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""C2397F35FECF8ADF"""
+"""C20F4947BFE1506B_3DEC7187DA60E065_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""C2397F35FECF8ADF"""
+"""0392AA18474B9D6E_44571EAB2D5ADC18_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=CC=C2)CN3CCCC3""",21,"""C2397F35FECF8ADF"""
+"""E1F1E00F4239E68B_5D733AA945363398_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""C2397F35FECF8ADF"""
+"""D2FFA16FD45C429C_2087654BC22082F1_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=CC(=C2)OCCN(C)C""",21,"""C2397F35FECF8ADF"""
+"""BF9EA586568723CA_D75AA989534221CA_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""C2397F35FECF8ADF"""
+"""575D6EBBEB257664_E07D910DA428227E_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""C2397F35FECF8ADF"""
+"""4568256534A277EC_32B16F898E2708CD_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""C2397F35FECF8ADF"""
+"""996F284BDA28CDDB_E264A1017B7D3CDE_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""C2397F35FECF8ADF"""
+"""8A1D5852BACDBB7D_CDF1954E685A5E1B_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""C2397F35FECF8ADF"""
+"""A436B44907FB7334_C8CA6BEBB46A8C32_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""C2397F35FECF8ADF"""
+"""2122DAE2FDA5C0FE_0D31CD1CD4EA1006_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""C2397F35FECF8ADF"""
+"""1541CB27F51D9B7B_1D1D5D4D0B04A4F2_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""C2397F35FECF8ADF"""
+"""9AE2C7047DF41EFC_C00E0474A5A75088_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""C2397F35FECF8ADF"""
+"""9BB2654EEBE981EB_507DE00E3C5ADA5D_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""C2397F35FECF8ADF"""
+"""DA1E6BA63B35323A_755C50BDDC551486_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""C2397F35FECF8ADF"""
+"""CB6FEE6CF8607DDA_13A1E0FCF5DCA5E6_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=C(OCCC(C)C)C=C2""",21,"""C2397F35FECF8ADF"""
+"""C8CE95AC65756DAF_EECC83EA0B9635B6_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=C(C=C2)OC3CCCC3""",21,"""C2397F35FECF8ADF"""
+"""0385E21419390AC0_6FFA5A14BC6D5D62_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""C2397F35FECF8ADF"""
+"""19271F454B7BCD98_1A853826C641F9D5_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""C2397F35FECF8ADF"""
+"""AE07543A59707072_E562FFAA11400738_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""C2397F35FECF8ADF"""
+"""8DD171F3B905995B_12E5165F3A392A26_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""C2397F35FECF8ADF"""
+"""562BA6549D558CCB_64EE3843F2552D4D_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""C2397F35FECF8ADF"""
+"""6E04E113A959B9B6_A1DEA9796BB14432_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""C2397F35FECF8ADF"""
+"""FA823938229B8CB8_CBBA9C5F94874F52_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""C2397F35FECF8ADF"""
+"""4BE7E4E1E05150D3_BA812E2A858CC1A1_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""C2397F35FECF8ADF"""
+"""388CB9201B3F6011_084AC25F47C5C8E3_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""C2397F35FECF8ADF"""
+"""48FE773228D53938_7D8450D77D6958D1_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""C2397F35FECF8ADF"""
+"""BC58BDCAFAC9406B_2E78088E431BF9C0_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(C=CC=C2)CN3CCCC3""",21,"""C2397F35FECF8ADF"""
+"""8914EDF89DEE1657_B6AC580FFFA91A7A_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""C2397F35FECF8ADF"""
+"""CFFEEC18AFCCBEC8_BCAB720CA6D4FE87_6005_UN""","""CC1=CC(=C(C(=C1)F)N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""C2397F35FECF8ADF"""
+"""C51578016A79868C_3AF07CF648039247_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](CCN)(=O)=O)C2CC2""",21,"""C438021996F8FF5F"""
+"""F6E3935173F2EB1D_A189AC7CE5A09DE9_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""C438021996F8FF5F"""
+"""32AF251489E53E37_F60640C90BE0BEB5_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""C438021996F8FF5F"""
+"""EC1838EF5312C88B_EB1041714548C77D_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](CC)(=O)=O)CCCN""",21,"""C438021996F8FF5F"""
+"""F8A2DC4816B8DC60_61CFE49CB39CF25C_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](C)(=O)=O)C2CC(C2)N""",21,"""C438021996F8FF5F"""
+"""EF7BEB887BF4BD97_2715EC9B83A970DD_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""C438021996F8FF5F"""
+"""6FD323832191A6A3_D2F460DD513BE59C_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2CNCC2""",21,"""C438021996F8FF5F"""
+"""09C918E22172A9B6_6CAC6BCAEED44058_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](CC)(=O)=O)CCCBr""",21,"""C438021996F8FF5F"""
+"""797094DE0A1EDFCE_D876EACA4BDAC3D6_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(CCCNC)[S](=O)(=O)C""",21,"""C438021996F8FF5F"""
+"""551FDFE389CDD7AA_3D1BE2ACC213D98E_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""C438021996F8FF5F"""
+"""AC78A0BFA611F085_6F5088B79E2C0A46_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](=O)(=O)CC#N)C2CC2""",21,"""C438021996F8FF5F"""
+"""6A7FEDC7DF7D0EA6_EC84E3C1768A4851_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""C438021996F8FF5F"""
+"""56F05C4DF4D38233_2A82B43192D4FCA2_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""C438021996F8FF5F"""
+"""E403179E83DE349A_8824E9A8829BEEE3_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""C438021996F8FF5F"""
+"""DC17A9B7E9DFD2F5_4543B2E15DD5CEBC_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""C438021996F8FF5F"""
+"""6D8EAE1FD89ECB38_B13E1D5692D59E15_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""C438021996F8FF5F"""
+"""C511F20F7A1C6997_BBCAFA560EAEA613_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""C438021996F8FF5F"""
+"""9B76190E7E59AA9C_B9E4AF770CA51638_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""C438021996F8FF5F"""
+"""F601381827E56ECF_2A26B03BD65DCDDC_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""C438021996F8FF5F"""
+"""43C756CFC0D8977E_FA97879DD020C9F8_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""C438021996F8FF5F"""
+"""D6A1F5A0B25C59FF_B098E02C47EE4E75_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""C438021996F8FF5F"""
+"""EA8AEE22CD77202A_5CA57E4E4DC4EA7A_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""C438021996F8FF5F"""
+"""C071F7156FDD52EB_5548CA2AE691C7C0_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](=O)(=O)C2CC2)CC#C""",21,"""C438021996F8FF5F"""
+"""97C0F7C57D15D244_0148D0A1019F0206_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""C438021996F8FF5F"""
+"""A175E340A791C06B_29239F5C249B4EEE_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N2CCCC(C)(C)[S]2(=O)=O""",21,"""C438021996F8FF5F"""
+"""32725CE575D780C9_E20A6408AD5D85FD_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N2CCCC(CC)[S]2(=O)=O""",21,"""C438021996F8FF5F"""
+"""10BE0C5AA020AD38_D36314D2C8E43352_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""C438021996F8FF5F"""
+"""B8803BD7FB70C154_0C7D737CB2EC0A7C_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""C438021996F8FF5F"""
+"""BFC4B5FE2E95F4B5_A745BDE5667C9750_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""C438021996F8FF5F"""
+"""79CF1FB62E19E660_E7290DB563464EEE_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""C438021996F8FF5F"""
+"""0B39BFF4736E0CCD_4F669761985B5186_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N2[S](CCN(C)CC2)(=O)=O""",21,"""C438021996F8FF5F"""
+"""36BB84DF9FAFC55B_C3F1B1ECF0F2BA65_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N2CC(=O)NCC[S]2(=O)=O""",21,"""C438021996F8FF5F"""
+"""4489E4A447564818_960AACE55D577DF1_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N2[S](CCCCC2C)(=O)=O""",21,"""C438021996F8FF5F"""
+"""CE67236A9A3849EB_ECA2E929F3B7920F_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(CCN)[S](=O)(=O)C2CC2""",21,"""C438021996F8FF5F"""
+"""CAA4956F6B207385_8A58CFE8579B00F8_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""C438021996F8FF5F"""
+"""06BCF12DC1D156DB_2A5D538D6990FE1A_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N([S](CC)(=O)=O)C2CNC2""",21,"""C438021996F8FF5F"""
+"""6829E3DA71D7F126_18C487B1FE79AA67_6036_DP""","""C(CCOC1=C(C=CC=C1)Br)N3CC2(CNC2)C[S]3(=O)=O""",21,"""C438021996F8FF5F"""
+"""BC24A9B3883B6AE2_A2B1FE2327BAEE0D_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""C438021996F8FF5F"""
+"""66123CB981E39D88_5E5A66732ED8FEBD_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""C438021996F8FF5F"""
+"""118843FB84D5D45A_603B01C4E3E63626_6036_UN""","""C(CCOC1=C(C=CC=C1)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""C438021996F8FF5F"""
+"""2A5E74EE7955D97B_3B08D5A16DAE90C1_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](CCN)(=O)=O)C3CC3""",21,"""C5C0AB4EB355FDD9"""
+"""576A9180093E2E31_A071052BC00D9F6F_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""C5C0AB4EB355FDD9"""
+"""D215C6931BCE1835_F7FEE99E2E4DBC33_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""C5C0AB4EB355FDD9"""
+"""646AC9E72D47E951_EAE8E82660E5C5FB_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](CC)(=O)=O)CCCN""",21,"""C5C0AB4EB355FDD9"""
+"""4C1A44D3C7D28B61_60374DCB9631F0DA_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](C)(=O)=O)C3CC(C3)N""",21,"""C5C0AB4EB355FDD9"""
+"""5EE1C82F12B09A7E_26ED45CCA604725B_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""C5C0AB4EB355FDD9"""
+"""8F48FAC183623ACA_D30CC98A7496E71A_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C)[S](=O)(=O)C3CNCC3""",21,"""C5C0AB4EB355FDD9"""
+"""0D5C156D50D6729C_6D54C29DCB7942DE_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](CC)(=O)=O)CCCBr""",21,"""C5C0AB4EB355FDD9"""
+"""5468C775EBF42156_D98E439D6E77C150_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(CCCNC)[S](=O)(=O)C""",21,"""C5C0AB4EB355FDD9"""
+"""4B1D9876F8ED162E_3CE34BFBE7BEDB08_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""C5C0AB4EB355FDD9"""
+"""A3320C2F74DEC30F_6EA821E0BB8108C0_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](=O)(=O)CC#N)C3CC3""",21,"""C5C0AB4EB355FDD9"""
+"""8CF142C2D04673AD_ED7C4A9653274AD7_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""C5C0AB4EB355FDD9"""
+"""52FEC0627DE163FD_2B7A1D66B779FE24_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""C5C0AB4EB355FDD9"""
+"""478B7B5D8643F0CF_89DC40FFA736EC65_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""C5C0AB4EB355FDD9"""
+"""34B04B07F328BBAE_44BB1BB67878CC3A_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""C5C0AB4EB355FDD9"""
+"""ECD951BAB95A1954_B0C6B401B7789C93_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""C5C0AB4EB355FDD9"""
+"""45B9572F6D14F772_BA3253012B03A495_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""C5C0AB4EB355FDD9"""
+"""2312A4EE2D6B30F6_B81C0620290814BE_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""C5C0AB4EB355FDD9"""
+"""149E9C4869368C1E_2BDE196CF3F0CF5A_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""C5C0AB4EB355FDD9"""
+"""4CF657E276A2DAD9_FB6F2ECAF58DCB7E_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""C5C0AB4EB355FDD9"""
+"""5EFB432C054E2C85_B160497B62434CF3_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""C5C0AB4EB355FDD9"""
+"""C7A58EFDCFFD6B41_5D5DD7196869E8FC_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""C5C0AB4EB355FDD9"""
+"""F9ADEA412624F557_54B0637DC33CC546_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](=O)(=O)C3CC3)CC#C""",21,"""C5C0AB4EB355FDD9"""
+"""759EB8846FE767B9_00B079F624320080_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""C5C0AB4EB355FDD9"""
+"""832B822B6A5FA967_28DB360B01364C68_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N3CCCC(C)(C)[S]3(=O)=O""",21,"""C5C0AB4EB355FDD9"""
+"""0B61A59197F712CC_E3F2CD5F88F0877B_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N3CCCC(CC)[S]3(=O)=O""",21,"""C5C0AB4EB355FDD9"""
+"""025192C21CA2BB7F_D29BBD85ED4931D4_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""C5C0AB4EB355FDD9"""
+"""EF1A7433D51F0833_0D85DA2B974108FA_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""C5C0AB4EB355FDD9"""
+"""895A9844726CDF94_A6BD14B243D195D6_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""C5C0AB4EB355FDD9"""
+"""A821DE90F1CCF272_E6D1A4E246EB4C68_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""C5C0AB4EB355FDD9"""
+"""23828E02D70530B5_4E9E3E36BDF65300_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N3[S](CCN(C)CC3)(=O)=O""",21,"""C5C0AB4EB355FDD9"""
+"""43B08D732E73BE36_C20918BBD55FB8E3_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N3CC(=O)NCC[S]3(=O)=O""",21,"""C5C0AB4EB355FDD9"""
+"""2859843D3E1F3A87_97F205B278FA7F77_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N3[S](CCCCC3C)(=O)=O""",21,"""C5C0AB4EB355FDD9"""
+"""76EAC8440D843E22_ED5A407ED61A9089_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(CCN)[S](=O)(=O)C3CC3""",21,"""C5C0AB4EB355FDD9"""
+"""2BB1C82A89309CC0_8BA066BF7236027E_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""C5C0AB4EB355FDD9"""
+"""FE9DEED095F22A37_2BA5FADA4C3DFC9C_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N([S](CC)(=O)=O)C3CNC3""",21,"""C5C0AB4EB355FDD9"""
+"""A298926B6C0BCE12_193C2EE6DBD4A8E1_6036_DP""","""C(C2=C(C=C1OCOC1=C2)Br)N4CC3(CNC3)C[S]4(=O)=O""",21,"""C5C0AB4EB355FDD9"""
+"""9AAEBFB4E83A45D5_A34957740217EC8B_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""C5C0AB4EB355FDD9"""
+"""FACB31B9FCFBD985_5FA2CF240B75FC3B_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""C5C0AB4EB355FDD9"""
+"""EAC8407F1D900DF0_61C3A893C64B34A0_6036_UN""","""C(C2=C(C=C1OCOC1=C2)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""C5C0AB4EB355FDD9"""
+"""5038BCCEB55D7362_C791EDDE3D194185_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=CC=C3)OC4CCCC4""",21,"""C661BC8ACC82B859"""
+"""F0057DE210BBB26D_68E615F2C609ED79_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=C(OCC)C=C3)OCC""",21,"""C661BC8ACC82B859"""
+"""4AE22F968416F7EB_94E6623559E21A53_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=CC(=C3)OCCC(C)C""",21,"""C661BC8ACC82B859"""
+"""D743F8376EC536A0_C8DC9A63CACE2C57_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""C661BC8ACC82B859"""
+"""64C1A43CE128D1A6_FBF4F5A24DA0DAFF_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=C(C=C3)OC4CCOC4""",21,"""C661BC8ACC82B859"""
+"""1EEDE2CFECFBB90C_301511D695D72E0C_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""C661BC8ACC82B859"""
+"""ADE951EBF9C3A93C_E87A35DAC1133F84_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=CC(=C3)COCCOC""",21,"""C661BC8ACC82B859"""
+"""DD5FDE04BAFAB233_6117B8DBCFAF34E8_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""C661BC8ACC82B859"""
+"""60427AD07011E084_7E0CAC38F8E5D38D_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=CC(=C3)OC(COC)C""",21,"""C661BC8ACC82B859"""
+"""261DF1E3F1B1AC67_2C4D540C735073A1_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""C661BC8ACC82B859"""
+"""3335E92202A69FA1_39B4B238E82DD2E3_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""C661BC8ACC82B859"""
+"""A86BF815526E5A81_400FDD141F17EE9E_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=CC=C3)CN4CCCC4""",21,"""C661BC8ACC82B859"""
+"""A588158D8970BC12_592BF916777B011E_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""C661BC8ACC82B859"""
+"""776488ED875086B5_24DFA6F4F06DB077_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=CC(=C3)OCCN(C)C""",21,"""C661BC8ACC82B859"""
+"""EE408DA2B17C6A01_D3026A36610F134C_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""C661BC8ACC82B859"""
+"""C4E9F64B6A154E09_E42552B2966510F8_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""C661BC8ACC82B859"""
+"""54F6CF40D14E2142_36E9AC36BC6A3A4B_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""C661BC8ACC82B859"""
+"""6E24A64E0B01EDB3_E63C62BE49300E58_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""C661BC8ACC82B859"""
+"""18B04F8755CA2215_C9A956F15A176C9D_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""C661BC8ACC82B859"""
+"""6AA71B70C62432B1_CC92A8548627BEB4_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""C661BC8ACC82B859"""
+"""E779D17CB2E119D5_09690EA3E6A72280_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""C661BC8ACC82B859"""
+"""001800BD6B9C68DF_19459EF239499674_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""C661BC8ACC82B859"""
+"""38909B1B1446A3C3_C456C7CB97EA620E_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""C661BC8ACC82B859"""
+"""F89ED3ECDD5270BE_542523B10E17E8DB_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""C661BC8ACC82B859"""
+"""FCD5612638AAF06A_71049302EE182600_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""C661BC8ACC82B859"""
+"""831054271D9F5FB2_17F92343C7919760_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=C(OCCC(C)C)C=C3""",21,"""C661BC8ACC82B859"""
+"""8F6B5336227611B5_EA94405539DB0730_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=C(C=C3)OC4CCCC4""",21,"""C661BC8ACC82B859"""
+"""3CF5B991F2DF58EB_6BA299AB8E206FE4_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""C661BC8ACC82B859"""
+"""72D0E9BB32DE6AF9_1EDDFB99F40CCB53_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""C661BC8ACC82B859"""
+"""0231054B41CE6A3A_E13A3C15230D35BE_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""C661BC8ACC82B859"""
+"""066F1405D7E225B7_16BDD5E0087418A0_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""C661BC8ACC82B859"""
+"""1B65FD991B18FA44_60B6FBFCC0181FCB_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""C661BC8ACC82B859"""
+"""73C3C1B9AFC440C6_A5866AC659FC76B4_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""C661BC8ACC82B859"""
+"""DE394DD57B010E58_CFE25FE0A6CA7DD4_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""C661BC8ACC82B859"""
+"""2EE2C6290D46A7E0_BED9ED95B7C1F327_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""C661BC8ACC82B859"""
+"""7974037001925E93_0C1201E07588FA65_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""C661BC8ACC82B859"""
+"""51AC3DC33290A15D_79DC93684F246A57_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""C661BC8ACC82B859"""
+"""E30F8E17A4CDFC36_2A20CB317156CB46_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(C=CC=C3)CN4CCCC4""",21,"""C661BC8ACC82B859"""
+"""C2E8375BEBC0338C_B2F49BB0CDE428FC_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""C661BC8ACC82B859"""
+"""42A4BEC081EA74D0_B8F3B1B39499CC01_6005_UN""","""C2(=C1[N](CCNC1)N=C2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""C661BC8ACC82B859"""
+"""B882FF385A602393_C8B6AF96F5C8BB59_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC(=CC=C3)OC4CCCC4""",21,"""C946FEC204534285"""
+"""45CE2075C5FA1746_67C157BA0ED817A5_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC(=C(OCC)C=C3)OCC""",21,"""C946FEC204534285"""
+"""6EF96E9CAE8D7719_9BC1207D9133E08F_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC=CC(=C3)OCCC(C)C""",21,"""C946FEC204534285"""
+"""5DF1CACA8B7F2AE3_C7FBD82B021FD68B_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""C946FEC204534285"""
+"""C69651B2CE86A8FE_F4D3B7EA85712023_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC=C(C=C3)OC4CCOC4""",21,"""C946FEC204534285"""
+"""D068D610BBA7AB2C_3F32539E5D06D4D0_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""C946FEC204534285"""
+"""EA5864F471A5C406_E75D779209C2C558_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC=CC(=C3)COCCOC""",21,"""C946FEC204534285"""
+"""ED324F29F6A032FD_6E30FA93077ECE34_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""C946FEC204534285"""
+"""4294D075B40F503A_712BEE7030342951_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC=CC(=C3)OC(COC)C""",21,"""C946FEC204534285"""
+"""A5BEB955FE662093_236A1644BB81897D_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""C946FEC204534285"""
+"""B761C11439F3D187_3693F07020FC283F_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""C946FEC204534285"""
+"""F729C7207DCADBA1_4F289F5CD7C61442_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC(=CC=C3)CN4CCCC4""",21,"""C946FEC204534285"""
+"""DF79A5DF585BA85A_560CBB5EBFAAFBC2_6005_DP""","""N1CCC[N]2C(=CN=C12)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""C946FEC204534285"""
+"""6DBAB3B456F8AAEC_2BF8E4BC38BC4AAB_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC=CC(=C3)OCCN(C)C""",21,"""C946FEC204534285"""
+"""18E42309CF58BC77_DC25287EA9DEE990_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""C946FEC204534285"""
+"""D41BDECAE4F18C63_EB0210FA5EB4EA24_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""C946FEC204534285"""
+"""471B5D83440EF6E9_39CEEE7E74BBC097_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""C946FEC204534285"""
+"""0EF27324A062DC88_E91B20F681E1F484_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""C946FEC204534285"""
+"""A451AA764B06E4EE_C68E14B992C69641_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""C946FEC204534285"""
+"""A0E6FFD97F30C54B_C3B5EA1C4EF64468_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""C946FEC204534285"""
+"""3BD8D997B0E29E49_064E4CEB2E76D85C_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""C946FEC204534285"""
+"""473890BEA868CDAA_1662DCBAF1986CA8_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""C946FEC204534285"""
+"""C89F60F4D46275FB_CB7185835F3B98D2_6005_DP""","""N1CCC[N]2C(=CN=C12)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""C946FEC204534285"""
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+"""4CB055AD951680C4_4CBF0A2EF28DC134_6005_UN""","""C2(=CC1=C(N=CC=C1)[NH]2)C3=CC(=CC=C3)CN4CCCC4""",21,"""CAD16BB0211897F3"""
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+"""E24A4CDC867FBA02_3A597B0C51F015E1_6005_UN""","""C2(=CC1=C(N=CC=C1)[NH]2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""CAD16BB0211897F3"""
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+"""C2BCE3CCBC2170D0_05D9D9990B3D0D2A_6005_UN""","""C2(=CC1=C(N=CC=C1)[NH]2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""CAD16BB0211897F3"""
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+"""F429DBCC860E3FF7_ED8AEB2FCE971A14_6005_UN""","""C2(=CC1=C(N=CC=C1)[NH]2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""CAD16BB0211897F3"""
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+"""516B8B57816AEF9B_00A2D6DA9812D5CF_6005_UN""","""C2(=CC1=C(N=CC=C1)[NH]2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""CAD16BB0211897F3"""
+"""806FA1F3170F83E6_756C4452A2BE45FD_6005_UN""","""C2(=CC1=C(N=CC=C1)[NH]2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""CAD16BB0211897F3"""
+"""EC336A04C5262554_26901C0B9CCCE4EC_6005_UN""","""C2(=CC1=C(N=CC=C1)[NH]2)C3=C(C=CC=C3)CN4CCCC4""",21,"""CAD16BB0211897F3"""
+"""F6C1D5158219405A_BE444C8A207E0756_6005_UN""","""C2(=CC1=C(N=CC=C1)[NH]2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""CAD16BB0211897F3"""
+"""5A8CC36E2EC93DB5_B44366897903E3AB_6005_UN""","""C2(=CC1=C(N=CC=C1)[NH]2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""CAD16BB0211897F3"""
+"""EA7A78C1A58C0066_35CE5DCF5BBD3DE0_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](CCN)(=O)=O)C2CC2""",21,"""CB062320854650F8"""
+"""52FD848297010DE9_AEB78D45F61E324E_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C(C)C)[S](=O)(=O)CCN""",21,"""CB062320854650F8"""
+"""45F5E93FD88DE08D_F93861F0185E1112_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)CCN=C=S""",21,"""CB062320854650F8"""
+"""50B3D4C27A750D92_E42E604856F668DA_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](CC)(=O)=O)CCCN""",21,"""CB062320854650F8"""
+"""EC76BFF08679EB66_6EF1C5A5A0225DFB_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)C2CC(C2)N""",21,"""CB062320854650F8"""
+"""37CBA3BE1E346361_282BCDA29017DF7A_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(CCCN)[S](=O)(=O)CCl""",21,"""CB062320854650F8"""
+"""4B034868358B4236_DDCA41E442854A3B_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)C2CNCC2""",21,"""CB062320854650F8"""
+"""7D1D3FF4C74A0BB9_63924AF3FD6AEFFF_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](CC)(=O)=O)CCCBr""",21,"""CB062320854650F8"""
+"""C1B41A6A91EE121C_D748CBF358646C71_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(CCCNC)[S](=O)(=O)C""",21,"""CB062320854650F8"""
+"""2086697E9DB25D8B_3225C395D1AD7629_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""CB062320854650F8"""
+"""912F4C9AFABC57DD_606EA98E8D92A5E1_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](=O)(=O)CC#N)C2CC2""",21,"""CB062320854650F8"""
+"""1A753AE1AA5AC7D6_E3BAC2F86534E7F6_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)C(=O)CCN""",21,"""CB062320854650F8"""
+"""C96AA28B2F9CE601_25BC9508816A5305_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""CB062320854650F8"""
+"""0B9C8D8B69EEB89C_871AC89191254144_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""CB062320854650F8"""
+"""FC183F9FBB34E741_4A7D93D84E6B611B_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""CB062320854650F8"""
+"""FB13F8695EBD6441_BE003C6F816B31B2_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""CB062320854650F8"""
+"""2AFCC7D2E42B1C23_B4F4DB6F1D1009B4_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(CC(CC)N)[S](=O)(=O)C""",21,"""CB062320854650F8"""
+"""D1DF2E26AF4054E0_B6DA8E4E1F1BB99F_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""CB062320854650F8"""
+"""AFF0981378F8F30D_25189102C5E3627B_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)CCN=[N]#N""",21,"""CB062320854650F8"""
+"""5190E1953487F6FB_F5A9A6A4C39E665F_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""CB062320854650F8"""
+"""AECB357FEED8ACCF_BFA6C1155450E1D2_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""CB062320854650F8"""
+"""54326EF50E9CD7C1_539B5F775E7A45DD_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""CB062320854650F8"""
+"""19CCD04C8151BD90_5A76EB13F52F6867_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](=O)(=O)C2CC2)CC#C""",21,"""CB062320854650F8"""
+"""0CB8EAC13FDB92A6_0E76F1981221ADA1_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""CB062320854650F8"""
+"""542A462CC7A6182F_261DBE653725E149_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N2CCCC(C)(C)[S]2(=O)=O""",21,"""CB062320854650F8"""
+"""7211E9ACF6491E99_ED344531BEE32A5A_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N2CCCC(CC)[S]2(=O)=O""",21,"""CB062320854650F8"""
+"""E6AD7B049C66C143_DC5D35EBDB5A9CF5_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""CB062320854650F8"""
+"""CBC670DC23694FB1_03435245A152A5DB_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""CB062320854650F8"""
+"""362FAE74FF8C6071_A87B9CDC75C238F7_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""CB062320854650F8"""
+"""AD0F800AE97524AF_E8172C8C70F8E149_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""CB062320854650F8"""
+"""DD9FB0D1E9C0E074_4058B6588BE5FE21_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N2[S](CCN(C)CC2)(=O)=O""",21,"""CB062320854650F8"""
+"""76E81BD58A7398C4_CCCF90D5E34C15C2_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N2CC(=O)NCC[S]2(=O)=O""",21,"""CB062320854650F8"""
+"""0C9C4BB9CDA149B6_99348DDC4EE9D256_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N2[S](CCCCC2C)(=O)=O""",21,"""CB062320854650F8"""
+"""0C3FB7479A7C42C2_E39CC810E0093DA8_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(CCN)[S](=O)(=O)C2CC2""",21,"""CB062320854650F8"""
+"""211A84E6F281D0CA_8566EED14425AF5F_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(CCN)[S](=O)(=O)C(F)F""",21,"""CB062320854650F8"""
+"""BF0B3894151EB264_256372B47A2E51BD_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N([S](CC)(=O)=O)C2CNC2""",21,"""CB062320854650F8"""
+"""B7F16171F91FCC9B_17FAA688EDC705C0_6036_DP""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N3CC2(CNC2)C[S]3(=O)=O""",21,"""CB062320854650F8"""
+"""481FAFA70CF90E5E_AD8FDF1A340441AA_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""CB062320854650F8"""
+"""F2069FA407101DC8_5164474A3D66511A_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""CB062320854650F8"""
+"""6CBCEBCC40427017_6F0520FDF0589981_6036_UN""","""NCC(C1=CC(=CC(=C1)Cl)Cl)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""CB062320854650F8"""
+"""711D60FF4506B4D3_33718CBF9A743D6D_6036_UN""","""CN(C)CCNCCOCCN([S](CCN)(=O)=O)C1CC1""",21,"""CDB9F250448F5075"""
+"""0EF4074AA2418295_A8085C3537D732C3_6036_UN""","""CN(C)CCNCCOCCN(C(C)C)[S](=O)(=O)CCN""",21,"""CDB9F250448F5075"""
+"""14D8562CF84BCA19_FF87B080D997119F_6036_UN""","""CN(C)CCNCCOCCN([S](C)(=O)=O)CCN=C=S""",21,"""CDB9F250448F5075"""
+"""2158EE0009678329_E291B138973F6857_6036_UN""","""CN(C)CCNCCOCCN([S](CC)(=O)=O)CCCN""",21,"""CDB9F250448F5075"""
+"""E5078A20D27408A9_684E14D561EB5D76_6036_UN""","""CN(C)CCNCCOCCN([S](C)(=O)=O)C1CC(C1)N""",21,"""CDB9F250448F5075"""
+"""9D64562033C1F9E4_2E941CD251DEDFF7_6036_UN""","""CN(C)CCNCCOCCN(CCCN)[S](=O)(=O)CCl""",21,"""CDB9F250448F5075"""
+"""1534491D1D5658CA_DB759094834C4AB6_6036_UN""","""CN(C)CCNCCOCCN(C)[S](=O)(=O)C1CNCC1""",21,"""CDB9F250448F5075"""
+"""159D74BE4A63951B_652D9B833CA3EF72_6036_UN""","""CN(C)CCNCCOCCN([S](CC)(=O)=O)CCCBr""",21,"""CDB9F250448F5075"""
+"""76DB837048B2F01F_D1F71A8399AD6CFC_6036_UN""","""CN(C)CCNCCOCCN(CCCNC)[S](=O)(=O)C""",21,"""CDB9F250448F5075"""
+"""A7ECF83137966BF4_349A12E5106476A4_6036_UN""","""CN(C)CCNCCOCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""CDB9F250448F5075"""
+"""E85429DDA1890CEC_66D178FE4C5BA56C_6036_UN""","""CN(C)CCNCCOCCN([S](=O)(=O)CC#N)C1CC1""",21,"""CDB9F250448F5075"""
+"""65522B1EB433DC0C_E5051388A4FDE77B_6036_UN""","""CN(C)CCNCCOCCN([S](C)(=O)=O)C(=O)CCN""",21,"""CDB9F250448F5075"""
+"""31A75477B4849956_2303447840A35388_6036_UN""","""CN(C)CCNCCOCCN(C)[S](=O)(=O)C1=CC=CS1""",21,"""CDB9F250448F5075"""
+"""3D7C32BB77FC1BDD_81A519E150EC41C9_6036_UN""","""CN(C)CCNCCOCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""CDB9F250448F5075"""
+"""98EAE302C106BF03_4CC242A88FA26196_6036_UN""","""CN(C)CCNCCOCCN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""CDB9F250448F5075"""
+"""DBE827814C0EB1C7_B8BFED1F40A2313F_6036_UN""","""CN(C)CCNCCOCCN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""CDB9F250448F5075"""
+"""A507DCE4EBE337FE_B24B0A1FDCD90939_6036_UN""","""CN(C)CCNCCOCCN(CC(CC)N)[S](=O)(=O)C""",21,"""CDB9F250448F5075"""
+"""5DDFBC6C3ECF7B30_B0655F3EDED2B912_6036_UN""","""CN(C)CCNCCOCCN(C)[S](=O)(=O)C1=C[NH]C=N1""",21,"""CDB9F250448F5075"""
+"""16A43FFF06345D6E_23A74072042A62F6_6036_UN""","""CN(C)CCNCCOCCN([S](C)(=O)=O)CCN=[N]#N""",21,"""CDB9F250448F5075"""
+"""93D3F9700111ABED_F31677D4025766D2_6036_UN""","""CN(C)CCNCCOCCN(CC(C)(C)N)[S](=O)(=O)C""",21,"""CDB9F250448F5075"""
+"""60F8086DD6037D0E_B91910659599E15F_6036_UN""","""CN(C)CCNCCOCCN1[S](CC(C)(C)C1=O)(=O)=O""",21,"""CDB9F250448F5075"""
+"""BAF0F242C4A17C08_55248E079FB34550_6036_UN""","""CN(C)CCNCCOCCN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2""",21,"""CDB9F250448F5075"""
+"""B1088550557215AC_5CC93A6334E668EA_6036_UN""","""CN(C)CCNCCOCCN([S](=O)(=O)C1CC1)CC#C""",21,"""CDB9F250448F5075"""
+"""1211121DCCB07F33_08C920E8D3E8AD2C_6036_UN""","""CN(C)CCNCCOCCN1[S](=O)(=O)C2(CCC1)CC2""",21,"""CDB9F250448F5075"""
+"""1A567AD116601960_20A26F15F6ECE1C4_6036_UN""","""CN(C)CCNCCOCCN1CCCC(C)(C)[S]1(=O)=O""",21,"""CDB9F250448F5075"""
+"""46DC3F66F34DE52E_EB8B94417F2A2AD7_6036_UN""","""CN(C)CCNCCOCCN1CCCC(CC)[S]1(=O)=O""",21,"""CDB9F250448F5075"""
+"""AB83E474C992F400_DAE2E49B1A939C78_6036_UN""","""CN(C)CCNCCOCCN1C(C(N)CC[S]1(=O)=O)=O""",21,"""CDB9F250448F5075"""
+"""12BF8AE20DC80253_05FC8335609BA556_6036_UN""","""CN(C)CCNCCOCCN([S](C)(=O)=O)[C@@H]1CNCC1""",21,"""CDB9F250448F5075"""
+"""F50B7090E27B215F_AEC44DACB40B387A_6036_UN""","""CN(C)CCNCCOCCN1CCCC(Cl)(Cl)[S]1(=O)=O""",21,"""CDB9F250448F5075"""
+"""E00072C5E4DDEC2C_EEA8FDFCB131E1C4_6036_UN""","""CN(C)CCNCCOCCN([S](C)(=O)=O)[C@H]1CNCC1""",21,"""CDB9F250448F5075"""
+"""0011B442CD8AA3F2_46E767284A2CFEAC_6036_UN""","""CN(C)CCNCCOCCN1[S](CCN(C)CC1)(=O)=O""",21,"""CDB9F250448F5075"""
+"""DEFD22A8F8E20372_CA7041A52285154F_6036_UN""","""CN(C)CCNCCOCCN1CC(=O)NCC[S]1(=O)=O""",21,"""CDB9F250448F5075"""
+"""00DED461234C0522_9F8B5CAC8F20D2DB_6036_UN""","""CN(C)CCNCCOCCN1[S](CCCCC1C)(=O)=O""",21,"""CDB9F250448F5075"""
+"""B59B1C13395824BA_E523196021C03D25_6036_UN""","""CN(C)CCNCCOCCN(CCN)[S](=O)(=O)C1CC1""",21,"""CDB9F250448F5075"""
+"""942F722C4B6416CD_83D93FA185ECAFD2_6036_UN""","""CN(C)CCNCCOCCN(CCN)[S](=O)(=O)C(F)F""",21,"""CDB9F250448F5075"""
+"""F38B6E56E3E2EBB5_23DCA3C4BBE75130_6036_UN""","""CN(C)CCNCCOCCN([S](CC)(=O)=O)C1CNC1""",21,"""CDB9F250448F5075"""
+"""D470958DA396BE27_114577F82C0E054D_6036_DP""","""CN(C)CCNCCOCCN2CC1(CNC1)C[S]2(=O)=O""",21,"""CDB9F250448F5075"""
+"""11A98F437D20B6DD_AB300E6AF5CD4127_6036_UN""","""CN(C)CCNCCOCCN(C)[S](=O)(=O)C1=N[NH]C=N1""",21,"""CDB9F250448F5075"""
+"""44755FD08E91EDC9_57DB963AFCAF5197_6036_UN""","""CN(C)CCNCCOCCN(C)[S](=O)(=O)C1=C[NH]N=C1""",21,"""CDB9F250448F5075"""
+"""2C7FC7CC51E2B159_69BAF18D3191990C_6036_UN""","""CN(C)CCNCCOCCN(C(C)(C)CN)[S](=O)(=O)C""",21,"""CDB9F250448F5075"""
+"""19C840AA6D3F8499_CC3A43567CEB8B6B_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""CDCA12028D7072B7"""
+"""67FFB9DDF6BE93C1_634DBB7A87FB2797_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""CDCA12028D7072B7"""
+"""FC2D2A3D12A0060B_9F4DCCBD1810D0BD_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""CDCA12028D7072B7"""
+"""40BDA2B5C5D11B27_C37734EB8B3CE6B9_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""CDCA12028D7072B7"""
+"""C5A5290CCC63BEB3_F05F5B2A0C521011_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""CDCA12028D7072B7"""
+"""006E8EC0CA8AA415_3BBEBF5ED425E4E2_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""CDCA12028D7072B7"""
+"""6558B743230C0E05_E3D19B5280E1F56A_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=CC(=C2)COCCOC)N""",21,"""CDCA12028D7072B7"""
+"""68117392E6962AC2_6ABC16538E5DFE06_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""CDCA12028D7072B7"""
+"""D63CD9A4945C6876_75A702B0B9171963_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=CC(=C2)OC(COC)C)N""",21,"""CDCA12028D7072B7"""
+"""6255BFF9BBB7139C_27E6FA8432A2B94F_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""CDCA12028D7072B7"""
+"""6499A27E99423004_321F1CB0A9DF180D_6005_UN""","""CNC1=C(C=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""CDCA12028D7072B7"""
+"""23A465BF0D42758C_4BA4739C5EE52470_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""CDCA12028D7072B7"""
+"""E98684695FA05B85_5280579E3689CBF0_6005_UN""","""CNC1=C(C=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""CDCA12028D7072B7"""
+"""C86B2A0EF4FFC94D_2F74087CB19F7A99_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""CDCA12028D7072B7"""
+"""FD1C5DBDD7EC97CC_D8A9C4BE20FDD9A2_6005_UN""","""CNC1=C(C=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""CDCA12028D7072B7"""
+"""6178C046777AD240_EF8EFC3AD797DA16_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""CDCA12028D7072B7"""
+"""48EC8B2ACAEE8866_3D4202BEFD98F0A5_6005_UN""","""CNC1=C(C=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""CDCA12028D7072B7"""
+"""AEDD48C6922C8682_ED97CC3608C2C4B6_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""CDCA12028D7072B7"""
+"""BBE13585B1660598_C202F8791BE5A673_6005_UN""","""CNC1=C(C=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""CDCA12028D7072B7"""
+"""B90830428A7CBD32_C73906DCC7D5745A_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""CDCA12028D7072B7"""
+"""7A40BDDEB201A9E0_02C2A02BA755E86E_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""CDCA12028D7072B7"""
+"""08139DCDD3BACD68_12EE307A78BB5C9A_6005_UN""","""CNC1=C(C=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""CDCA12028D7072B7"""
+"""16F893C6803CBA05_CFFD6943D618A8E0_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""CDCA12028D7072B7"""
+"""D23E5A2D3C7F6AD2_5F8E8D394FE52235_6005_UN""","""CNC1=C(C=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""CDCA12028D7072B7"""
+"""50E4EE74AC8C01C7_7AAF3D8AAFEAECEE_6005_UN""","""CNC1=C(C=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""CDCA12028D7072B7"""
+"""E752AF4B37A3BB7D_1C528DCB86635D8E_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=C(OCCC(C)C)C=C2)N""",21,"""CDCA12028D7072B7"""
+"""F4DA979E2DC714EC_E13FEEDD7829CDDE_6005_UN""","""CNC1=C(C=C(C=C1)C2=CC=C(C=C2)OC3CCCC3)N""",21,"""CDCA12028D7072B7"""
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+"""F61053077CCE96FA_2403468E5144DB4B_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""CE2FAE08EE9610B3"""
+"""7E0C2B441900B132_31FAA0BACA397A09_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""CE2FAE08EE9610B3"""
+"""CA23C891721E6968_4841CF963D034674_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC(=CC=C2)CN3CCCC3""",21,"""CE2FAE08EE9610B3"""
+"""C444B412E5BD7171_5165EB94556FA9F4_6005_UN""","""CC1=C(C(=NC=C1Br)N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""CE2FAE08EE9610B3"""
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+"""A2198EEE35D66494_3EA7BEB49E7E92A1_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""CE2FAE08EE9610B3"""
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+"""E1FF8BA868371870_C4DCBAD6A433165E_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""CE2FAE08EE9610B3"""
+"""06C8E86EE879E745_01271C21C4B38A6A_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""CE2FAE08EE9610B3"""
+"""CC456D919A6E6A2C_110B8C701B5D3E9E_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""CE2FAE08EE9610B3"""
+"""9D072DCE5AB6DE29_CC18D549B5FECAE4_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""CE2FAE08EE9610B3"""
+"""891C91D76274CC67_5C6B31332C034031_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""CE2FAE08EE9610B3"""
+"""9B243EFF667F293E_794A8180CC0C8EEA_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""CE2FAE08EE9610B3"""
+"""ECA07788BC66FE8A_1FB731C1E5853F8A_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC=C(OCCC(C)C)C=C2""",21,"""CE2FAE08EE9610B3"""
+"""E047437D8158484B_E2DA52D71BCFAFDA_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC=C(C=C2)OC3CCCC3""",21,"""CE2FAE08EE9610B3"""
+"""73037BDB99BB0BAF_63EC8B29AC34C70E_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""CE2FAE08EE9610B3"""
+"""AD6AA8DB2F297B49_1693E91BD61863B9_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""CE2FAE08EE9610B3"""
+"""033E1177B42F12CD_E9742E9701199D54_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""CE2FAE08EE9610B3"""
+"""AB8309344307B0AC_1EF3C7622A60B04A_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""CE2FAE08EE9610B3"""
+"""BCEABB159D0A0645_68F8E97EE20CB721_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""CE2FAE08EE9610B3"""
+"""297E2ABB9EEB6580_ADC878447BE8DE5E_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""CE2FAE08EE9610B3"""
+"""49B4779D7C58FC41_C7AC4D6284DED53E_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""CE2FAE08EE9610B3"""
+"""F6BFD369B759A204_B697FF1795D55BCD_6005_UN""","""CC1=C(C(=NC=C1Br)N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""CE2FAE08EE9610B3"""
+"""7D782B74C2D47048_045C1362579C528F_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""CE2FAE08EE9610B3"""
+"""0ABFA6DCC0BAADF4_719281EA6D30C2BD_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""CE2FAE08EE9610B3"""
+"""0AB557D64F6AC797_226ED9B3534263AC_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(C=CC=C2)CN3CCCC3""",21,"""CE2FAE08EE9610B3"""
+"""9DFE1E2C9E9B34BF_BABA8932EFF08016_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""CE2FAE08EE9610B3"""
+"""CB3FBADC5A6E694E_B0BDA331B68D64EB_6005_UN""","""CC1=C(C(=NC=C1Br)N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""CE2FAE08EE9610B3"""
+"""A93D3828468347A0_CF5E14CDF99F1A4D_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=CC=C2)OC3CCCC3""",21,"""CEAE45990804E391"""
+"""1D8BE5E306ECE4F3_6029ECE1028FB6B1_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=C(OCC)C=C2)OCC""",21,"""CEAE45990804E391"""
+"""892EB747037D7851_9C299B269D64419B_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=CC(=C2)OCCC(C)C""",21,"""CEAE45990804E391"""
+"""4A94425CD2A7F7CC_C01363700E48779F_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""CEAE45990804E391"""
+"""0D6369FAF496EFC2_F33B0CB189268137_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=C(C=C2)OC3CCOC3""",21,"""CEAE45990804E391"""
+"""D4D5C131E8E52F0A_38DAE8C5515175C4_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""CEAE45990804E391"""
+"""D2AA6F79184AE280_E0B5CCC90595644C_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=CC(=C2)COCCOC""",21,"""CEAE45990804E391"""
+"""E6EE3BDA31FC64D0_69D841C80B296F20_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""CEAE45990804E391"""
+"""96CCC8E5F0599D9C_76C3552B3C638845_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=CC(=C2)OC(COC)C""",21,"""CEAE45990804E391"""
+"""40C721F33AA31CF6_2482AD1FB7D62869_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""CEAE45990804E391"""
+"""F4090A32E0C67DA5_317B4B2B2CAB892B_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""CEAE45990804E391"""
+"""3D296066BDC8A516_48C02407DB91B556_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=CC=C2)CN3CCCC3""",21,"""CEAE45990804E391"""
+"""C4A23B0D9C27F3A9_51E40005B3FD5AD6_6005_UN""","""CC1=C(C=CC(=C1)CN)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""CEAE45990804E391"""
+"""4ADB05E6A5927569_2C105FE734EBEBBF_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=CC(=C2)OCCN(C)C""",21,"""CEAE45990804E391"""
+"""4AFF351CB3E6EDBA_DBCD9325A5894884_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""CEAE45990804E391"""
+"""8609C3B33EFE7021_ECEAABA152E34B30_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""CEAE45990804E391"""
+"""AC284D99A4118168_3E26552578EC6183_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""CEAE45990804E391"""
+"""264752298C6174A6_EEF39BAD8DB65590_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""CEAE45990804E391"""
+"""8218CCFFBF7971E5_C166AFE29E913755_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""CEAE45990804E391"""
+"""F3A902F3B6962558_C45D514742A1E57C_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""CEAE45990804E391"""
+"""CE8928E51F8DFDFC_01A6F7B022217948_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""CEAE45990804E391"""
+"""D4EEACEA505D314C_118A67E1FDCFCDBC_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""CEAE45990804E391"""
+"""2F0AFDB9DC7C01BE_CC993ED8536C39C6_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""CEAE45990804E391"""
+"""2232B06CEE8CBD79_5CEADAA2CA91B313_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""CEAE45990804E391"""
+"""57FA1AE209538754_79CB6A112A9E7DC8_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""CEAE45990804E391"""
+"""2E0D181C1968D668_1F36DA500317CCA8_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=C(OCCC(C)C)C=C2""",21,"""CEAE45990804E391"""
+"""78BBE5C23AFCF4DC_E25BB946FD5D5CF8_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=C(C=C2)OC3CCCC3""",21,"""CEAE45990804E391"""
+"""20B89351234014F4_636D60B84AA6342C_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""CEAE45990804E391"""
+"""2FD68D0D25D1D29B_1612028A308A909B_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""CEAE45990804E391"""
+"""503A58E7A745B0CF_E9F5C506E78B6E76_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""CEAE45990804E391"""
+"""8A98625B68217BB3_1E722CF3CCF24368_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""CEAE45990804E391"""
+"""16E935D7E7191B51_687902EF049E4403_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""CEAE45990804E391"""
+"""39A7D702A8F74CB6_AD4993D59D7A2D7C_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""CEAE45990804E391"""
+"""B0A59EB54D3FCA04_C72DA6F3624C261C_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""CEAE45990804E391"""
+"""36EF82820FDA5F63_B61614867347A8EF_6005_UN""","""CC1=C(C=CC(=C1)CN)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""CEAE45990804E391"""
+"""D818E0AB3152A6A5_04DDF8F3B10EA1AD_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""CEAE45990804E391"""
+"""A48E3CF5B37D6D08_71136A7B8BA2319F_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""CEAE45990804E391"""
+"""08CBD806E3C25EB3_22EF3222B5D0908E_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(C=CC=C2)CN3CCCC3""",21,"""CEAE45990804E391"""
+"""B24B89A4C6CE76E9_BA3B62A309627334_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=CC(=N[N]2C3CCCCO3)C""",21,"""CEAE45990804E391"""
+"""B9FB3C517D6A20C8_B03C48A0501F97C9_6005_UN""","""CC1=C(C=CC(=C1)CN)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""CEAE45990804E391"""
+"""10719FEC6F0F5C1B_CEE588313A2A232D_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=CC(=CC=C3)OC4CCCC4""",21,"""CF15D965CBB1DAF1"""
+"""4C2D53F558E4B8C2_6192701DC13A8FD1_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=CC(=C(OCC)C=C3)OCC""",21,"""CF15D965CBB1DAF1"""
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+"""EAD63E41B54B351F_E84E59FA243E5716_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""CF15D965CBB1DAF1"""
+"""FC5992D0CF143914_1FC9B00F0F477A08_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""CF15D965CBB1DAF1"""
+"""76BCCD561CF2AD42_69C29E13C72B7D63_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""CF15D965CBB1DAF1"""
+"""9E522DCEA95E2162_ACF20F295ECF141C_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""CF15D965CBB1DAF1"""
+"""8368ED6AD4E18250_C6963A0FA1F91F7C_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""CF15D965CBB1DAF1"""
+"""F2CFD09388428107_B7AD887AB0F2918F_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""CF15D965CBB1DAF1"""
+"""FFD85F72FC663265_0566640F72BB98CD_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""CF15D965CBB1DAF1"""
+"""0AA9D36BBED1D8D6_70A8F687481708FF_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""CF15D965CBB1DAF1"""
+"""FE0A4FBA5E0F2A52_2354AEDE7665A9EE_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=C(C=CC=C3)CN4CCCC4""",21,"""CF15D965CBB1DAF1"""
+"""0206991FBF26E265_BB80FE5FCAD74A54_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""CF15D965CBB1DAF1"""
+"""1C9E3513DEC8F993_B187D45C93AAAEA9_6005_UN""","""BrC2=N[N]1C(=CN=C1S2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""CF15D965CBB1DAF1"""
+"""38590CD7F38628C4_CEBD594D786C2D4D_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""CF4D081989F7D491"""
+"""783414A2C9290BB9_61CAA161837C81B1_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""CF4D081989F7D491"""
+"""B10C5F0F2A0D3932_9DCAD6A61C97769B_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""CF4D081989F7D491"""
+"""14360360DEEC8F87_C1F02EF08FBB409F_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""CF4D081989F7D491"""
+"""14BA9440E7BFCC1B_F2D8413108D5B637_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""CF4D081989F7D491"""
+"""C25AAD81CC64B9EA_3939A545D0A242C4_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""CF4D081989F7D491"""
+"""B8E33AB08446475A_E15681498466534C_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=CC(=C2)COCCOC)N""",21,"""CF4D081989F7D491"""
+"""6903965B616601A2_683B0C488ADA5820_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""CF4D081989F7D491"""
+"""A33AF7468D47B0EA_772018ABBD90BF45_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=CC(=C2)OC(COC)C)N""",21,"""CF4D081989F7D491"""
+"""6345E307CD4E68F0_2561E09F36251F69_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""CF4D081989F7D491"""
+"""376D872FB3A6AD7E_309806ABAD58BE2B_6004_UN""","""COC1=C(N=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""CF4D081989F7D491"""
+"""89C782541C35A5C0_492369875A628256_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""CF4D081989F7D491"""
+"""A7949950EE081A7D_50074D85320E6DD6_6004_UN""","""COC1=C(N=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""CF4D081989F7D491"""
+"""7FDAD202BFDCBBC3_2DF31267B518DCBF_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""CF4D081989F7D491"""
+"""EE2030EDF4FA62BA_DA2EDEA5247A7F84_6004_UN""","""COC1=C(N=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""CF4D081989F7D491"""
+"""1E4A5FCF3588981D_ED09E621D3107C30_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""CF4D081989F7D491"""
+"""99C93CE6EA8257D9_3FC518A5F91F5683_6004_UN""","""COC1=C(N=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""CF4D081989F7D491"""
+"""DB07367F93DDB17B_EF10D62D0C456290_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""CF4D081989F7D491"""
+"""6D426E6006FEF2BF_C085E2621F620055_6004_UN""","""COC1=C(N=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""CF4D081989F7D491"""
+"""483F0BD8192BED51_C5BE1CC7C352D27C_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""CF4D081989F7D491"""
+"""FC2DF0E401E88947_0045BA30A3D24E48_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""CF4D081989F7D491"""
+"""93856959F181610A_10692A617C3CFABC_6004_UN""","""COC1=C(N=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""CF4D081989F7D491"""
+"""A3C9DF31DAC9EE8F_CD7A7358D29F0EC6_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""CF4D081989F7D491"""
+"""84FD20CD9A274BF7_5D0997224B628413_6004_UN""","""COC1=C(N=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""CF4D081989F7D491"""
+"""DA568C2BEBE47A03_78282791AB6D4AC8_6004_UN""","""COC1=C(N=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""CF4D081989F7D491"""
+"""362FE0E9BBD758D6_1ED597D082E4FBA8_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=C(OCCC(C)C)C=C2)N""",21,"""CF4D081989F7D491"""
+"""2D8CD342E61D5238_E3B8F4C67CAE6BF8_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=C(C=C2)OC3CCCC3)N""",21,"""CF4D081989F7D491"""
+"""44677841995537CC_628E2D38CB55032C_6004_UN""","""COC1=C(N=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C)N""",21,"""CF4D081989F7D491"""
+"""D225D26456AF6FBF_17F14F0AB179A79B_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)N""",21,"""CF4D081989F7D491"""
+"""EE80F920C17F0542_E816888666785976_6004_UN""","""COC1=C(N=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3)N""",21,"""CF4D081989F7D491"""
+"""A25191D2DE5D9AC9_1F9161734D017468_6004_UN""","""COC1=C(N=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)N""",21,"""CF4D081989F7D491"""
+"""13DE3E1788727DEA_699A4F6F856D7303_6004_UN""","""COC1=C(N=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2)N""",21,"""CF4D081989F7D491"""
+"""62B0862D1608FBF4_ACAADE551C891A7C_6004_UN""","""COC1=C(N=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)N""",21,"""CF4D081989F7D491"""
+"""224D144738F9DF77_C6CEEB73E3BF111C_6004_UN""","""COC1=C(N=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)N""",21,"""CF4D081989F7D491"""
+"""3210A12C51177652_B7F55906F2B49FEF_6004_UN""","""COC1=C(N=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)N""",21,"""CF4D081989F7D491"""
+"""2E1D6AE8C31C189A_053EB57330FD96AD_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)N""",21,"""CF4D081989F7D491"""
+"""B1359945BBAFC245_70F027FB0A51069F_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3)N""",21,"""CF4D081989F7D491"""
+"""C021889ADF926760_230C7FA23423A78E_6004_UN""","""COC1=C(N=C(C=C1)C2=C(C=CC=C2)CN3CCCC3)N""",21,"""CF4D081989F7D491"""
+"""A69287078D5C0606_BBD82F2388914434_6004_UN""","""COC1=C(N=C(C=C1)C2=CC(=N[N]2C3CCCCO3)C)N""",21,"""CF4D081989F7D491"""
+"""819331197883C534_B1DF0520D1ECA0C9_6004_UN""","""COC1=C(N=C(C=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)N""",21,"""CF4D081989F7D491"""
+"""97B6C9A1E7A4A0E2_CE243AB9F455F909_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC(=CC=C2)OC3CCCC3""",21,"""CFD46BED05CE00D5"""
+"""1607B3661D0DB7FA_6153C2950F4555F5_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC(=C(OCC)C=C2)OCC""",21,"""CFD46BED05CE00D5"""
+"""B9170D0D7BE0EE43_9D53B55290AEA2DF_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC=CC(=C2)OCCC(C)C""",21,"""CFD46BED05CE00D5"""
+"""C83AAC43746A9B42_C1694D04038294DB_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""CFD46BED05CE00D5"""
+"""C0BE083DF84CE846_F24122C584EC6273_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC=C(C=C2)OC3CCOC3""",21,"""CFD46BED05CE00D5"""
+"""B91B452724547D5E_39A0C6B15C9B9680_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC(=C(OC)C=C2)CN(C)C""",21,"""CFD46BED05CE00D5"""
+"""519D2AC975C3BA9B_E1CFE2BD085F8708_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC=CC(=C2)COCCOC""",21,"""CFD46BED05CE00D5"""
+"""32530E80622BFD86_68A26FBC06E38C64_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC=CC(=C2)CN(C)C3CC3""",21,"""CFD46BED05CE00D5"""
+"""D26E7C5C88891177_77B97B5F31A96B01_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC=CC(=C2)OC(COC)C""",21,"""CFD46BED05CE00D5"""
+"""4522CC556B7A80D2_25F8836BBA1CCB2D_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""CFD46BED05CE00D5"""
+"""6D82F1CCB84B0D44_3001655F21616A6F_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""CFD46BED05CE00D5"""
+"""DF290DDA90FD06E5_49BA0A73D65B5612_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC(=CC=C2)CN3CCCC3""",21,"""CFD46BED05CE00D5"""
+"""E3798CFF250B1E79_509E2E71BE37B992_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""CFD46BED05CE00D5"""
+"""1F562B1FAC077103_2D6A7193392108FB_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=CC=CC(=C2)OCCN(C)C""",21,"""CFD46BED05CE00D5"""
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+"""6320411EE8173238_23951C56B81A73CA_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=C(C=CC=C2)CN3CCCC3""",21,"""CFD46BED05CE00D5"""
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+"""9C383B2D7F625509_B14666D45DD5748D_6004_UN""","""Cl[S](=O)(=O)C1=C[NH]N=C1C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""CFD46BED05CE00D5"""
+"""CC11A817BE959921_2ECE20EA25FBB504_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](CCN)(=O)=O)C2CC2)C""",21,"""D0065E05FB00D81C"""
+"""E70712CF197D981C_B5B7F0608858BAAA_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C(C)C)[S](=O)(=O)CCN)C""",21,"""D0065E05FB00D81C"""
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+"""503008FD3C2BB26A_FF2E1D6D28B0E03E_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](CC)(=O)=O)CCCN)C""",21,"""D0065E05FB00D81C"""
+"""B3C7A01657E46558_75F1B880DE64D51F_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](C)(=O)=O)C2CC(C2)N)C""",21,"""D0065E05FB00D81C"""
+"""0726FB37BE870BA3_332BB087EE51579E_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(CCCN)[S](=O)(=O)CCl)C""",21,"""D0065E05FB00D81C"""
+"""CB200203892959C4_C6CA3CC13CC3C2DF_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C)[S](=O)(=O)C2CNCC2)C""",21,"""D0065E05FB00D81C"""
+"""1F0BDE8F92396A6E_789237D6832C671B_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](CC)(=O)=O)CCCBr)C""",21,"""D0065E05FB00D81C"""
+"""A8D2397A69591BD9_CC48B6D62622E495_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(CCCNC)[S](=O)(=O)C)C""",21,"""D0065E05FB00D81C"""
+"""C632E4979175016D_2925BEB0AFEBFECD_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C(C)(C)C#N)[S](=O)(=O)C)C""",21,"""D0065E05FB00D81C"""
+"""F1FBCF018B42C5A5_7B6ED4ABF3D42D05_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](=O)(=O)CC#N)C2CC2)C""",21,"""D0065E05FB00D81C"""
+"""F99E782E7218B3C6_F8BABFDD1B726F12_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](C)(=O)=O)C(=O)CCN)C""",21,"""D0065E05FB00D81C"""
+"""E4846953D0F16798_3EBCE82DFF2CDBE1_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C)[S](=O)(=O)C2=CC=CS2)C""",21,"""D0065E05FB00D81C"""
+"""C3C8A0E0F238E269_9C1AB5B4EF63C9A0_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C(C)(C)C)[S](=O)(=O)CCl)C""",21,"""D0065E05FB00D81C"""
+"""55107E1CEBABE5E2_517DEEFD302DE9FF_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C(C)(C)C)[S](=O)(=O)CBr)C""",21,"""D0065E05FB00D81C"""
+"""AD1788B3369F44BE_A500414AFF2DB956_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C(C)(C)C#C)[S](=O)(=O)C)C""",21,"""D0065E05FB00D81C"""
+"""75BA62D760C4E0BA_AFF4A64A63568150_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(CC(CC)N)[S](=O)(=O)C)C""",21,"""D0065E05FB00D81C"""
+"""1E038BF12AA38847_ADDAF36B615D317B_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C)[S](=O)(=O)C2=C[NH]C=N2)C""",21,"""D0065E05FB00D81C"""
+"""966049990F613FA7_3E18EC27BBA5EA9F_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](C)(=O)=O)CCN=[N]#N)C""",21,"""D0065E05FB00D81C"""
+"""B8D1DBC9C6AE0A7A_EEA9DB81BDD8EEBB_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(CC(C)(C)N)[S](=O)(=O)C)C""",21,"""D0065E05FB00D81C"""
+"""285733CD1801DA47_A4A6BC302A166936_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N2[S](CC(C)(C)C2=O)(=O)=O)C""",21,"""D0065E05FB00D81C"""
+"""71BA5610AA1DF92F_489B2252203CCD39_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3)C""",21,"""D0065E05FB00D81C"""
+"""F842DC11EED9CA86_417696368B69E083_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](=O)(=O)C2CC2)CC#C)C""",21,"""D0065E05FB00D81C"""
+"""565D6AA9F8FB7D2A_15768CBD6C672545_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N2[S](=O)(=O)C3(CCC2)CC3)C""",21,"""D0065E05FB00D81C"""
+"""6251B8E8F887A9AF_3D1DC340496369AD_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N2CCCC(C)(C)[S]2(=O)=O)C""",21,"""D0065E05FB00D81C"""
+"""0FDCFDD83EE02683_F6343814C0A5A2BE_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N2CCCC(CC)[S]2(=O)=O)C""",21,"""D0065E05FB00D81C"""
+"""471545FD50CDBB91_C75D48CEA51C1411_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N2C(C(N)CC[S]2(=O)=O)=O)C""",21,"""D0065E05FB00D81C"""
+"""7C2F9609274B97AF_18432F60DF142D3F_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](C)(=O)=O)[C@@H]2CNCC2)C""",21,"""D0065E05FB00D81C"""
+"""B22BB63DC4128A2B_B37BE1F90B84B013_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N2CCCC(Cl)(Cl)[S]2(=O)=O)C""",21,"""D0065E05FB00D81C"""
+"""D3072C3D0A794946_F31751A90EBE69AD_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](C)(=O)=O)[C@H]2CNCC2)C""",21,"""D0065E05FB00D81C"""
+"""A79750B70B1DE3D7_5B58CB7DF5A376C5_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N2[S](CCN(C)CC2)(=O)=O)C""",21,"""D0065E05FB00D81C"""
+"""7EB0A02091612E39_D7CFEDF09D0A9D26_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N2CC(=O)NCC[S]2(=O)=O)C""",21,"""D0065E05FB00D81C"""
+"""77263078CAF8BFA2_8234F0F930AF5AB2_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N2[S](CCCCC2C)(=O)=O)C""",21,"""D0065E05FB00D81C"""
+"""02BA38914A37EBE9_F89CB5359E4FB54C_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(CCN)[S](=O)(=O)C2CC2)C""",21,"""D0065E05FB00D81C"""
+"""59F8B9208254CD51_9E6693F43A6327BB_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(CCN)[S](=O)(=O)C(F)F)C""",21,"""D0065E05FB00D81C"""
+"""615C2350B8BFEBF1_3E630F910468D959_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N([S](CC)(=O)=O)C2CNC2)C""",21,"""D0065E05FB00D81C"""
+"""F7202D621BB1D876_0CFADBAD93818D24_6036_DP""","""CC1=N[N](C)C(=C1C(CN)N3CC2(CNC2)C[S]3(=O)=O)C""",21,"""D0065E05FB00D81C"""
+"""B1F22768CC2B685B_B68FA23F4A42C94E_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C)[S](=O)(=O)C2=N[NH]C=N2)C""",21,"""D0065E05FB00D81C"""
+"""D1A9B690C74A81B1_4A643A6F4320D9FE_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C)[S](=O)(=O)C2=C[NH]N=C2)C""",21,"""D0065E05FB00D81C"""
+"""99674506F5AB1831_74055DD88E1E1165_6036_UN""","""CC1=N[N](C)C(=C1C(CN)N(C(C)(C)CN)[S](=O)(=O)C)C""",21,"""D0065E05FB00D81C"""
+"""4899EA9764E6282E_2E743FF74CAF022D_6036_UN""","""CNCC(CN1CCCC1=O)N([S](CCN)(=O)=O)C2CC2""",21,"""D0BC411892546F35"""
+"""B098FC2E7F122C13_B50DEF7DE10C0D83_6036_UN""","""CNCC(CN1CCCC1=O)N(C(C)C)[S](=O)(=O)CCN""",21,"""D0BC411892546F35"""
+"""AFC2293E404D0E80_E28203C80F4C2EDF_6036_UN""","""CNCC(CN1CCCC1=O)N([S](C)(=O)=O)CCN=C=S""",21,"""D0BC411892546F35"""
+"""A05FB707C749516A_FF94027041E45717_6036_UN""","""CNCC(CN1CCCC1=O)N([S](CC)(=O)=O)CCCN""",21,"""D0BC411892546F35"""
+"""79690F03DF6BA29C_754BA79DB7306236_6036_UN""","""CNCC(CN1CCCC1=O)N([S](C)(=O)=O)C2CC(C2)N""",21,"""D0BC411892546F35"""
+"""A3DA793B71F329A5_3391AF9A8705E0B7_6036_UN""","""CNCC(CN1CCCC1=O)N(CCCN)[S](=O)(=O)CCl""",21,"""D0BC411892546F35"""
+"""4C96E8F14B88610C_C67023DC559775F6_6036_UN""","""CNCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2CNCC2""",21,"""D0BC411892546F35"""
+"""FC55D74FB593AF3D_782828CBEA78D032_6036_UN""","""CNCC(CN1CCCC1=O)N([S](CC)(=O)=O)CCCBr""",21,"""D0BC411892546F35"""
+"""06B6EDC968B04850_CCF2A9CB4F7653BC_6036_UN""","""CNCC(CN1CCCC1=O)N(CCCNC)[S](=O)(=O)C""",21,"""D0BC411892546F35"""
+"""08DE6BACD1BEC3E6_299FA1ADC6BF49E4_6036_UN""","""CNCC(CN1CCCC1=O)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""D0BC411892546F35"""
+"""385A50C98F9BAE69_7BD4CBB69A809A2C_6036_UN""","""CNCC(CN1CCCC1=O)N([S](=O)(=O)CC#N)C2CC2""",21,"""D0BC411892546F35"""
+"""ED62D16F71186BE2_F800A0C07226D83B_6036_UN""","""CNCC(CN1CCCC1=O)N([S](C)(=O)=O)C(=O)CCN""",21,"""D0BC411892546F35"""
+"""B34EC2DBAB910B17_3E06F73096786CC8_6036_UN""","""CNCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""D0BC411892546F35"""
+"""DF9DBCAE5456A782_9CA0AAA986377E89_6036_UN""","""CNCC(CN1CCCC1=O)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""D0BC411892546F35"""
+"""3A22CC5EDDB04D18_51C7F1E059795ED6_6036_UN""","""CNCC(CN1CCCC1=O)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""D0BC411892546F35"""
+"""CD0C5A8C901734D4_A5BA5E5796790E7F_6036_UN""","""CNCC(CN1CCCC1=O)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""D0BC411892546F35"""
+"""29CD46F648AA2746_AF4EB9570A023679_6036_UN""","""CNCC(CN1CCCC1=O)N(CC(CC)N)[S](=O)(=O)C""",21,"""D0BC411892546F35"""
+"""65996DA90D024A72_AD60EC7608098652_6036_UN""","""CNCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""D0BC411892546F35"""
+"""B3FAA0E3D38B86A3_3EA2F33AD2F15DB6_6036_UN""","""CNCC(CN1CCCC1=O)N([S](C)(=O)=O)CCN=[N]#N""",21,"""D0BC411892546F35"""
+"""F73B04BD05D1E0A1_EE13C49CD48C5992_6036_UN""","""CNCC(CN1CCCC1=O)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""D0BC411892546F35"""
+"""BAB946B51056B007_A41CA32D4342DE1F_6036_UN""","""CNCC(CN1CCCC1=O)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""D0BC411892546F35"""
+"""B25CFF727CAEF032_48213D4F49687A10_6036_UN""","""CNCC(CN1CCCC1=O)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""D0BC411892546F35"""
+"""45B23768789157B5_41CC892BE23D57AA_6036_UN""","""CNCC(CN1CCCC1=O)N([S](=O)(=O)C2CC2)CC#C""",21,"""D0BC411892546F35"""
+"""A683D026103E09C6_15CC93A00533926C_6036_UN""","""CNCC(CN1CCCC1=O)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""D0BC411892546F35"""
+"""E9911BEAE5E090A9_3DA7DC5D2037DE84_6036_UN""","""CNCC(CN1CCCC1=O)N2CCCC(C)(C)[S]2(=O)=O""",21,"""D0BC411892546F35"""
+"""FA94104B10B2632A_F68E2709A9F11597_6036_UN""","""CNCC(CN1CCCC1=O)N2CCCC(CC)[S]2(=O)=O""",21,"""D0BC411892546F35"""
+"""8BCFF5FB370E6769_C7E757D3CC48A338_6036_UN""","""CNCC(CN1CCCC1=O)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""D0BC411892546F35"""
+"""65370B2609148DC1_18F9307DB6409A16_6036_UN""","""CNCC(CN1CCCC1=O)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""D0BC411892546F35"""
+"""3F6327682D0DAD61_B3C1FEE462D0073A_6036_UN""","""CNCC(CN1CCCC1=O)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""D0BC411892546F35"""
+"""CAB8346B58CAB11F_F3AD4EB467EADE84_6036_UN""","""CNCC(CN1CCCC1=O)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""D0BC411892546F35"""
+"""52C139DD8E16F5F5_5BE2D4609CF7C1EC_6036_UN""","""CNCC(CN1CCCC1=O)N2[S](CCN(C)CC2)(=O)=O""",21,"""D0BC411892546F35"""
+"""A52E8DA628997F60_D775F2EDF45E2A0F_6036_UN""","""CNCC(CN1CCCC1=O)N2CC(=O)NCC[S]2(=O)=O""",21,"""D0BC411892546F35"""
+"""91A6052B4248B932_828EEFE459FBED9B_6036_UN""","""CNCC(CN1CCCC1=O)N2[S](CCCCC2C)(=O)=O""",21,"""D0BC411892546F35"""
+"""F4C0360065BDA007_F826AA28F71B0265_6036_UN""","""CNCC(CN1CCCC1=O)N(CCN)[S](=O)(=O)C2CC2""",21,"""D0BC411892546F35"""
+"""7751908028A58EF2_9EDC8CE953379092_6036_UN""","""CNCC(CN1CCCC1=O)N(CCN)[S](=O)(=O)C(F)F""",21,"""D0BC411892546F35"""
+"""4597603D605FEB6C_3ED9108C6D3C6E70_6036_UN""","""CNCC(CN1CCCC1=O)N([S](CC)(=O)=O)C2CNC2""",21,"""D0BC411892546F35"""
+"""F7DB933400F6CF7C_0C40C4B0FAD53A0D_6036_DP""","""CNCC(CN1CCCC1=O)N3CC2(CNC2)C[S]3(=O)=O""",21,"""D0BC411892546F35"""
+"""C1234DA0EFFA0BA1_B635BD2223167E67_6036_UN""","""CNCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""D0BC411892546F35"""
+"""08C03F4E33D1AC81_4ADE25722A746ED7_6036_UN""","""CNCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""D0BC411892546F35"""
+"""C3C193CCA30BE528_74BF42C5E74AA64C_6036_UN""","""CNCC(CN1CCCC1=O)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""D0BC411892546F35"""
+"""BC97BDAEE3152F23_D0CA6E7E11AEC8B4_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=CC=C2)OC3CCCC3""",21,"""D13A3F2AE0353168"""
+"""0D4DB339E5E1153C_7FBD9652EABE6448_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=C(OCC)C=C2)OCC""",21,"""D13A3F2AE0353168"""
+"""2CC03B20332EEBE3_83BDE19575559362_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=CC(=C2)OCCC(C)C""",21,"""D13A3F2AE0353168"""
+"""5EE4EDA75ABDFF55_DF8719C3E679A566_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""D13A3F2AE0353168"""
+"""7B559F3ADB3AFAC3_ECAF7602611753CE_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=C(C=C2)OC3CCOC3""",21,"""D13A3F2AE0353168"""
+"""D8732E5F9FCE7CB6_274E9276B960A73D_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""D13A3F2AE0353168"""
+"""72DBA8B7E542A205_FF21B67AEDA4B6B5_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=CC(=C2)COCCOC""",21,"""D13A3F2AE0353168"""
+"""70E95BD6415B27C7_764C3B7BE318BDD9_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""D13A3F2AE0353168"""
+"""47D1566FEAADC52D_69572F98D4525ABC_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=CC(=C2)OC(COC)C""",21,"""D13A3F2AE0353168"""
+"""841C726E64934C80_3B16D7AC5FE7FA90_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""D13A3F2AE0353168"""
+"""1B21DAA44AA96C42_2EEF3198C49A5BD2_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""D13A3F2AE0353168"""
+"""ED8D852348574C10_57545EB433A067AF_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=CC=C2)CN3CCCC3""",21,"""D13A3F2AE0353168"""
+"""3E17DBCF22AF580D_4E707AB65BCC882F_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""D13A3F2AE0353168"""
+"""29A5113FC17FEEEC_33842554DCDA3946_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=CC(=C2)OCCN(C)C""",21,"""D13A3F2AE0353168"""
+"""9EE40AE5A9D4FC47_C459E9964DB89A7D_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""D13A3F2AE0353168"""
+"""3F3335D2E9E9501D_F37ED112BAD299C9_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""D13A3F2AE0353168"""
+"""493AC6432DF2C7C2_21B22F9690DDB37A_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""D13A3F2AE0353168"""
+"""1BCF9E7627CEFA5F_F167E11E65878769_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""D13A3F2AE0353168"""
+"""ADB8E1EE8CE5982F_DEF2D55176A0E5AC_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""D13A3F2AE0353168"""
+"""FC0C5349B943B436_DBC92BF4AA903785_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""D13A3F2AE0353168"""
+"""FBCB5582FA7EE9C7_1E328D03CA10ABB1_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""D13A3F2AE0353168"""
+"""18F071734C03C822_0E1E1D5215FE1F45_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""D13A3F2AE0353168"""
+"""1F165B4865F13019_D30D446BBB5DEB3F_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""D13A3F2AE0353168"""
+"""D329B7F37FDC08EB_437EA01122A061EA_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""D13A3F2AE0353168"""
+"""A2FCA9E9806AF07B_665F10A2C2AFAF31_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""D13A3F2AE0353168"""
+"""09E8623A05C77F90_00A2A0E3EB261E51_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=C(OCCC(C)C)C=C2""",21,"""D13A3F2AE0353168"""
+"""07C0BAFF17AAD8C7_FDCFC3F5156C8E01_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=C(C=C2)OC3CCCC3""",21,"""D13A3F2AE0353168"""
+"""CF703E70B7375A51_7CF91A0BA297E6D5_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""D13A3F2AE0353168"""
+"""040119E109B521B1_09867839D8BB4262_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""D13A3F2AE0353168"""
+"""EE2F61A94AA9CDA2_F661BFB50FBABC8F_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""D13A3F2AE0353168"""
+"""CEC55CCB591E6EC1_01E6564024C39191_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""D13A3F2AE0353168"""
+"""FD00663C4C2EB09B_77ED785CECAF96FA_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""D13A3F2AE0353168"""
+"""7261CE954900134B_B2DDE966754BFF85_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""D13A3F2AE0353168"""
+"""28B4ADD1C6B73B02_D8B9DC408A7DF4E5_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""D13A3F2AE0353168"""
+"""76B8DBB1830C0E6A_A9826E359B767A16_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""D13A3F2AE0353168"""
+"""FADCC03386E05F3C_1B498240593F7354_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""D13A3F2AE0353168"""
+"""DAE462645867FA35_6E8710C86393E366_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""D13A3F2AE0353168"""
+"""DC6FEAA04DAB1205_3D7B48915DE14277_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(C=CC=C2)CN3CCCC3""",21,"""D13A3F2AE0353168"""
+"""DBA1B3B96AE9A5D5_A5AF1810E153A1CD_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=CC(=N[N]2C3CCCCO3)C""",21,"""D13A3F2AE0353168"""
+"""90BD38BC7A3AAB70_AFA83213B82E4530_6005_UN""","""NC1=C(C=CC(=C1Cl)Br)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""D13A3F2AE0353168"""
+"""2D4BB8EFF4240705_2F9D8DA41A8A8DAC_6036_UN""","""CC(CN)(CN([S](CCN)(=O)=O)C1CC1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""5D785A3D50797963_B4E45D2EB7298202_6036_UN""","""CC(CN)(CN(C(C)C)[S](=O)(=O)CCN)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""2751BBD9082DB4D7_E36BB19B5969A15E_6036_UN""","""CC(CN)(CN([S](C)(=O)=O)CCN=C=S)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""D8B183A8E59123D8_FE7DB02317C1D896_6036_UN""","""CC(CN)(CN([S](CC)(=O)=O)CCCN)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""3E47D2A23B89D89C_74A215CEE115EDB7_6036_UN""","""CC(CN)(CN([S](C)(=O)=O)C1CC(C1)N)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""21BC706B7F3025E0_32781DC9D1206F36_6036_UN""","""CC(CN)(CN(CCCN)[S](=O)(=O)CCl)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""A700706C627A363C_C799918F03B2FA77_6036_UN""","""CC(CN)(CN(C)[S](=O)(=O)C1CNCC1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""6E25F2474C01B3DD_79C19A98BC5D5FB3_6036_UN""","""CC(CN)(CN([S](CC)(=O)=O)CCCBr)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""7DECBAC5C5F1FDB8_CD1B1B981953DC3D_6036_UN""","""CC(CN)(CN(CCCNC)[S](=O)(=O)C)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""2E034E2A38FE9502_287613FE909AC665_6036_UN""","""CC(CN)(CN(C(C)(C)C#N)[S](=O)(=O)C)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""44ABB399F8F50B0A_7A3D79E5CCA515AD_6036_UN""","""CC(CN)(CN([S](=O)(=O)CC#N)C1CC1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""C916886AA947A9C8_F9E91293240357BA_6036_UN""","""CC(CN)(CN([S](C)(=O)=O)C(=O)CCN)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""4CD51124E1A22624_3FEF4563C05DE349_6036_UN""","""CC(CN)(CN(C)[S](=O)(=O)C1=CC=CS1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""4E5C3B9DDD507837_9D4918FAD012F108_6036_UN""","""CC(CN)(CN(C(C)(C)C)[S](=O)(=O)CCl)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""11E5736CDDB99A21_502E43B30F5CD157_6036_UN""","""CC(CN)(CN(C(C)(C)C)[S](=O)(=O)CBr)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""27C65D42C440150C_A453EC04C05C81FE_6036_UN""","""CC(CN)(CN(C(C)(C)C#C)[S](=O)(=O)C)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""B4CDAD5DACAAF735_AEA70B045C27B9F8_6036_UN""","""CC(CN)(CN(CC(CC)N)[S](=O)(=O)C)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""3B2A7B4D079672C8_AC895E255E2C09D3_6036_UN""","""CC(CN)(CN(C)[S](=O)(=O)C1=C[NH]C=N1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""297EE3AAE698ED92_3F4B416984D4D237_6036_UN""","""CC(CN)(CN([S](C)(=O)=O)CCN=[N]#N)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""ABC44950082A5D0E_EFFA76CF82A9D613_6036_UN""","""CC(CN)(CN(CC(C)(C)N)[S](=O)(=O)C)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""319E078A34B29FA5_A5F5117E1567519E_6036_UN""","""CC(CN)(CN1[S](CC(C)(C)C1=O)(=O)=O)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""EB4FF0A6B6E7F676_49C88F1C1F4DF591_6036_UN""","""CC(CN)(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)CC3=CC=CS3""",21,"""D155F34BC471E0B4"""
+"""301DEA18B6D3813D_40253B78B418D82B_6036_UN""","""CC(CN)(CN([S](=O)(=O)C1CC1)CC#C)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""AB14EC0632FE2FEC_142521F353161DED_6036_UN""","""CC(CN)(CN1[S](=O)(=O)C2(CCC1)CC2)CC3=CC=CS3""",21,"""D155F34BC471E0B4"""
+"""B6CB0CC1CEBE6716_3C4E6E0E76125105_6036_UN""","""CC(CN)(CN1CCCC(C)(C)[S]1(=O)=O)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""986B4589EC2F6D52_F767955AFFD49A16_6036_UN""","""CC(CN)(CN1CCCC(CC)[S]1(=O)=O)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""0AC5E892B13B337F_C60EE5809A6D2CB9_6036_UN""","""CC(CN)(CN1C(C(N)CC[S]1(=O)=O)=O)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""0F481F40CEF48F2F_1910822EE0651597_6036_UN""","""CC(CN)(CN([S](C)(=O)=O)[C@@H]1CNCC1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""2EC0B89C221EC703_B2284CB734F588BB_6036_UN""","""CC(CN)(CN1CCCC(Cl)(Cl)[S]1(=O)=O)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""932C48DF25B17F3E_F244FCE731CF5105_6036_UN""","""CC(CN)(CN([S](C)(=O)=O)[C@H]1CNCC1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""CBCB628903F848D6_5A0B6633CAD24E6D_6036_UN""","""CC(CN)(CN1[S](CCN(C)CC1)(=O)=O)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""227B16919E49D7A3_D69C40BEA27BA58E_6036_UN""","""CC(CN)(CN1CC(=O)NCC[S]1(=O)=O)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""EE85F41E11318F47_83675DB70FDE621A_6036_UN""","""CC(CN)(CN1[S](CCCCC1C)(=O)=O)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""35BE8A9A49F4E01A_F9CF187BA13E8DE4_6036_UN""","""CC(CN)(CN(CCN)[S](=O)(=O)C1CC1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""4AD6E7EE262770A0_9F353EBA05121F13_6036_UN""","""CC(CN)(CN(CCN)[S](=O)(=O)C(F)F)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""A92E5E64EC53EE1A_3F30A2DF3B19E1F1_6036_UN""","""CC(CN)(CN([S](CC)(=O)=O)C1CNC1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""E24F7BDB2C59FC82_0DA976E3ACF0B58C_6036_DP""","""CC(CN)(CN2CC1(CNC1)C[S]2(=O)=O)CC3=CC=CS3""",21,"""D155F34BC471E0B4"""
+"""4990179D1FF70967_B7DC0F717533F1E6_6036_UN""","""CC(CN)(CN(C)[S](=O)(=O)C1=N[NH]C=N1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""D04762A0B9ACB85F_4B3797217C51E156_6036_UN""","""CC(CN)(CN(C)[S](=O)(=O)C1=C[NH]N=C1)CC2=CC=CS2""",21,"""D155F34BC471E0B4"""
+"""57CE4F7199237EEE_7556F096B16F29CD_6036_UN""","""CC(CN)(CN(C(C)(C)CN)[S](=O)(=O)C)CC1=CC=CS1""",21,"""D155F34BC471E0B4"""
+"""E87C2ABF6D70E315_2F9211436AAED97F_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](CCN)(=O)=O)C1CC1""",21,"""D15A6FACB455B467"""
+"""05061DE8AE5FF643_B4EBC1C9C70DD6D1_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C(C)C)[S](=O)(=O)CCN""",21,"""D15A6FACB455B467"""
+"""3F5EB0222967E1EB_E3642D7C294DF58D_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](C)(=O)=O)CCN=C=S""",21,"""D15A6FACB455B467"""
+"""75797A7DDE33FAFD_FE722CC467E58C45_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](CC)(=O)=O)CCCN""",21,"""D15A6FACB455B467"""
+"""FCED852A607196E9_74AD89299131B964_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](C)(=O)=O)C1CC(C1)N""",21,"""D15A6FACB455B467"""
+"""36CAAE784CDEDCE8_3277812EA1043BE5_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(CCCN)[S](=O)(=O)CCl""",21,"""D15A6FACB455B467"""
+"""C2E53CB194B1D3FD_C7960D687396AEA4_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C)[S](=O)(=O)C1CNCC1""",21,"""D15A6FACB455B467"""
+"""FCC03D334B433D9B_79CE067FCC790B60_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](CC)(=O)=O)CCCBr""",21,"""D15A6FACB455B467"""
+"""5F8B2BA0FAD1B122_CD14877F697788EE_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(CCCNC)[S](=O)(=O)C""",21,"""D15A6FACB455B467"""
+"""1E3EECB2631AC097_28798F19E0BE92B6_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""D15A6FACB455B467"""
+"""25399C39CFA9A325_7A32E502BC81417E_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](=O)(=O)CC#N)C1CC1""",21,"""D15A6FACB455B467"""
+"""3936A57BDB3DB5D9_F9E68E7454270369_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""D15A6FACB455B467"""
+"""379366FB6EC3B54D_3FE0D984B079B79A_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C)[S](=O)(=O)C1=CC=CS1""",21,"""D15A6FACB455B467"""
+"""C5708CFB51903DA6_9D46841DA036A5DB_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""D15A6FACB455B467"""
+"""B5E2F4436D1D9F98_5021DF547F788584_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""D15A6FACB455B467"""
+"""18506568775C86DB_A45C70E3B078D52D_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""D15A6FACB455B467"""
+"""F5CA92ADEDA69414_AEA897E32C03ED2B_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""D15A6FACB455B467"""
+"""B166BEFE1E2A4C36_AC86C2C22E085D00_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C)[S](=O)(=O)C1=C[NH]C=N1""",21,"""D15A6FACB455B467"""
+"""1E6D6EDCA781E542_3F44DD8EF4F086E4_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""D15A6FACB455B467"""
+"""0DADF00A8E14D2B7_EFF5EA28F28D82C0_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""D15A6FACB455B467"""
+"""3B45009FD6C1663F_A5FA8D996543054D_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N1[S](CC(C)(C)C1=O)(=O)=O""",21,"""D15A6FACB455B467"""
+"""93F68B600F6370FB_49C713FB6F69A142_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N1[C@H]2CC[C@@H](C[S]1(=O)=O)C2""",21,"""D15A6FACB455B467"""
+"""1DDFBE2806B2C4F4_402AA79FC43C8CF8_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](=O)(=O)C1CC1)CC#C""",21,"""D15A6FACB455B467"""
+"""3412F85D103ACA10_142ABD142332493E_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N1[S](=O)(=O)C2(CCC1)CC2""",21,"""D15A6FACB455B467"""
+"""6374C24D83291AA8_3C41F2E9063605D6_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N1CCCC(C)(C)[S]1(=O)=O""",21,"""D15A6FACB455B467"""
+"""C79AB011AE05735B_F76809BD8FF0CEC5_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N1CCCC(CC)[S]1(=O)=O""",21,"""D15A6FACB455B467"""
+"""0ABB3CF581ECFFCC_C6017967EA49786A_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N1C(C(N)CC[S]1(=O)=O)=O""",21,"""D15A6FACB455B467"""
+"""EFC6B06905E38DA6_191F1EC990414144_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](C)(=O)=O)[C@@H]1CNCC1""",21,"""D15A6FACB455B467"""
+"""74BC04C2256DE4A6_B227D05044D1DC68_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N1CCCC(Cl)(Cl)[S]1(=O)=O""",21,"""D15A6FACB455B467"""
+"""9677356C85883DF5_F24B600041EB05D6_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](C)(=O)=O)[C@H]1CNCC1""",21,"""D15A6FACB455B467"""
+"""D23A58EB3C968B12_5A04FAD4BAF61ABE_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N1[S](CCN(C)CC1)(=O)=O""",21,"""D15A6FACB455B467"""
+"""245C5C6ADA20A438_D693DC59D25FF15D_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N1CC(=O)NCC[S]1(=O)=O""",21,"""D15A6FACB455B467"""
+"""2553E86CDA2A903B_8368C1507FFA36C9_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N1[S](CCCCC1C)(=O)=O""",21,"""D15A6FACB455B467"""
+"""B7CBCFDCF2D714B1_F9C0849CD11AD937_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(CCN)[S](=O)(=O)C1CC1""",21,"""D15A6FACB455B467"""
+"""AA4BD8D56578D8AD_9F3AA25D75364BC0_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(CCN)[S](=O)(=O)C(F)F""",21,"""D15A6FACB455B467"""
+"""12984B84304048E8_3F3F3E384B3DB522_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N([S](CC)(=O)=O)C1CNC1""",21,"""D15A6FACB455B467"""
+"""0A1459AF0B8A1B63_0DA6EA04DCD4E15F_6036_DP""","""CC(C)CC(N)C(C(F)(F)F)N2CC1(CNC1)C[S]2(=O)=O""",21,"""D15A6FACB455B467"""
+"""10B7943C5A30B030_B7D393960517A535_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C)[S](=O)(=O)C1=N[NH]C=N1""",21,"""D15A6FACB455B467"""
+"""99707A39C169E839_4B380BC60C75B585_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C)[S](=O)(=O)C1=C[NH]N=C1""",21,"""D15A6FACB455B467"""
+"""965ABD6985785F64_75596C71C14B7D1E_6036_UN""","""CC(C)CC(N)C(C(F)(F)F)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""D15A6FACB455B467"""
+"""87F760A4B2B06EEC_D07F8C2489B95A8A_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=CC=C2)OC3CCCC3""",21,"""D18FDD707822A356"""
+"""6F716F7569D0BD0F_7F08740872A9F676_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=C(OCC)C=C2)OCC""",21,"""D18FDD707822A356"""
+"""A97B28565091B436_830803CFED42015C_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=CC(=C2)OCCC(C)C""",21,"""D18FDD707822A356"""
+"""F8E4C59A8D4E499D_DF32FB997E6E3758_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""D18FDD707822A356"""
+"""201EECA685919AB4_EC1A9458F900C1F0_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=C(C=C2)OC3CCOC3""",21,"""D18FDD707822A356"""
+"""39619C8EFD866457_27FB702C21773503_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""D18FDD707822A356"""
+"""C3EF9649EB0F78F4_FF94542075B3248B_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=CC(=C2)COCCOC""",21,"""D18FDD707822A356"""
+"""07363BE90C09FC47_76F9D9217B0F2FE7_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""D18FDD707822A356"""
+"""7EF93B26FA9695B0_69E2CDC24C45C882_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=CC(=C2)OC(COC)C""",21,"""D18FDD707822A356"""
+"""3F1D1361C8C7B621_3BA335F6C7F068AE_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""D18FDD707822A356"""
+"""3B91ADEE12935C5A_2E5AD3C25C8DC9EC_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""D18FDD707822A356"""
+"""724D6B17F2D52108_57E1BCEEABB7F591_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=CC=C2)CN3CCCC3""",21,"""D18FDD707822A356"""
+"""D37B199EEE126583_4EC598ECC3DB1A11_6005_UN""","""FC(F)(F)C1=NN=C(O1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""D18FDD707822A356"""
+"""EE6A6AED697AA45B_3331C70E44CDAB78_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=CC(=C2)OCCN(C)C""",21,"""D18FDD707822A356"""
+"""9E3805132587696D_C4EC0BCCD5AF0843_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""D18FDD707822A356"""
+"""19AD369FD0F7BA6F_F3CB334822C50BF7_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""D18FDD707822A356"""
+"""0EB7B8010414FF8E_2107CDCC08CA2144_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""D18FDD707822A356"""
+"""AEA64D0B3ED010FA_F1D20344FD901557_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""D18FDD707822A356"""
+"""C40FB5562F613A8B_DE47370BEEB77792_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""D18FDD707822A356"""
+"""8737845E1099BDD5_DB7CC9AE3287A5BB_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""D18FDD707822A356"""
+"""DF1C297365B59612_1E876F595207398F_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""D18FDD707822A356"""
+"""DB91FCE69218FCFC_0EABFF088DE98D7B_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""D18FDD707822A356"""
+"""99353F494ACAAF2A_D3B8A631234A7901_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""D18FDD707822A356"""
+"""799161F99C39768F_43CB424BBAB7F3D4_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""D18FDD707822A356"""
+"""FED7CF3B0E87FE7E_66EAF2F85AB83D0F_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""D18FDD707822A356"""
+"""3409A2A3FC252727_001742B973318C6F_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=C(OCCC(C)C)C=C2""",21,"""D18FDD707822A356"""
+"""B9E563DC2F105115_FD7A21AF8D7B1C3F_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=C(C=C2)OC3CCCC3""",21,"""D18FDD707822A356"""
+"""2E1C290950D6BC86_7C4CF8513A8074EB_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""D18FDD707822A356"""
+"""99A86A64675DF403_09339A6340ACD05C_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""D18FDD707822A356"""
+"""A5A7E24F1954C86A_F6D45DEF97AD2EB1_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""D18FDD707822A356"""
+"""062F0FCCB9E0A60C_0153B41ABCD403AF_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""D18FDD707822A356"""
+"""D94D69DFE0D5A522_77589A0674B804C4_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""D18FDD707822A356"""
+"""40C7FDD7FC897F68_B2680B3CED5C6DBB_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""D18FDD707822A356"""
+"""573315CAC045CFDA_D80C3E1A126A66DB_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""D18FDD707822A356"""
+"""C861F6CB335A8A84_A9378C6F0361E828_6005_UN""","""FC(F)(F)C1=NN=C(O1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""D18FDD707822A356"""
+"""9A4D405C2FECA919_1BFC601AC128E16A_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""D18FDD707822A356"""
+"""B125A2F303163DFD_6E32F292FB847158_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""D18FDD707822A356"""
+"""E1BBB8BC34A25526_3DCEAACBC5F6D049_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(C=CC=C2)CN3CCCC3""",21,"""D18FDD707822A356"""
+"""30A686E13573A9E0_A51AFA4A794433F3_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""D18FDD707822A356"""
+"""A305D34715C527D6_AF1DD0492039D70E_6005_UN""","""FC(F)(F)C1=NN=C(O1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""D18FDD707822A356"""
+"""F40316B9356C7AF1_D2824FCDA4232F47_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""D3721E9955B8D69B"""
+"""2DCD9D950F9D863F_7DF5B7E15F3383BB_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""D3721E9955B8D69B"""
+"""74D88834DA5622E2_81F5C026C0D87491_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""D3721E9955B8D69B"""
+"""CBBE98C5F9EB041A_DDCF387053F44295_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""D3721E9955B8D69B"""
+"""AA9D63273C713AE5_EEE757B1D49AB43D_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""D3721E9955B8D69B"""
+"""74579CEA3C653FE9_2506B3C50CED40CE_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""D3721E9955B8D69B"""
+"""1464B2252B1D2276_FD6997C958295146_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=CC(=C2)COCCOC""",21,"""D3721E9955B8D69B"""
+"""5B1CA111439BF7D7_74041AC856955A2A_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""D3721E9955B8D69B"""
+"""265AB97969F4E317_6B1F0E2B61DFBD4F_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""D3721E9955B8D69B"""
+"""EB6FF559B94C9130_395EF61FEA6A1D63_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""D3721E9955B8D69B"""
+"""19AC8156E1C616B1_2CA7102B7117BC21_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""D3721E9955B8D69B"""
+"""FC9BD8B3387F5C5D_551C7F07862D805C_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""D3721E9955B8D69B"""
+"""163EF88376B1B0FC_4C385B05EE416FDC_6004_UN""","""NCCC1=C(C=NC=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""D3721E9955B8D69B"""
+"""74D68DDF3386D085_31CC04E76957DEB5_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""D3721E9955B8D69B"""
+"""BB54BF7B219EC00F_C611C825F8357D8E_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""D3721E9955B8D69B"""
+"""FEBC6D2C7A64C701_F136F0A10F5F7E3A_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""D3721E9955B8D69B"""
+"""4C87B4CF8218B58C_23FA0E2525505489_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""D3721E9955B8D69B"""
+"""5B36A83E1379801E_F32FC0ADD00A609A_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""D3721E9955B8D69B"""
+"""08312D517A4E6C71_DCBAF4E2C32D025F_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""D3721E9955B8D69B"""
+"""A5AB4777DDBD40E2_D9810A471F1DD076_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""D3721E9955B8D69B"""
+"""F2E8668C95B5F802_1C7AACB07F9D4C42_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""D3721E9955B8D69B"""
+"""CA4B310AA64BDFF3_0C563CE1A073F8B6_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""D3721E9955B8D69B"""
+"""D18AB6E5BA26640A_D14565D80ED00CCC_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""D3721E9955B8D69B"""
+"""4E70D50FDEB7B234_413681A2972D8619_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""D3721E9955B8D69B"""
+"""C2D47F75264867EA_64173111772248C2_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""D3721E9955B8D69B"""
+"""A114224861948242_02EA81505EABF9A2_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""D3721E9955B8D69B"""
+"""3DDD2104F11B9138_FF87E246A0E169F2_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""D3721E9955B8D69B"""
+"""6A5AAACF866BB70D_7EB13BB8171A0126_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""D3721E9955B8D69B"""
+"""22E5EF72386E0D8E_0BCE598A6D36A591_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""D3721E9955B8D69B"""
+"""79D8A6D3010AF74E_F4299E06BA375B7C_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""D3721E9955B8D69B"""
+"""854F6B750FD0F20B_03AE77F3914E7662_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""D3721E9955B8D69B"""
+"""3FABE6253A19B14B_75A559EF59227109_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""D3721E9955B8D69B"""
+"""C972DE7163620F2B_B095C8D5C0C61876_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""D3721E9955B8D69B"""
+"""0ECDC2E164D53295_DAF1FDF33FF01316_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""D3721E9955B8D69B"""
+"""7AE4BA26F4D39335_ABCA4F862EFB9DE5_6004_UN""","""NCCC1=C(C=NC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""D3721E9955B8D69B"""
+"""24B28A82246E0F7D_1901A3F3ECB294A7_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""D3721E9955B8D69B"""
+"""7EE1634586E607B2_6CCF317BD61E0495_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""D3721E9955B8D69B"""
+"""452A4F1F5CCD5DF8_3F336922E86CA584_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""D3721E9955B8D69B"""
+"""A8FCED6691D0ED7A_A7E739A354DE463E_6004_UN""","""NCCC1=C(C=NC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""D3721E9955B8D69B"""
+"""3F8D49BCD5F868C2_ADE013A00DA3A2C3_6004_UN""","""NCCC1=C(C=NC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""D3721E9955B8D69B"""
+"""EBA5E2945A39BEFF_D215A19CD654E496_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""D3E5F0C827CF1D4A"""
+"""E33B49434AC18047_7D6259B02D44486A_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""D3E5F0C827CF1D4A"""
+"""931EA8A8009E2407_81622E77B2AFBF40_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""D3E5F0C827CF1D4A"""
+"""8EB1E9B13D0B714D_DD58D62121838944_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""D3E5F0C827CF1D4A"""
+"""86868DA39C0BD385_EE70B9E0A6ED7FEC_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""D3E5F0C827CF1D4A"""
+"""4F729D4C55CD3DDA_25915D947E9A8B1F_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""D3E5F0C827CF1D4A"""
+"""2F5DCE05C6708274_FDFE79982A5E9A97_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=CC(=C2)COCCOC""",21,"""D3E5F0C827CF1D4A"""
+"""D1C6A32692808CFD_7493F49924E291FB_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""D3E5F0C827CF1D4A"""
+"""B0444AEB7D13C1FF_6B88E07A13A8769E_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""D3E5F0C827CF1D4A"""
+"""E4717B433763A247_39C9184E981DD6B2_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""D3E5F0C827CF1D4A"""
+"""BB9A15250B153D85_2C30FE7A036077F0_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""D3E5F0C827CF1D4A"""
+"""2B242EBDE711E69D_558B9156F45A4B8D_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""D3E5F0C827CF1D4A"""
+"""CB9D6823200E8B0C_4CAFB5549C36A40D_6005_UN""","""CCOC1=CC(=CC=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""D3E5F0C827CF1D4A"""
+"""183545B8A325C3EF_315BEAB61B201564_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""D3E5F0C827CF1D4A"""
+"""D861B0231EC88921_C68626748A42B65F_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""D3E5F0C827CF1D4A"""
+"""AEB25BF3AC6202E4_F1A11EF07D28B5EB_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""D3E5F0C827CF1D4A"""
+"""69926D97028868BB_236DE07457279F58_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""D3E5F0C827CF1D4A"""
+"""F239ACDAA4ED3EFF_F3B82EFCA27DAB4B_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""D3E5F0C827CF1D4A"""
+"""4526277F91AF66F3_DC2D1AB3B15AC98E_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""D3E5F0C827CF1D4A"""
+"""8E5B43AB544217C4_D916E4166D6A1BA7_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""D3E5F0C827CF1D4A"""
+"""4CFF9F073C54F595_1CED42E10DEA8793_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""D3E5F0C827CF1D4A"""
+"""2E8B7B2185BA710B_0CC1D2B0D2043367_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""D3E5F0C827CF1D4A"""
+"""86674827C5E9AB29_D1D28B897CA7C71D_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""D3E5F0C827CF1D4A"""
+"""CA650D89CFF51458_41A16FF3E55A4DC8_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""D3E5F0C827CF1D4A"""
+"""C612D70DCB408562_6480DF4005558313_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""D3E5F0C827CF1D4A"""
+"""6590D75EC3B69AC1_027D6F012CDC3273_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""D3E5F0C827CF1D4A"""
+"""9B7222A7DEC84B13_FF100C17D296A223_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""D3E5F0C827CF1D4A"""
+"""BA8EC1274F655329_7E26D5E9656DCAF7_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""D3E5F0C827CF1D4A"""
+"""0C4ABBB81389C515_0B59B7DB1F416E40_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""D3E5F0C827CF1D4A"""
+"""1B10A93992A68EA5_F4BE7057C84090AD_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""D3E5F0C827CF1D4A"""
+"""D71C074A5C9D0A10_033999A2E339BDB3_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""D3E5F0C827CF1D4A"""
+"""03F222B16C1FB0F4_7532B7BE2B55BAD8_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""D3E5F0C827CF1D4A"""
+"""096F643A25B545F5_B0022684B2B1D3A7_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""D3E5F0C827CF1D4A"""
+"""15E6138CB1BC9D42_DA6613A24D87D8C7_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""D3E5F0C827CF1D4A"""
+"""47FB40822C9B8E9A_AB5DA1D75C8C5634_6005_UN""","""CCOC1=CC(=CC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""D3E5F0C827CF1D4A"""
+"""99171CAEB7C14183_19964DA29EC55F76_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""D3E5F0C827CF1D4A"""
+"""E04F82CFB23FC40E_6C58DF2AA469CF44_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""D3E5F0C827CF1D4A"""
+"""F98C768555AE2E99_3FA487739A1B6E55_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""D3E5F0C827CF1D4A"""
+"""2166BCC7A47AFEE6_A770D7F226A98DEF_6005_UN""","""CCOC1=CC(=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""D3E5F0C827CF1D4A"""
+"""C1597639E0478461_AD77FDF17FD46912_6005_UN""","""CCOC1=CC(=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""D3E5F0C827CF1D4A"""
+"""47FB0245F5890954_D4C57D102D898601_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""D5352C44DC127FDD"""
+"""DC9C9CFA8290FE2C_7BB2853CD6992AFD_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""D5352C44DC127FDD"""
+"""18BE83E3DCD7F89B_87B2F2FB4972DDD7_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""D5352C44DC127FDD"""
+"""E86F88A058E9EAEA_DB880AADDA5EEBD3_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""D5352C44DC127FDD"""
+"""49D59B52C12341D5_E8A0656C5D301D7B_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""D5352C44DC127FDD"""
+"""7422580FA7EC6C89_234181188547E988_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""D5352C44DC127FDD"""
+"""08F9F1EAFD54336E_FB2EA514D183F800_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)COCCOC)N""",21,"""D5352C44DC127FDD"""
+"""612E24DEC0046FBC_72432815DF3FF36C_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""D5352C44DC127FDD"""
+"""091251303FA483C6_6D583CF6E8751409_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)OC(COC)C)N""",21,"""D5352C44DC127FDD"""
+"""3B59A52A918A90C3_3F19C4C263C0B425_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""D5352C44DC127FDD"""
+"""BB5DD331429E1BA0_2AE022F6F8BD1567_6005_UN""","""COC1=CC(=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""D5352C44DC127FDD"""
+"""0AD0022451C28368_535B4DDA0F87291A_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""D5352C44DC127FDD"""
+"""6DA533DC1084CE42_4A7F69D867EBC69A_6005_UN""","""COC1=CC(=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""D5352C44DC127FDD"""
+"""6DF9D1206335087B_378B363AE0FD77F3_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""D5352C44DC127FDD"""
+"""6659BC35E5C1D21C_C056FAF8719FD4C8_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""D5352C44DC127FDD"""
+"""EB1B9F81BA19BB4A_F771C27C86F5D77C_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""D5352C44DC127FDD"""
+"""D70D078733E8EBA6_25BD3CF8ACFAFDCF_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""D5352C44DC127FDD"""
+"""CE4D7F7462F652A9_F568F27059A0C9DC_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""D5352C44DC127FDD"""
+"""ADE85F503EED010F_DAFDC63F4A87AB19_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""D5352C44DC127FDD"""
+"""83021A67545F9778_DFC6389A96B77930_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""D5352C44DC127FDD"""
+"""33EA915B3D478A99_1A3D9E6DF637E504_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""D5352C44DC127FDD"""
+"""7FB440013DE7DA59_0A110E3C29D951F0_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""D5352C44DC127FDD"""
+"""82C265ABE438097D_D7025705877AA58A_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""D5352C44DC127FDD"""
+"""BCCB538E622D158D_4771B37F1E872F5F_6005_UN""","""COC1=CC(=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""D5352C44DC127FDD"""
+"""D5491EE42961DAD6_625003CCFE88E184_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""D5352C44DC127FDD"""
+"""ADCEBF8678E0DFEA_04ADB38DD70150E4_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(OCCC(C)C)C=C2)N""",21,"""D5352C44DC127FDD"""
+"""CFCC148DFDF19282_F9C0D09B294BC0B4_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)OC3CCCC3)N""",21,"""D5352C44DC127FDD"""
+"""E6109AF908E052C9_78F609659EB0A860_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=C(OC)C=C2)CN(C)C)N""",21,"""D5352C44DC127FDD"""
+"""B4402345D9E28EDD_0D896B57E49C0CD7_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)N""",21,"""D5352C44DC127FDD"""
+"""81E35FCD3ACEF320_F26EACDB339DF23A_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C)C=C(C=C2)OCC3CC3)N""",21,"""D5352C44DC127FDD"""
+"""39AA91DA67B5207F_05E9452E18E4DF24_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)N""",21,"""D5352C44DC127FDD"""
+"""29E586794743A1C3_73E26B32D088D84F_6005_UN""","""COC1=CC(=C(C=C1)C2=C(OCC(C)(C)C)N=CC=C2)N""",21,"""D5352C44DC127FDD"""
+"""CB4CE5F4CF786770_B6D2FA08496CB130_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)N""",21,"""D5352C44DC127FDD"""
+"""40564845D682A141_DCB6CF2EB65ABA50_6005_UN""","""COC1=CC(=C(C=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)N""",21,"""D5352C44DC127FDD"""
+"""5C745851F508E6F0_AD8D7D5BA75134A3_6005_UN""","""COC1=CC(=C(C=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)N""",21,"""D5352C44DC127FDD"""
+"""1A6B6B0C83BB8A73_1F46912E65183DE1_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)N""",21,"""D5352C44DC127FDD"""
+"""8BABD71936DAFB3A_6A8803A65FB4ADD3_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=CC=C2)C3=CC=NC=C3)N""",21,"""D5352C44DC127FDD"""
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+"""BB3C024216D7D358_78045618C7C17F93_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=C(OCC)C=C2)OCC""",21,"""D683FF60CD4A2AB3"""
+"""FD0C6C3EE04F9753_840421DF582A88B9_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=CC(=C2)OCCC(C)C""",21,"""D683FF60CD4A2AB3"""
+"""9B3B13455E4A222B_D83ED989CB06BEBD_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""D683FF60CD4A2AB3"""
+"""E570128E4EDE4D3B_EB16B6484C684815_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=C(C=C2)OC3CCOC3""",21,"""D683FF60CD4A2AB3"""
+"""2BBC4D41210C0BBE_20F7523C941FBCE6_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""D683FF60CD4A2AB3"""
+"""9C4DD0EE7EFB9010_F8987630C0DBAD6E_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=CC(=C2)COCCOC""",21,"""D683FF60CD4A2AB3"""
+"""F740DBD40E851BA7_71F5FB31CE67A602_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""D683FF60CD4A2AB3"""
+"""EED2871DFA8B25FB_6EEEEFD2F92D4167_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=CC(=C2)OC(COC)C""",21,"""D683FF60CD4A2AB3"""
+"""EB368120BD869E4D_3CAF17E67298E14B_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""D683FF60CD4A2AB3"""
+"""5446982E770DF3DD_2956F1D2E9E54009_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""D683FF60CD4A2AB3"""
+"""DE83F740707310F7_50ED9EFE1EDF7C74_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=CC=C2)CN3CCCC3""",21,"""D683FF60CD4A2AB3"""
+"""BE4CE62713240AE4_49C9BAFC76B393F4_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""D683FF60CD4A2AB3"""
+"""6EDB1618D2C42DD7_343DE51EF1A5229D_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=CC(=C2)OCCN(C)C""",21,"""D683FF60CD4A2AB3"""
+"""2DE4FE97363E1635_C3E029DC60C781A6_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""D683FF60CD4A2AB3"""
+"""7D05A1EEC573D3E5_F4C7115897AD8212_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""D683FF60CD4A2AB3"""
+"""2D956688A0BED12D_260BEFDCBDA2A8A1_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""D683FF60CD4A2AB3"""
+"""CC199F32A02BCA29_F6DE215448F89CB2_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""D683FF60CD4A2AB3"""
+"""3A68E4E3B1283D98_D94B151B5BDFFE77_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""D683FF60CD4A2AB3"""
+"""12176AC6739DD3D9_DC70EBBE87EF2C5E_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""D683FF60CD4A2AB3"""
+"""15D7A416762CAAE1_198B4D49E76FB06A_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""D683FF60CD4A2AB3"""
+"""1A75636CF060114D_09A7DD183881049E_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""D683FF60CD4A2AB3"""
+"""B0928851C95F2B53_D4B484219622F0E4_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""D683FF60CD4A2AB3"""
+"""8FE31BB793A8375C_44C7605B0FDF7A31_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""D683FF60CD4A2AB3"""
+"""95A0F3B7A1004078_61E6D0E8EFD0B4EA_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""D683FF60CD4A2AB3"""
+"""F0843E1F258B1A58_071B60A9C659058A_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=C(OCCC(C)C)C=C2""",21,"""D683FF60CD4A2AB3"""
+"""9F1E9FA9DB430A16_FA7603BF381395DA_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=C(C=C2)OC3CCCC3""",21,"""D683FF60CD4A2AB3"""
+"""F20B299DA02781AB_7B40DA418FE8FD0E_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""D683FF60CD4A2AB3"""
+"""66C461F460125238_0E3FB873F5C459B9_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""D683FF60CD4A2AB3"""
+"""691E9602E81F7E34_F1D87FFF22C5A754_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""D683FF60CD4A2AB3"""
+"""2EE72D7738EA234D_065F960A09BC8A4A_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""D683FF60CD4A2AB3"""
+"""2299DDF9BB673C7E_7054B816C1D08D21_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""D683FF60CD4A2AB3"""
+"""FD1D96A190DFB761_B564292C5834E45E_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""D683FF60CD4A2AB3"""
+"""066438EBAC04D5BF_DF001C0AA702EF3E_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""D683FF60CD4A2AB3"""
+"""C687689C8288C48F_AE3BAE7FB60961CD_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""D683FF60CD4A2AB3"""
+"""C2B55929858BC655_1CF0420A7440688F_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""D683FF60CD4A2AB3"""
+"""F66A36642DAE148B_693ED0824EECF8BD_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""D683FF60CD4A2AB3"""
+"""11842AB8AC2C4CC6_3AC288DB709E59AC_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(C=CC=C2)CN3CCCC3""",21,"""D683FF60CD4A2AB3"""
+"""B282332B109464C3_A216D85ACC2CBA16_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""D683FF60CD4A2AB3"""
+"""3C0D5C64AC97CA5B_A811F25995515EEB_6004_UN""","""N[S](=O)(=O)C1=CC=C(O1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""D683FF60CD4A2AB3"""
+"""56F03C35A36ACCE5_D774E8BEC8B89240_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=CC=C2)OC3CCCC3)CN""",21,"""D684B9EA39236B9C"""
+"""172C78C1D298BEB2_7803109233A83EBC_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=C(OCC)C=C2)OCC)CN""",21,"""D684B9EA39236B9C"""
+"""623E0D92074F97BF_84036755AC43C996_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=CC(=C2)OCCC(C)C)CN""",21,"""D684B9EA39236B9C"""
+"""D5BBC22C3EFD193D_D8399F033F6FFF92_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=C(C=C2)C[N]3C=CN=C3)CN""",21,"""D684B9EA39236B9C"""
+"""523A56F5D5CFB75C_EB11F0C2B801093A_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=C(C=C2)OC3CCOC3)CN""",21,"""D684B9EA39236B9C"""
+"""65C6F01F185A0279_20F014B66076FDC9_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=C(OC)C=C2)CN(C)C)CN""",21,"""D684B9EA39236B9C"""
+"""32D8BB6FD62A07F7_F89F30BA34B2EC41_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=CC(=C2)COCCOC)CN""",21,"""D684B9EA39236B9C"""
+"""A24D9984F632C4A9_71F2BDBB3A0EE72D_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=CC(=C2)CN(C)C3CC3)CN""",21,"""D684B9EA39236B9C"""
+"""D3CB6DA43C3478B5_6EE9A9580D440048_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=CC(=C2)OC(COC)C)CN""",21,"""D684B9EA39236B9C"""
+"""993CC77878348A8A_3CA8516C86F1A064_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=C(C(NOC)=O)C=C2)F)CN""",21,"""D684B9EA39236B9C"""
+"""6E14C34C4104B40F_2951B7581D8C0126_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(OC)N=C(C=C2)C(F)(F)F)CN""",21,"""D684B9EA39236B9C"""
+"""F90F13B324BFA939_50EAD874EAB63D5B_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=CC=C2)CN3CCCC3)CN""",21,"""D684B9EA39236B9C"""
+"""09AA64C3810F9F35_49CEFC7682DAD2DB_6004_UN""","""CC[N]1C(=C(N=N1)C3=CC=C([N]2C=C(C)C=N2)C=C3)CN""",21,"""D684B9EA39236B9C"""
+"""AC26BFD78B5A9F9C_343AA39405CC63B2_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=CC(=C2)OCCN(C)C)CN""",21,"""D684B9EA39236B9C"""
+"""2A9EAE3414E96FD0_C3E76F5694AEC089_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(C=C(C(C)C)C=C2)C(C)C)CN""",21,"""D684B9EA39236B9C"""
+"""17ACBCA8FBA14C69_F4C057D263C4C33D_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=C(C=C2)C3=CC=CC=C3)CN""",21,"""D684B9EA39236B9C"""
+"""851DB4FDCDFD4D7D_260CA95649CBE98E_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(C=CC=C2F)OC(F)(F)F)CN""",21,"""D684B9EA39236B9C"""
+"""E8C65FCAC7ECEA6F_F6D967DEBC91DD9D_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)CN""",21,"""D684B9EA39236B9C"""
+"""30523FE001242517_D94C5391AFB6BF58_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(C=C(OC)C=C2)C(F)(F)F)CN""",21,"""D684B9EA39236B9C"""
+"""7F6D244120268031_DC77AD3473866D71_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=CC(=C2F)C(N(C)C)=O)CN""",21,"""D684B9EA39236B9C"""
+"""5E70AA55BA443028_198C0BC31306F145_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=C(OC)C=C2)C(F)(F)F)CN""",21,"""D684B9EA39236B9C"""
+"""0B966D79536D4F4F_09A09B92CCE845B1_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)CN""",21,"""D684B9EA39236B9C"""
+"""83D86A0C6CCB080F_D4B3C2AB624BB1CB_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=CC=C2)C3=CC=CC=C3)CN""",21,"""D684B9EA39236B9C"""
+"""BFC9BBEAF8BB5AEC_44C026D1FBB63B1E_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(OC)C=C(C=C2)C(F)(F)F)CN""",21,"""D684B9EA39236B9C"""
+"""3383942FD1E4F19A_61E196621BB9F5C5_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(C)C=C(C=C2)OC(F)(F)F)CN""",21,"""D684B9EA39236B9C"""
+"""11CFE05D8BAF8E60_071C2623323044A5_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=C(OCCC(C)C)C=C2)CN""",21,"""D684B9EA39236B9C"""
+"""1698AD2B9C446F33_FA714535CC7AD4F5_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=C(C=C2)OC3CCCC3)CN""",21,"""D684B9EA39236B9C"""
+"""1768081F6626B33F_7B479CCB7B81BC21_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(C=C(OC)C=C2)CN(C)C)CN""",21,"""D684B9EA39236B9C"""
+"""A7CBC1EE542F841F_0E38FEF901AD1896_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=C(N=C2)C(F)(F)F)OC)CN""",21,"""D684B9EA39236B9C"""
+"""3EA6DAC3A9C67794_F1DF3975D6ACE67B_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(C)C=C(C=C2)OCC3CC3)CN""",21,"""D684B9EA39236B9C"""
+"""D82039057A111073_0658D080FDD5CB65_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(C=CC(=C2)C3(CC3)C#N)F)CN""",21,"""D684B9EA39236B9C"""
+"""5A89C7C740411F48_7053FE9C35B9CC0E_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(OCC(C)(C)C)N=CC=C2)CN""",21,"""D684B9EA39236B9C"""
+"""A5D51ED69C71E70B_B5636FA6AC5DA571_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC=C(C=C2)C[N]3C=NC=N3)CN""",21,"""D684B9EA39236B9C"""
+"""73ABBF6320195B76_DF075A80536BAE11_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(OCC)C=CC(=C2)[N](=O)=O)CN""",21,"""D684B9EA39236B9C"""
+"""79CB236096D6BFC2_AE3CE8F5426020E2_6004_UN""","""CC[N]1C(=C(N=N1)C3=CC2=C(C=C(OC)C=C2)C=C3)CN""",21,"""D684B9EA39236B9C"""
+"""00EE6AF2CADE315D_1CF70480802929A0_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=C(C=C2C3CC3)Cl)OC)CN""",21,"""D684B9EA39236B9C"""
+"""C426AC2E0139A4C9_69399608BA85B992_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=CC=C2)C3=CC=NC=C3)CN""",21,"""D684B9EA39236B9C"""
+"""9A8ED5C26DA965F3_3AC5CE5184F71883_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(C=CC=C2)CN3CCCC3)CN""",21,"""D684B9EA39236B9C"""
+"""BDE6830DF07D0FE3_A2119ED03845FB39_6004_UN""","""CC[N]1C(=C(N=N1)C2=CC(=N[N]2C3CCCCO3)C)CN""",21,"""D684B9EA39236B9C"""
+"""876203D86EDC6283_A816B4D361381FC4_6004_UN""","""CC[N]1C(=C(N=N1)C2=C(C=C(C=C2)OC(F)(F)F)F)CN""",21,"""D684B9EA39236B9C"""
+"""61C4EAA484CF5FD1_5C46D98CE83DD467_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CN=C(OC)C=C2""",21,"""D77D21F643D1D300"""
+"""E6B90F4391CD4ADD_5E97BBED1AEE2156_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CC(=C(N=C2)O)C""",21,"""D77D21F643D1D300"""
+"""E524A619E7F08AB5_829170736A8BFD1A_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C=CC=C2F)F""",21,"""D77D21F643D1D300"""
+"""B207D2FB4D76E071_AEB67534A90AB93F_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C=CC(=C2)C)C""",21,"""D77D21F643D1D300"""
+"""17573A289D26F73C_F863DBB49F8F5BC3_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CC=C(SC)C=C2""",21,"""D77D21F643D1D300"""
+"""E9DCAFFA2AB2A8DB_1F8C8D75B119AC27_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C(=CC=C2)Cl)Cl""",21,"""D77D21F643D1D300"""
+"""907D07C046110415_A80A5BF5024F79CB_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(N=C(C=C2)O)F""",21,"""D77D21F643D1D300"""
+"""6644DB64952B9F8E_EFB9AFFC3471C275_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C)C=NC(=C2)F""",21,"""D77D21F643D1D300"""
+"""62FF8BF30C3D78AE_85DCE04EB284F979_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)F)F""",21,"""D77D21F643D1D300"""
+"""7B19D3AA790C6FE1_AC65A154146777AF_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CC(=C(C)C=C2)C""",21,"""D77D21F643D1D300"""
+"""C19B735D93CD08D5_7C77C62D60E4ADC3_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(SC)C=CC=C2""",21,"""D77D21F643D1D300"""
+"""27341068497D677D_D60CD489A8A62F57_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C)C=CC=C2C""",21,"""D77D21F643D1D300"""
+"""03A10BB3AD7E550B_597C6062B118ED9E_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C)C(=NC=C2)F""",21,"""D77D21F643D1D300"""
+"""29BD7B1C790940C7_66F5E5D27BB86346_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CSC=C2C(F)F""",21,"""D77D21F643D1D300"""
+"""5375F906CCBFACFA_4574F4852158A121_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C(=CC=C2)Cl)F""",21,"""D77D21F643D1D300"""
+"""8260ABDFE5FF76A2_8076A71ABC2D5A54_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)F)Cl""",21,"""D77D21F643D1D300"""
+"""D8DE665221F048FE_C19CD41D63BF4C62_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)CF""",21,"""D77D21F643D1D300"""
+"""877FDD7E469C5E56_D0A0FED73B035016_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CF""",21,"""D77D21F643D1D300"""
+"""0CF5A5105D1CEC79_B782A153DA92EFA0_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C)C=C(C=C2)F""",21,"""D77D21F643D1D300"""
+"""42E8D69A170217F2_04FC85AC66A1A9E3_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(CC)C=CC=C2""",21,"""D77D21F643D1D300"""
+"""B587B8B39D7F06AE_D6B86B85D48CED3F_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C=CC(=C2)F)F""",21,"""D77D21F643D1D300"""
+"""36396AB96505BF33_7B38B0D188A14FC0_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(OC)N=CC=C2""",21,"""D77D21F643D1D300"""
+"""E0FE5FB9CFD4668C_1687DB368C034D56_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CC(=NC=C2)OC""",21,"""D77D21F643D1D300"""
+"""E8DB0451444D76E7_71261067170FB686_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C=C(C)C=C2)F""",21,"""D77D21F643D1D300"""
+"""67705246BD7A5297_5A307757699F45DB_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C(=CC=C2)Br)F""",21,"""D77D21F643D1D300"""
+"""4BEED8A94B8E1489_4EF72018AD74A598_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C=C(C)C=C2)C""",21,"""D77D21F643D1D300"""
+"""D75F0E7A4EDB28A3_F68856EB38ED9B09_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CC=CC(=C2)CC""",21,"""D77D21F643D1D300"""
+"""45AC4995A44AEB0C_34900AB6E735B784_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C([N](C)N=C2)C#N""",21,"""D77D21F643D1D300"""
+"""27081E26E5438DB0_D2B68F8D87997D1B_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=C(C)C=CC(=C2)F""",21,"""D77D21F643D1D300"""
+"""37529322B8DB0058_D73D064D02842D87_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)F""",21,"""D77D21F643D1D300"""
+"""2ECC1A9761111FB1_CB00ED486E75D476_6006_UN""","""CC(C)CCC(=O)C1=CC=C(C=C1)C2=CN=C(NC)C=C2""",21,"""D77D21F643D1D300"""
+"""C729B8E8138B09A3_77783113A6B1DA27_2201_UN""","""CC(C)CC1=CC3=C(N=C1C2=CC=C(C=C2)Cl)N=CC=C3""",21,"""D77D21F643D1D300"""
+"""ECF38744C59D4D7E_C1E5CC38C2C60DCE_2201_UN""","""CC(C)CC1=CC3=C(N=C1C2=CC=C(C=C2)Cl)C=CN=C3""",21,"""D77D21F643D1D300"""
+"""B1D629CE0E4B355E_1BA984BDB119F4BD_2201_UN""","""CC(C)CC2=C(C)C1=NON=C1N=C2C3=CC=C(C=C3)Cl""",21,"""D77D21F643D1D300"""
+"""6464A59EB716D119_F64DB5F75C3EB584_2201_UN""","""CC(C)CC2=C(C)C1=C(SC=C1)N=C2C3=CC=C(C=C3)Cl""",21,"""D77D21F643D1D300"""
+"""78835A683B762D23_FE704F48BF4E246A_2201_UN""","""CC(C)CC2=CC1=C([N](C)N=C1)N=C2C3=CC=C(C=C3)Cl""",21,"""D77D21F643D1D300"""
+"""3C77F0F7347667B8_02F7920758DFDABF_2201_UN""","""CC(C)CC1=CC3=C(N=C1C2=CC=C(C=C2)Cl)C=NC=C3""",21,"""D77D21F643D1D300"""
+"""0545ECF2F2EE0B76_DDA84FFF9750BAA8_2201_UN""","""CC(C)CC2=CC1=C(ON=C1C)N=C2C3=CC=C(C=C3)Cl""",21,"""D77D21F643D1D300"""
+"""CDFD208EA3E4CC2A_9B768D8C8BAC9967_2201_UN""","""CC(C)CC2=CC1=C(C)[NH]N=C1N=C2C3=CC=C(C=C3)Cl""",21,"""D77D21F643D1D300"""
+"""769113C436B2F096_09D01E39C185DB84_2201_UN""","""CC(C)CC1=CC3=C(N=C1C2=CC=C(C=C2)Cl)N=CN=C3""",21,"""D77D21F643D1D300"""
+"""58518B3A2DD92459_2931C864E16A2A99_6036_UN""","""CCC1CCC(CC1)NCCN([S](CCN)(=O)=O)C2CC2""",21,"""D7F9B68B3F914781"""
+"""3BFFDF59F863AFC9_B24818EE4CC92537_6036_UN""","""CCC1CCC(CC1)NCCN(C(C)C)[S](=O)(=O)CCN""",21,"""D7F9B68B3F914781"""
+"""C2220F0FDEDB3DD0_E5C7F45BA289066B_6036_UN""","""CCC1CCC(CC1)NCCN([S](C)(=O)=O)CCN=C=S""",21,"""D7F9B68B3F914781"""
+"""78BA54A74C242616_F8D1F5E3EC217FA3_6036_UN""","""CCC1CCC(CC1)NCCN([S](CC)(=O)=O)CCCN""",21,"""D7F9B68B3F914781"""
+"""8A8731AD52658303_720E500E1AF54A82_6036_UN""","""CCC1CCC(CC1)NCCN([S](C)(=O)=O)C2CC(C2)N""",21,"""D7F9B68B3F914781"""
+"""FE29A1E5260103F1_34D458092AC0C803_6036_UN""","""CCC1CCC(CC1)NCCN(CCCN)[S](=O)(=O)CCl""",21,"""D7F9B68B3F914781"""
+"""4F3B9E27B7873872_C135D44FF8525D42_6036_UN""","""CCC1CCC(CC1)NCCN(C)[S](=O)(=O)C2CNCC2""",21,"""D7F9B68B3F914781"""
+"""E6255CF9DA7E0DED_7F6DDF5847BDF886_6036_UN""","""CCC1CCC(CC1)NCCN([S](CC)(=O)=O)CCCBr""",21,"""D7F9B68B3F914781"""
+"""D1D9FF412703A7DB_CBB75E58E2B37B08_6036_UN""","""CCC1CCC(CC1)NCCN(CCCNC)[S](=O)(=O)C""",21,"""D7F9B68B3F914781"""
+"""393A76501FC53FDD_2EDA563E6B7A6150_6036_UN""","""CCC1CCC(CC1)NCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""D7F9B68B3F914781"""
+"""D11C723002C5097F_7C913C253745B298_6036_UN""","""CCC1CCC(CC1)NCCN([S](=O)(=O)CC#N)C2CC2""",21,"""D7F9B68B3F914781"""
+"""29FD3037336AE96D_FF455753DFE3F08F_6036_UN""","""CCC1CCC(CC1)NCCN([S](C)(=O)=O)C(=O)CCN""",21,"""D7F9B68B3F914781"""
+"""574F1DF10659CC94_394300A33BBD447C_6036_UN""","""CCC1CCC(CC1)NCCN(C)[S](=O)(=O)C2=CC=CS2""",21,"""D7F9B68B3F914781"""
+"""5395576965025EEE_9BE55D3A2BF2563D_6036_UN""","""CCC1CCC(CC1)NCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""D7F9B68B3F914781"""
+"""664C389670E41FBF_56820673F4BC7662_6036_UN""","""CCC1CCC(CC1)NCCN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""D7F9B68B3F914781"""
+"""545FA35601AD1597_A2FFA9C43BBC26CB_6036_UN""","""CCC1CCC(CC1)NCCN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""D7F9B68B3F914781"""
+"""4A9E102773DE2087_A80B4EC4A7C71ECD_6036_UN""","""CCC1CCC(CC1)NCCN(CC(CC)N)[S](=O)(=O)C""",21,"""D7F9B68B3F914781"""
+"""E7B0C387AE8234CE_AA251BE5A5CCAEE6_6036_UN""","""CCC1CCC(CC1)NCCN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""D7F9B68B3F914781"""
+"""C11ADAD00D0C0943_39E704A97F347502_6036_UN""","""CCC1CCC(CC1)NCCN([S](C)(=O)=O)CCN=[N]#N""",21,"""D7F9B68B3F914781"""
+"""1369B2ACA60397E3_E956330F79497126_6036_UN""","""CCC1CCC(CC1)NCCN(CC(C)(C)N)[S](=O)(=O)C""",21,"""D7F9B68B3F914781"""
+"""04E49C71394CC047_A35954BEEE87F6AB_6036_UN""","""CCC1CCC(CC1)NCCN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""D7F9B68B3F914781"""
+"""2CFCA243C5EFECAE_4F64CADCE4AD52A4_6036_UN""","""CCC1CCC(CC1)NCCN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""D7F9B68B3F914781"""
+"""F832F2170744265B_46897EB84FF87F1E_6036_UN""","""CCC1CCC(CC1)NCCN([S](=O)(=O)C2CC2)CC#C""",21,"""D7F9B68B3F914781"""
+"""AF7EFF266ACED79A_12896433A8F6BAD8_6036_UN""","""CCC1CCC(CC1)NCCN2[S](=O)(=O)C3(CCC2)CC3""",21,"""D7F9B68B3F914781"""
+"""047B05478F67E526_3AE22BCE8DF2F630_6036_UN""","""CCC1CCC(CC1)NCCN2CCCC(C)(C)[S]2(=O)=O""",21,"""D7F9B68B3F914781"""
+"""4CB1751C0D4D0652_F1CBD09A04343D23_6036_UN""","""CCC1CCC(CC1)NCCN2CCCC(CC)[S]2(=O)=O""",21,"""D7F9B68B3F914781"""
+"""AA35CCD4D4C17AC8_C0A2A040618D8B8C_6036_UN""","""CCC1CCC(CC1)NCCN2C(C(N)CC[S]2(=O)=O)=O""",21,"""D7F9B68B3F914781"""
+"""E6D41E647419BFBF_1FBCC7EE1B85B2A2_6036_UN""","""CCC1CCC(CC1)NCCN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""D7F9B68B3F914781"""
+"""E3A83A3FD3088E62_B4840977CF152F8E_6036_UN""","""CCC1CCC(CC1)NCCN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""D7F9B68B3F914781"""
+"""69029FE74B05EAC7_F4E8B927CA2FF630_6036_UN""","""CCC1CCC(CC1)NCCN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""D7F9B68B3F914781"""
+"""14E6B1B0CBB25AE4_5CA723F33132E958_6036_UN""","""CCC1CCC(CC1)NCCN2[S](CCN(C)CC2)(=O)=O""",21,"""D7F9B68B3F914781"""
+"""D99C6C7EC012FEBB_D030057E599B02BB_6036_UN""","""CCC1CCC(CC1)NCCN2CC(=O)NCC[S]2(=O)=O""",21,"""D7F9B68B3F914781"""
+"""D1DF61100783B40A_85CB1877F43EC52F_6036_UN""","""CCC1CCC(CC1)NCCN2[S](CCCCC2C)(=O)=O""",21,"""D7F9B68B3F914781"""
+"""FE6945C27C01983F_FF635DBB5ADE2AD1_6036_UN""","""CCC1CCC(CC1)NCCN(CCN)[S](=O)(=O)C2CC2""",21,"""D7F9B68B3F914781"""
+"""4D2A042FD01A2006_99997B7AFEF2B826_6036_UN""","""CCC1CCC(CC1)NCCN(CCN)[S](=O)(=O)C(F)F""",21,"""D7F9B68B3F914781"""
+"""380BEF26540D359A_399CE71FC0F946C4_6036_UN""","""CCC1CCC(CC1)NCCN([S](CC)(=O)=O)C2CNC2""",21,"""D7F9B68B3F914781"""
+"""976328C15408896E_0B053323571012B9_6036_DP""","""CCC1CCC(CC1)NCCN3CC2(CNC2)C[S]3(=O)=O""",21,"""D7F9B68B3F914781"""
+"""08F958A26A4C8C1D_B1704AB18ED356D3_6036_UN""","""CCC1CCC(CC1)NCCN(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""D7F9B68B3F914781"""
+"""AD8243CBFE8718E4_4D9BD2E187B14663_6036_UN""","""CCC1CCC(CC1)NCCN(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""D7F9B68B3F914781"""
+"""C4BF212F5FC7E96F_73FAB5564A8F8EF8_6036_UN""","""CCC1CCC(CC1)NCCN(C(C)(C)CN)[S](=O)(=O)C""",21,"""D7F9B68B3F914781"""
+"""41049D14DACE772C_D8C82E0FE3E319E8_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=CC=C2)OC3CCCC3)N""",21,"""D9387F5B1278E034"""
+"""AD44357A9CE94530_77BFD62318F3B514_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=C(OCC)C=C2)OCC)N""",21,"""D9387F5B1278E034"""
+"""6333A25443579A72_8BBFA1E48718423E_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=CC(=C2)OCCC(C)C)N""",21,"""D9387F5B1278E034"""
+"""59F6E578C7423728_D78559B21434743A_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""D9387F5B1278E034"""
+"""057406E43E396189_E4AD3673935A8292_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=C(C=C2)OC3CCOC3)N""",21,"""D9387F5B1278E034"""
+"""778A2B214F90F330_2F4CD2074B2D7661_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""D9387F5B1278E034"""
+"""D8B681A125A150F8_F723F60B1FE967E9_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=CC(=C2)COCCOC)N""",21,"""D9387F5B1278E034"""
+"""FE7AD7BBA5F67719_7E4E7B0A11556C85_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""D9387F5B1278E034"""
+"""0079E4B1B077F770_61556FE9261F8BE0_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=CC(=C2)OC(COC)C)N""",21,"""D9387F5B1278E034"""
+"""923D0842CAF7FD95_331497DDADAA2BCC_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""D9387F5B1278E034"""
+"""514C4B42FDB96242_26ED71E936D78A8E_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""D9387F5B1278E034"""
+"""B1D95719886FC197_5F561EC5C1EDB6F3_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=CC=C2)CN3CCCC3)N""",21,"""D9387F5B1278E034"""
+"""8DD42D748D0C8452_46723AC7A9815973_6005_UN""","""CC1=C(C=CC(=C1C)C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""D9387F5B1278E034"""
+"""B775A9C5B37ABCEF_3B8665252E97E81A_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=CC(=C2)OCCN(C)C)N""",21,"""D9387F5B1278E034"""
+"""3CF05AE7D2CF1508_CC5BA9E7BFF54B21_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""D9387F5B1278E034"""
+"""571A8B6BC6826283_FB7C9163489F4895_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""D9387F5B1278E034"""
+"""7BF2CBFBB86A4170_29B06FE762906226_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""D9387F5B1278E034"""
+"""EBDEC04FBAC80351_F965A16F97CA5635_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""D9387F5B1278E034"""
+"""E309FCDD0C02764B_D6F0952084ED34F0_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""D9387F5B1278E034"""
+"""5E5F2DE0712DBB7C_D3CB6B8558DDE6D9_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""D9387F5B1278E034"""
+"""9C7F64704928A027_1630CD72385D7AED_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""D9387F5B1278E034"""
+"""5346F1ADB6402EDB_061C5D23E7B3CE19_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""D9387F5B1278E034"""
+"""9B8657468720EF4F_DB0F041A49103A63_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""D9387F5B1278E034"""
+"""22D76FE7954BBF2C_4B7CE060D0EDB0B6_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""D9387F5B1278E034"""
+"""A3D15B55152C4EA8_6E5D50D330E27E6D_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""D9387F5B1278E034"""
+"""D57F9A2993C9389C_08A0E092196BCF0D_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=C(OCCC(C)C)C=C2)N""",21,"""D9387F5B1278E034"""
+"""5053EA19345BF8B5_F5CD8384E7215F5D_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=C(C=C2)OC3CCCC3)N""",21,"""D9387F5B1278E034"""
+"""8B2AB9195F1C2DF8_74FB5A7A50DA3789_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(C=C(OC)C=C2)CN(C)C)N""",21,"""D9387F5B1278E034"""
+"""81C4731B14644528_018438482AF6933E_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=C(N=C2)C(F)(F)F)OC)N""",21,"""D9387F5B1278E034"""
+"""2666AE3180E37D3B_FE63FFC4FDF76DD3_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(C)C=C(C=C2)OCC3CC3)N""",21,"""D9387F5B1278E034"""
+"""A59EC93436077C80_09E41631D68E40CD_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(C=CC(=C2)C3(CC3)C#N)F)N""",21,"""D9387F5B1278E034"""
+"""9E73A7591AA61015_7FEF382D1EE247A6_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(OCC(C)(C)C)N=CC=C2)N""",21,"""D9387F5B1278E034"""
+"""394515AEAE7D7353_BADFA91787062ED9_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC=C(C=C2)C[N]3C=NC=N3)N""",21,"""D9387F5B1278E034"""
+"""427FCFDA99C56BD8_D0BB9C31783025B9_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(OCC)C=CC(=C2)[N](=O)=O)N""",21,"""D9387F5B1278E034"""
+"""FFFB8E01AB4290BE_A1802E44693BAB4A_6005_UN""","""CC1=C(C=CC(=C1C)C3=CC2=C(C=C(OC)C=C2)C=C3)N""",21,"""D9387F5B1278E034"""
+"""A91BE74E67B68876_134BC231AB72A208_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=C(C=C2C3CC3)Cl)OC)N""",21,"""D9387F5B1278E034"""
+"""6A68F8E0301D672E_668550B991DE323A_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=CC=C2)C3=CC=NC=C3)N""",21,"""D9387F5B1278E034"""
+"""9EC68606F3BAA409_357908E0AFAC932B_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(C=CC=C2)CN3CCCC3)N""",21,"""D9387F5B1278E034"""
+"""2DCC96E90B20AB7B_ADAD5861131E7091_6005_UN""","""CC1=C(C=CC(=C1C)C2=CC(=N[N]2C3CCCCO3)C)N""",21,"""D9387F5B1278E034"""
+"""4AD4A4E30F96DFCD_A7AA72624A63946C_6005_UN""","""CC1=C(C=CC(=C1C)C2=C(C=C(C=C2)OC(F)(F)F)F)N""",21,"""D9387F5B1278E034"""
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+"""7CFF00EA668F7E30_D7D61938B521E088_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""D96B3FD1B36D7486"""
+"""167B4F0E9C4C0694_E4FE76F9324F1620_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""D96B3FD1B36D7486"""
+"""8FF1794C3BE9B90E_2F1F928DEA38E2D3_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""D96B3FD1B36D7486"""
+"""0B0509988DDBB398_F770B681BEFCF35B_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=CC(=C2)COCCOC""",21,"""D96B3FD1B36D7486"""
+"""2694C2E315AD1E9E_7E1D3B80B040F837_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""D96B3FD1B36D7486"""
+"""C53D226D12C5FE9F_61062F63870A1F52_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=CC(=C2)OC(COC)C""",21,"""D96B3FD1B36D7486"""
+"""77670280029EB8C7_3347D7570CBFBF7E_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""D96B3FD1B36D7486"""
+"""FD438A853D0F8E56_26BE316397C21E3C_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""D96B3FD1B36D7486"""
+"""70E6C2148DB4317C_5F055E4F60F82241_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""D96B3FD1B36D7486"""
+"""87582E2015A57819_46217A4D0894CDC1_6004_UN""","""NC(=N)C1=NC(=CC=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""D96B3FD1B36D7486"""
+"""AFDB52D7BAC16D76_3BD525AF8F827CA8_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=CC(=C2)OCCN(C)C""",21,"""D96B3FD1B36D7486"""
+"""080884AC9A6F19F3_CC08E96D1EE0DF93_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""D96B3FD1B36D7486"""
+"""6A271D781E2DC2E9_FB2FD1E9E98ADC27_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""D96B3FD1B36D7486"""
+"""A8DAE178EF791A0C_29E32F6DC385F694_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""D96B3FD1B36D7486"""
+"""3855BBE01BF96298_F936E1E536DFC287_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""D96B3FD1B36D7486"""
+"""29926F7E20E22D5E_D6A3D5AA25F8A042_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""D96B3FD1B36D7486"""
+"""EF37F033EC5C9A8E_D3982B0FF9C8726B_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""D96B3FD1B36D7486"""
+"""456555081B8DCF0B_16638DF89948EE5F_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""D96B3FD1B36D7486"""
+"""8CB7C970A481E8BB_064F1DA946A65AAB_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""D96B3FD1B36D7486"""
+"""D0DFC5EE3280EF81_DB5C4490E805AED1_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""D96B3FD1B36D7486"""
+"""6FA10B582556EC36_4B2FA0EA71F82404_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""D96B3FD1B36D7486"""
+"""B7E2EC14424137F7_6E0E105991F7EADF_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""D96B3FD1B36D7486"""
+"""67333E1DEBAF18F4_08F3A018B87E5BBF_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=C(OCCC(C)C)C=C2""",21,"""D96B3FD1B36D7486"""
+"""A9BC6E785C899803_F59EC30E4634CBEF_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=C(C=C2)OC3CCCC3""",21,"""D96B3FD1B36D7486"""
+"""BB50754897C692A1_74A81AF0F1CFA33B_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""D96B3FD1B36D7486"""
+"""8AE9EF6752948E49_01D778C28BE3078C_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""D96B3FD1B36D7486"""
+"""F166913A111F10B4_FE30BF4E5CE2F961_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""D96B3FD1B36D7486"""
+"""3E27813CC02131C0_09B756BB779BD47F_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""D96B3FD1B36D7486"""
+"""ACC9AC7798AA4AD6_7FBC78A7BFF7D314_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""D96B3FD1B36D7486"""
+"""D0722F3F53C80EDA_BA8CE99D2613BA6B_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""D96B3FD1B36D7486"""
+"""35B5518A22E85C74_D0E8DCBBD925B10B_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""D96B3FD1B36D7486"""
+"""5C20DA9A348185D3_A1D36ECEC82E3FF8_6004_UN""","""NC(=N)C1=NC(=CC=C1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""D96B3FD1B36D7486"""
+"""E63A51370F1B8DCD_131882BB0A6736BA_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""D96B3FD1B36D7486"""
+"""A707C2A6906500AE_66D6103330CBA688_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""D96B3FD1B36D7486"""
+"""BAF9AFF2385CA12A_352A486A0EB90799_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""D96B3FD1B36D7486"""
+"""C4E95A5AB93C568A_ADFE18EBB20BE423_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""D96B3FD1B36D7486"""
+"""2BE1738F17385D7F_A7F932E8EB7600DE_6004_UN""","""NC(=N)C1=NC(=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""D96B3FD1B36D7486"""
+"""60976C27CCDD1CA3_DBF5D61996BF035D_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""DA05874D6724FA81"""
+"""9E2370EE892C86CF_74822E356DAFAFA1_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""DA05874D6724FA81"""
+"""417D5C49D869C98B_888259F2F244588B_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""DA05874D6724FA81"""
+"""120B92F94CE67221_D4B8A1A461686E8F_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""DA05874D6724FA81"""
+"""B6BCA272781FA968_E790CE65E6069827_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""DA05874D6724FA81"""
+"""40FD427ED56B4A1D_2C712A113E716CD4_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""DA05874D6724FA81"""
+"""FA3645C12F2C8347_F41E0E1D6AB57D5C_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=CC(=C2)COCCOC""",21,"""DA05874D6724FA81"""
+"""8FE55B3BC2FC3EA9_7D73831C64097630_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""DA05874D6724FA81"""
+"""D7E0D97BC13B5693_626897FF53439155_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""DA05874D6724FA81"""
+"""E06EB7DD2DC34A3A_30296FCBD8F63179_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""DA05874D6724FA81"""
+"""FD1D4CC46A9AF3FD_25D089FF438B903B_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""DA05874D6724FA81"""
+"""039A2B81F9831FF6_5C6BE6D3B4B1AC46_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""DA05874D6724FA81"""
+"""4C995AB5C7733F89_454FC2D1DCDD43C6_6005_UN""","""COC1=NC=C(C(=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""DA05874D6724FA81"""
+"""3C625010EFA687C2_38BB9D335BCBF2AF_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""DA05874D6724FA81"""
+"""1AA2CF067E3977C2_CF6651F1CAA95194_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""DA05874D6724FA81"""
+"""156281D3312489DF_F84169753DC35220_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""DA05874D6724FA81"""
+"""6FD22C53D8138F37_2A8D97F117CC7893_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""DA05874D6724FA81"""
+"""E30F00556E72E747_FA585979E2964C80_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""DA05874D6724FA81"""
+"""D54AD349D8E810E5_D5CD6D36F1B12E45_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""DA05874D6724FA81"""
+"""315408CBC0BC1F7C_D0F693932D81FC6C_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""DA05874D6724FA81"""
+"""5D35B2C05EB63508_150D35644D016058_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""DA05874D6724FA81"""
+"""96C58F4EDD0D7ED1_0521A53592EFD4AC_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""DA05874D6724FA81"""
+"""2E5B8B12D61FF526_D832FC0C3C4C20D6_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""DA05874D6724FA81"""
+"""2F1A60A5A1753A34_48411876A5B1AA03_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""DA05874D6724FA81"""
+"""0DCE53E69BCAAB30_6D60A8C545BE64D8_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""DA05874D6724FA81"""
+"""D45C289DD1F19CE0_0B9D18846C37D5B8_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""DA05874D6724FA81"""
+"""3B1B0525B383CA42_F6F07B92927D45E8_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""DA05874D6724FA81"""
+"""5B330DAA807DFBFE_77C6A26C25862D3C_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""DA05874D6724FA81"""
+"""4D59D81C3019B66B_02B9C05E5FAA898B_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""DA05874D6724FA81"""
+"""6538658E30A2A886_FD5E07D288AB7766_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""DA05874D6724FA81"""
+"""B802F081085BA138_0AD9EE27A3D25A78_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""DA05874D6724FA81"""
+"""155DDB4BD0721149_7CD2C03B6BBE5D13_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""DA05874D6724FA81"""
+"""15DC2A9666E26FF2_B9E25101F25A346C_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""DA05874D6724FA81"""
+"""A857598C28721ADB_D38664270D6C3F0C_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""DA05874D6724FA81"""
+"""95A420CF9ABD6991_A2BDD6521C67B1FF_6005_UN""","""COC1=NC=C(C(=C1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""DA05874D6724FA81"""
+"""86B08FAD4B607943_10763A27DE2EB8BD_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""DA05874D6724FA81"""
+"""8F12A16236A11DA9_65B8A8AFE482288F_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""DA05874D6724FA81"""
+"""FF6CF51746A88F00_3644F0F6DAF0899E_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(C=CC=C2)CN3CCCC3""",21,"""DA05874D6724FA81"""
+"""3FDF6B45C27700CE_AE90A07766426A24_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=CC(=N[N]2C3CCCCO3)C""",21,"""DA05874D6724FA81"""
+"""E21C0DC9AD95C8FA_A4978A743F3F8ED9_6005_UN""","""COC1=NC=C(C(=C1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""DA05874D6724FA81"""
+"""B4D887CA42B96B56_24893A02BE2B00FB_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](CCN)(=O)=O)C2CC2""",21,"""DA4144ED60D06DE3"""
+"""3611050256E63769_BFF0EA8813880F55_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C(C)C)[S](=O)(=O)CCN""",21,"""DA4144ED60D06DE3"""
+"""9F40BB32C74D4F71_E87F063DFDC82C09_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)CCN=C=S""",21,"""DA4144ED60D06DE3"""
+"""8D6C22038DE2D186_F5690785B36055C1_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](CC)(=O)=O)CCCN""",21,"""DA4144ED60D06DE3"""
+"""DED4B137B48BF118_7FB6A26845B460E0_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)C2CC(C2)N""",21,"""DA4144ED60D06DE3"""
+"""03413A8B1FED1AF5_396CAA6F7581E261_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(CCCN)[S](=O)(=O)CCl""",21,"""DA4144ED60D06DE3"""
+"""C5C0654F8F300E5B_CC8D2629A7137720_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)C2CNCC2""",21,"""DA4144ED60D06DE3"""
+"""A0A34760DED36A95_72D52D3E18FCD2E4_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](CC)(=O)=O)CCCBr""",21,"""DA4144ED60D06DE3"""
+"""9A8E3DDA93FDD7DD_C60FAC3EBDF2516A_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(CCCNC)[S](=O)(=O)C""",21,"""DA4144ED60D06DE3"""
+"""726389F14DED8A2F_2362A458343B4B32_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""DA4144ED60D06DE3"""
+"""D2C80F7EA4BB2FCC_7129CE43680498FA_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](=O)(=O)CC#N)C2CC2""",21,"""DA4144ED60D06DE3"""
+"""64E3A80A317F0F2D_F2FDA53580A2DAED_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)C(=O)CCN""",21,"""DA4144ED60D06DE3"""
+"""1957ACA3FFE9A7A3_34FBF2C564FC6E1E_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""DA4144ED60D06DE3"""
+"""D9F39D00D8B51653_965DAF5C74B37C5F_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""DA4144ED60D06DE3"""
+"""A49CBF7052101DAA_5B3AF415ABFD5C00_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""DA4144ED60D06DE3"""
+"""348F3FA1CF173E28_AF475BA264FD0CA9_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""DA4144ED60D06DE3"""
+"""A7F6C8F2D5D20942_A5B3BCA2F88634AF_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(CC(CC)N)[S](=O)(=O)C""",21,"""DA4144ED60D06DE3"""
+"""903BF12A996F36E7_A79DE983FA8D8484_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""DA4144ED60D06DE3"""
+"""329D00489107AFC3_345FF6CF20755F60_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)CCN=[N]#N""",21,"""DA4144ED60D06DE3"""
+"""92F844FA9A7E28BE_E4EEC16926085B44_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""DA4144ED60D06DE3"""
+"""7B0AEF575D529979_AEE1A6D8B1C6DCC9_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""DA4144ED60D06DE3"""
+"""00347594D8FC3126_42DC38BABBEC78C6_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""DA4144ED60D06DE3"""
+"""AA78AAE959D9C778_4B318CDE10B9557C_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](=O)(=O)C2CC2)CC#C""",21,"""DA4144ED60D06DE3"""
+"""B72E4A4291F52315_1F319655F7B790BA_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""DA4144ED60D06DE3"""
+"""4DE7B307F641F53B_375AD9A8D2B3DC52_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N2CCCC(C)(C)[S]2(=O)=O""",21,"""DA4144ED60D06DE3"""
+"""6CA20FB484252C80_FC7322FC5B751741_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N2CCCC(CC)[S]2(=O)=O""",21,"""DA4144ED60D06DE3"""
+"""9AC756C24087A503_CD1A52263ECCA1EE_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""DA4144ED60D06DE3"""
+"""27FCB9949AF5846F_1204358844C498C0_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""DA4144ED60D06DE3"""
+"""356579120E5E4EF9_B93CFB11905405EC_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""DA4144ED60D06DE3"""
+"""AEB877396DF219D0_F9504B41956EDC52_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""DA4144ED60D06DE3"""
+"""9EBC75284435CAAC_511FD1956E73C33A_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N2[S](CCN(C)CC2)(=O)=O""",21,"""DA4144ED60D06DE3"""
+"""ECDF33AD87C330E4_DD88F71806DA28D9_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N2CC(=O)NCC[S]2(=O)=O""",21,"""DA4144ED60D06DE3"""
+"""065A3D4CB0C921C7_8873EA11AB7FEF4D_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N2[S](CCCCC2C)(=O)=O""",21,"""DA4144ED60D06DE3"""
+"""E6ABD9B5CC973B5D_F2DBAFDD059F00B3_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(CCN)[S](=O)(=O)C2CC2""",21,"""DA4144ED60D06DE3"""
+"""49052D2131DDA91C_9421891CA1B39244_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(CCN)[S](=O)(=O)C(F)F""",21,"""DA4144ED60D06DE3"""
+"""903A6BC76528623E_342415799FB86CA6_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N([S](CC)(=O)=O)C2CNC2""",21,"""DA4144ED60D06DE3"""
+"""F0DF35328CEA0EDC_06BDC145085138DB_6036_DP""","""NCC(C1=C(C=C(C=C1)F)F)N3CC2(CNC2)C[S]3(=O)=O""",21,"""DA4144ED60D06DE3"""
+"""1FBB3D8F5835ADFC_BCC8B8D7D1927CB1_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""DA4144ED60D06DE3"""
+"""1B26AAB0974E7B6D_40232087D8F06C01_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""DA4144ED60D06DE3"""
+"""7F38822C02E93F67_7E42473015CEA49A_6036_UN""","""NCC(C1=C(C=C(C=C1)F)F)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""DA4144ED60D06DE3"""
+"""0369246EAE7469CE_DB0DCAE0A1481AAD_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=CC=C2)OC3CCCC3)F""",21,"""DAFD9BB450D3E371"""
+"""DA1000F8CBD16267_747A32CC5A58B651_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(OCC)C=C2)OCC)F""",21,"""DAFD9BB450D3E371"""
+"""D56CF0ACF149B58B_887A450BC5B3417B_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2)OCCC(C)C)F""",21,"""DAFD9BB450D3E371"""
+"""939916EAA8AD828E_D440BD5D569F777F_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(C=C2)C[N]3C=CN=C3)F""",21,"""DAFD9BB450D3E371"""
+"""65EE97C8AA87180F_E768D29CD1F181D7_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(C=C2)OC3CCOC3)F""",21,"""DAFD9BB450D3E371"""
+"""7447F7E000A02EF9_2C8936E809867524_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(OC)C=C2)CN(C)C)F""",21,"""DAFD9BB450D3E371"""
+"""09C42043FCA0C94F_F4E612E45D4264AC_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2)COCCOC)F""",21,"""DAFD9BB450D3E371"""
+"""42C44D5B5C29D1E5_7D8B9FE553FE6FC0_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2)CN(C)C3CC3)F""",21,"""DAFD9BB450D3E371"""
+"""8D7EDD63BCC2989B_62908B0664B488A5_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2)OC(COC)C)F""",21,"""DAFD9BB450D3E371"""
+"""A5ADFC1975A0E7A4_30D17332EF012889_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(C(NOC)=O)C=C2)F)F""",21,"""DAFD9BB450D3E371"""
+"""122EED5F0BC67102_25289506747C89CB_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(OC)N=C(C=C2)C(F)(F)F)F""",21,"""DAFD9BB450D3E371"""
+"""B447E85FC49B7A2D_5C93FA2A8346B5B6_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=CC=C2)CN3CCCC3)F""",21,"""DAFD9BB450D3E371"""
+"""D2B8857500F90B0A_45B7DE28EB2A5A36_6005_UN""","""NC1=C(C(=C(C=C1)F)C3=CC=C([N]2C=C(C)C=N2)C=C3)F""",21,"""DAFD9BB450D3E371"""
+"""E61E0996482C6D14_384381CA6C3CEB5F_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2)OCCN(C)C)F""",21,"""DAFD9BB450D3E371"""
+"""2634822A6315A47C_CF9E4D08FD5E4864_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=C(C(C)C)C=C2)C(C)C)F""",21,"""DAFD9BB450D3E371"""
+"""654C14C5D44CCF64_F8B9758C0A344BD0_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(C=C2)C3=CC=CC=C3)F""",21,"""DAFD9BB450D3E371"""
+"""E7977F4E63E490DF_2A758B08203B6163_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=CC=C2F)OC(F)(F)F)F""",21,"""DAFD9BB450D3E371"""
+"""4F551705E21C5330_FAA04580D5615570_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(C=C2)Cl)OC(F)(F)F)F""",21,"""DAFD9BB450D3E371"""
+"""63B8867FD5BE646E_D53571CFC64637B5_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=C(OC)C=C2)C(F)(F)F)F""",21,"""DAFD9BB450D3E371"""
+"""7F8082A75135C705_D00E8F6A1A76E59C_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=CC(=C2F)C(N(C)C)=O)F""",21,"""DAFD9BB450D3E371"""
+"""DBC0AD7D2A3D9C2A_15F5299D7AF679A8_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(OC)C=C2)C(F)(F)F)F""",21,"""DAFD9BB450D3E371"""
+"""F0F67CD1F34BF0A3_05D9B9CCA518CD5C_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)F""",21,"""DAFD9BB450D3E371"""
+"""A99AD009CAEB49DB_D8CAE0F50BBB3926_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=CC=C2)C3=CC=CC=C3)F""",21,"""DAFD9BB450D3E371"""
+"""CEDB8E9961E724FD_48B9048F9246B3F3_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(OC)C=C(C=C2)C(F)(F)F)F""",21,"""DAFD9BB450D3E371"""
+"""CA1C6AC3FBE6293B_6D98B43C72497D28_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C)C=C(C=C2)OC(F)(F)F)F""",21,"""DAFD9BB450D3E371"""
+"""72A44CD8856C4E98_0B65047D5BC0CC48_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(OCCC(C)C)C=C2)F""",21,"""DAFD9BB450D3E371"""
+"""6818F06C967594C8_F608676BA58A5C18_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(C=C2)OC3CCCC3)F""",21,"""DAFD9BB450D3E371"""
+"""C3250DBE2D55781D_773EBE95127134CC_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=C(OC)C=C2)CN(C)C)F""",21,"""DAFD9BB450D3E371"""
+"""7766DD98FAA6C2A9_0241DCA7685D907B_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(N=C2)C(F)(F)F)OC)F""",21,"""DAFD9BB450D3E371"""
+"""CC93596AA6D107C4_FDA61B2BBF5C6E96_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C)C=C(C=C2)OCC3CC3)F""",21,"""DAFD9BB450D3E371"""
+"""A9D6224D49AEBB21_0A21F2DE94254388_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=CC(=C2)C3(CC3)C#N)F)F""",21,"""DAFD9BB450D3E371"""
+"""4F8AB29CD5C8FF8E_7C2ADCC25C4944E3_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(OCC(C)(C)C)N=CC=C2)F""",21,"""DAFD9BB450D3E371"""
+"""5C6DE9F8707DBC9D_B91A4DF8C5AD2D9C_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC=C(C=C2)C[N]3C=NC=N3)F""",21,"""DAFD9BB450D3E371"""
+"""F6CE03E0FF55AD3D_D37E78DE3A9B26FC_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(OCC)C=CC(=C2)[N](=O)=O)F""",21,"""DAFD9BB450D3E371"""
+"""7E5C5F7A7220890A_A245CAAB2B90A80F_6005_UN""","""NC1=C(C(=C(C=C1)F)C3=CC2=C(C=C(OC)C=C2)C=C3)F""",21,"""DAFD9BB450D3E371"""
+"""D87545BE13EF4D7E_108E26DEE9D9A14D_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=C(C=C2C3CC3)Cl)OC)F""",21,"""DAFD9BB450D3E371"""
+"""7834BE6E9241B4E5_6540B456D375317F_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=CC=C2)C3=CC=NC=C3)F""",21,"""DAFD9BB450D3E371"""
+"""C5A6409F9B77769C_36BCEC0FED07906E_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=CC=C2)CN3CCCC3)F""",21,"""DAFD9BB450D3E371"""
+"""4D5D0555D64F9060_AE68BC8E51B573D4_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=CC(=N[N]2C3CCCCO3)C)F""",21,"""DAFD9BB450D3E371"""
+"""58FE17E9554E9D23_A46F968D08C89729_6005_UN""","""NC1=C(C(=C(C=C1)F)C2=C(C=C(C=C2)OC(F)(F)F)F)F""",21,"""DAFD9BB450D3E371"""
+"""0834E1A9F7D53CF7_2505EB4C77BB410C_6036_UN""","""NCC(CN([S](CCN)(=O)=O)C1CC1)C2=CC(=CC=C2)Cl""",21,"""DBCD95A3A9402C14"""
+"""FDEA1BFAF66A4BDB_BE7C3BC6DA184EA2_6036_UN""","""NCC(CN(C(C)C)[S](=O)(=O)CCN)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""619C0E2213A6B1EE_E9F3D77334586DFE_6036_UN""","""NCC(CN([S](C)(=O)=O)CCN=C=S)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""DDE6172615721EF7_F4E5D6CB7AF01436_6036_UN""","""NCC(CN([S](CC)(=O)=O)CCCN)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""E8D9AA09F9B15576_7E3A73268C242117_6036_UN""","""NCC(CN([S](C)(=O)=O)C1CC(C1)N)C2=CC(=CC=C2)Cl""",21,"""DBCD95A3A9402C14"""
+"""3D18E484ECA5E4CD_38E07B21BC11A396_6036_UN""","""NCC(CN(CCCN)[S](=O)(=O)CCl)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""9309EDD0F1BC3473_CD01F7676E8336D7_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1CNCC1)C2=CC(=CC=C2)Cl""",21,"""DBCD95A3A9402C14"""
+"""6FBE1397C5D59158_7359FC70D16C9313_6036_UN""","""NCC(CN([S](CC)(=O)=O)CCCBr)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""F3C6B1666130B1EE_C7837D707462109D_6036_UN""","""NCC(CN(CCCNC)[S](=O)(=O)C)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""FAA7347304B16B1F_22EE7516FDAB0AC5_6036_UN""","""NCC(CN(C(C)(C)C#N)[S](=O)(=O)C)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""2D8DBB9240D37430_70A51F0DA194D90D_6036_UN""","""NCC(CN([S](=O)(=O)CC#N)C1CC1)C2=CC(=CC=C2)Cl""",21,"""DBCD95A3A9402C14"""
+"""631BAD98FDAF750A_F371747B49329B1A_6036_UN""","""NCC(CN([S](C)(=O)=O)C(=O)CCN)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""AF92D98B5D1F94F0_3577238BAD6C2FE9_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=CC=CS1)C2=CC(=CC=C2)Cl""",21,"""DBCD95A3A9402C14"""
+"""EC336F789C2F073B_97D17E12BD233DA8_6036_UN""","""NCC(CN(C(C)(C)C)[S](=O)(=O)CCl)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""F4B384A8B51F260C_5AB6255B626D1DF7_6036_UN""","""NCC(CN(C(C)(C)C)[S](=O)(=O)CBr)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""23B73A8F7D27CF3F_AECB8AECAD6D4D5E_6036_UN""","""NCC(CN(C(C)(C)C#C)[S](=O)(=O)C)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""70B982E14367168A_A43F6DEC31167558_6036_UN""","""NCC(CN(CC(CC)N)[S](=O)(=O)C)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""B4463ED0CC7A7A10_A61138CD331DC573_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=C[NH]C=N1)C2=CC(=CC=C2)Cl""",21,"""DBCD95A3A9402C14"""
+"""DD1A7F000E493B80_35D32781E9E51E97_6036_UN""","""NCC(CN([S](C)(=O)=O)CCN=[N]#N)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""BA440CCE14782A74_E5621027EF981AB3_6036_UN""","""NCC(CN(CC(C)(C)N)[S](=O)(=O)C)C1=CC(=CC=C1)Cl""",21,"""DBCD95A3A9402C14"""
+"""1CB257C841C93E71_AF6D779678569D3E_6036_UN""","""NCC(CN1[S](CC(C)(C)C1=O)(=O)=O)C2=CC(=CC=C2)Cl""",21,"""DBCD95A3A9402C14"""
+"""65E054456EA38750_4350E9F4727C3931_6036_UN""","""NCC(CN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)C3=CC(=CC=C3)Cl""",21,"""DBCD95A3A9402C14"""
+"""A0B391CC78D39BB0_4ABD5D90D929148B_6036_UN""","""NCC(CN([S](=O)(=O)C1CC1)CC#C)C2=CC(=CC=C2)Cl""",21,"""DBCD95A3A9402C14"""
+"""E6C8E696F14254E7_1EBD471B3E27D14D_6036_UN""","""NCC(CN1[S](=O)(=O)C2(CCC1)CC2)C3=CC(=CC=C3)Cl""",21,"""DBCD95A3A9402C14"""
+"""40BD3F877E675803_36D608E61B239DA5_6036_UN""","""NCC(CN1CCCC(C)(C)[S]1(=O)=O)C2=CC(=CC=C2)Cl""",21,"""DBCD95A3A9402C14"""
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+"""76FB22B6C345E992_F1852DB0431578C8_6005_UN""","""C[N]1N=CC(=C1C(F)F)C2=CC=C(C=C2)OC3CCCC3""",21,"""DD70D16FB64CC7A1"""
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+"""6EA620C1A9134104_7BA79619BAD66033_6005_UN""","""C[N]1N=CC(=C1C(F)F)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""DD70D16FB64CC7A1"""
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+"""803F1A43A9F409EA_17036C050F46859D_6005_UN""","""C[N]1N=CC(=C1C(F)F)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""DD70D16FB64CC7A1"""
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+"""38C779C0DAABA211_3131A6D40B98B4BE_6005_UN""","""C[N]1N=CC(=C1C(F)F)C2=C(C=CC=C2)CN3CCCC3""",21,"""DD70D16FB64CC7A1"""
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+"""AFC0FE0BD7DE546D_29056B197B182CC0_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""DF71C645224DBA95"""
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+"""B1CF6C746AC97438_7807C21421603624_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""DF71C645224DBA95"""
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+"""E9B114BF478E4029_CA1210F98FC01180_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""DF71C645224DBA95"""
+"""552B581CC6793668_FD35287D78AA1234_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""DF71C645224DBA95"""
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+"""7322FB0CACE30297_1079746C0868204C_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""DF71C645224DBA95"""
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+"""D3BCBAE76CD1737C_4D35597EE0D8EA17_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""DF71C645224DBA95"""
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+"""E9BC04C467EC7C1C_0EE9598C295E95AC_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""DF71C645224DBA95"""
+"""02382DEF5CAF2B3B_F3843A9AD71405FC_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""DF71C645224DBA95"""
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+"""492BCF580D7E5820_07CD81561AC3C99F_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""DF71C645224DBA95"""
+"""7020EEBCDB703FBA_F82A46DACDC23772_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""DF71C645224DBA95"""
+"""0E4B5A829606AA2A_0FADAF2FE6BB1A6C_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""DF71C645224DBA95"""
+"""29AE72D380E7473D_79A681332ED71D07_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""DF71C645224DBA95"""
+"""52840035078A9FDB_BC961009B7337478_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""DF71C645224DBA95"""
+"""2B5A0A5087D6160E_D6F2252F48057F18_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""DF71C645224DBA95"""
+"""245E673C45E6D3BE_A7C9975A590EF1EB_6005_UN""","""COC1=C(C=C(C=C1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""DF71C645224DBA95"""
+"""431EF36E2FBD4B5B_15027B2F9B47F8A9_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""DF71C645224DBA95"""
+"""E3FF0765D722ABB5_60CCE9A7A1EB689B_6005_UN""","""COC1=C(C=C(C=C1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""DF71C645224DBA95"""
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+"""186D67D44388E898_1F871FFA66CC86E6_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N([S](CCN)(=O)=O)C3CC3""",21,"""E14F6115B837EBFE"""
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+"""075F07923DA43219_44B887909D53E6FD_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""E14F6115B837EBFE"""
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+"""552C480E5C8F6976_49DB08C6C01B54F9_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N([S](CC)(=O)=O)CCCBr""",21,"""E14F6115B837EBFE"""
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+"""A67CE7C570DEC614_C9F380CD58455CF0_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N([S](C)(=O)=O)C(=O)CCN""",21,"""E14F6115B837EBFE"""
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+"""540C6A9AE51EE122_94497E5ABC1A8AB4_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""E14F6115B837EBFE"""
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+"""EE44A141DF0ECB1F_0F51D337F892D97D_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""E14F6115B837EBFE"""
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+"""CEC056C5F882DACC_95EF832069215AD4_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""E14F6115B837EBFE"""
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+"""A414F2B1E4F2C47F_703FA926C85ED361_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N([S](=O)(=O)C3CC3)CC#C""",21,"""E14F6115B837EBFE"""
+"""1DF148FA0F9EA14A_243FB3AD2F5016A7_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""E14F6115B837EBFE"""
+"""FA5F246DEBC6022C_0C54FC500A545A4F_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""E14F6115B837EBFE"""
+"""0F9377B3CB205401_C77D07048392915C_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N3CCCC(CC)[S]3(=O)=O""",21,"""E14F6115B837EBFE"""
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+"""6595BE751AA4E75E_290A10709C231EDD_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""E14F6115B837EBFE"""
+"""94187376D80DF31A_8232DEE948B383F1_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""E14F6115B837EBFE"""
+"""11E2B2CC18702D7B_C25E6EB94D895A4F_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""E14F6115B837EBFE"""
+"""8205030D4BCCEED9_6A11F46DB6944527_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N3[S](CCN(C)CC3)(=O)=O""",21,"""E14F6115B837EBFE"""
+"""C1160343A72765FF_E686D2E0DE3DAEC4_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N3CC(=O)NCC[S]3(=O)=O""",21,"""E14F6115B837EBFE"""
+"""76B1A8B6BC9B648F_B37DCFE973986950_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N3[S](CCCCC3C)(=O)=O""",21,"""E14F6115B837EBFE"""
+"""815BB73896D42273_C9D58A25DD7886AE_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N(CCN)[S](=O)(=O)C3CC3""",21,"""E14F6115B837EBFE"""
+"""CD51AA3CB8AC5ADC_AF2FACE479541459_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N(CCN)[S](=O)(=O)C(F)F""",21,"""E14F6115B837EBFE"""
+"""D37708223CA03507_0F2A3081475FEABB_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N([S](CC)(=O)=O)C3CNC3""",21,"""E14F6115B837EBFE"""
+"""3DF5A9A9AE9A5D9E_3DB3E4BDD0B6BEC6_6036_DP""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""E14F6115B837EBFE"""
+"""DCF836917308F2CF_87C69D2F0975FAAC_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""E14F6115B837EBFE"""
+"""01784ABEE39863DC_7B2D057F0017EA1C_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""E14F6115B837EBFE"""
+"""59B14FE0539111AA_454C62C8CD292287_6036_UN""","""CC1=NOC(=N1)[C@@H]2NC[C@H](C2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""E14F6115B837EBFE"""
+"""DE8145F99FCE21D9_E0BFD6579313A610_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=CC=C2)OC3CCCC3""",21,"""E14F870362885FCC"""
+"""C75B8241CEB68813_4FC82E7B68030AEC_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=C(OCC)C=C2)OCC""",21,"""E14F870362885FCC"""
+"""3369471EEA0429CB_B3C859BCF7E8FDC6_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=CC(=C2)OCCC(C)C""",21,"""E14F870362885FCC"""
+"""21BF465B25130C3D_EFF2A1EA64C4CBC2_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""E14F870362885FCC"""
+"""2D40CC9951A2636E_DCDACE2BE3AA3D6A_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)OC3CCOC3""",21,"""E14F870362885FCC"""
+"""0CEE6467BC611B04_173B2A5F3BDDC999_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""E14F870362885FCC"""
+"""AC14F9E9D6141D59_CF540E536F19D811_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=CC(=C2)COCCOC""",21,"""E14F870362885FCC"""
+"""F660B0E6EDD00CA0_4639835261A5D37D_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""E14F870362885FCC"""
+"""64CD8A26309C2A1C_592297B156EF3418_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=CC(=C2)OC(COC)C""",21,"""E14F870362885FCC"""
+"""C0B44FC2DAF7DF4A_0B636F85DD5A9434_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""E14F870362885FCC"""
+"""B75841F695060F23_1E9A89B146273576_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""E14F870362885FCC"""
+"""4FE75969C3F73900_6721E69DB11D090B_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=CC=C2)CN3CCCC3""",21,"""E14F870362885FCC"""
+"""D2B4E910E84DDEC5_7E05C29FD971E68B_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""E14F870362885FCC"""
+"""646A1210B16B9EE1_03F19D7D5E6757E2_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=CC(=C2)OCCN(C)C""",21,"""E14F870362885FCC"""
+"""8343C80D7C3C4804_F42C51BFCF05F4D9_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""E14F870362885FCC"""
+"""D6F7BC63C3E26977_C30B693B386FF76D_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""E14F870362885FCC"""
+"""D91BF3A2911D5D03_11C797BF1260DDDE_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""E14F870362885FCC"""
+"""F636552414D34F27_C1125937E73AE9CD_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""E14F870362885FCC"""
+"""3DAE0D4EC75AEF92_EE876D78F41D8B08_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""E14F870362885FCC"""
+"""92DF7898523E36FA_EBBC93DD282D5921_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""E14F870362885FCC"""
+"""B0BF723BEFD86684_2E47352A48ADC515_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""E14F870362885FCC"""
+"""556468D3D5D81D92_3E6BA57B974371E1_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""E14F870362885FCC"""
+"""373BA4CB79F1F2D2_E378FC4239E0859B_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""E14F870362885FCC"""
+"""EC5FEDF7BB5CD5EA_730B1838A01D0F4E_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""E14F870362885FCC"""
+"""FE99C66D2493F56C_562AA88B4012C195_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""E14F870362885FCC"""
+"""F9A86093FE4CD4CD_30D718CA699B70F5_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=C(OCCC(C)C)C=C2""",21,"""E14F870362885FCC"""
+"""A69711A2F114C2D6_CDBA7BDC97D1E0A5_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)OC3CCCC3""",21,"""E14F870362885FCC"""
+"""C8774B90A9867FEB_4C8CA222202A8871_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""E14F870362885FCC"""
+"""AB3504B7CC555268_39F3C0105A062CC6_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""E14F870362885FCC"""
+"""8612F974334F86D2_C614079C8D07D22B_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""E14F870362885FCC"""
+"""FAEB85DCA6577BDB_3193EE69A67EFF35_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""E14F870362885FCC"""
+"""3416FCA17B2F35BB_4798C0756E12F85E_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""E14F870362885FCC"""
+"""4002B22DC6479CA4_82A8514FF7F69121_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""E14F870362885FCC"""
+"""AB327CDB1318706E_E8CC646908C09A41_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""E14F870362885FCC"""
+"""4F1FA1E72453910D_99F7D61C19CB14B2_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""E14F870362885FCC"""
+"""D9B6179717C5EEF0_2B3C3A69DB821DF0_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""E14F870362885FCC"""
+"""9DF5BE2B9BEDE20E_5EF2A8E1E12E8DC2_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""E14F870362885FCC"""
+"""0AC2BCC8D6927C02_0D0EF0B8DF5C2CD3_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(C=CC=C2)CN3CCCC3""",21,"""E14F870362885FCC"""
+"""96467DABC787D739_95DAA03963EECF69_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""E14F870362885FCC"""
+"""F1791AF2D1BCA9D7_9FDD8A3A3A932B94_6005_UN""","""CC1=C(C(=NC(=N1)N)N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""E14F870362885FCC"""
+"""647162AD524A0180_E3CA4F1ABC05FC3B_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=CC=C2)OC3CCCC3""",21,"""E23A1E4E4D9E05E7"""
+"""5C23F72C8BC627C3_4CBDB736471550C7_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=C(OCC)C=C2)OCC""",21,"""E23A1E4E4D9E05E7"""
+"""3C7C716F413B5F82_B0BDC0F1D8FEA7ED_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=CC(=C2)OCCC(C)C""",21,"""E23A1E4E4D9E05E7"""
+"""42C709290CE1E926_EC8738A74BD291E9_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""E23A1E4E4D9E05E7"""
+"""D67C999CB8A64AA3_DFAF5766CCBC6741_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=C(C=C2)OC3CCOC3""",21,"""E23A1E4E4D9E05E7"""
+"""EE64A719088E50AE_144EB31214CB93B2_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""E23A1E4E4D9E05E7"""
+"""501A3915F56F8D70_CC21971E400F823A_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=CC(=C2)COCCOC""",21,"""E23A1E4E4D9E05E7"""
+"""A023A537A5F9489A_454C1A1F4EB38956_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""E23A1E4E4D9E05E7"""
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+"""67073374206CBCD6_0816F6C8F24CCE1F_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""E23A1E4E4D9E05E7"""
+"""985FB8D7FA08EC21_1DEF10FC69316F5D_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""E23A1E4E4D9E05E7"""
+"""8167956C9B64DBC7_64547FD09E0B5320_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=CC=C2)CN3CCCC3""",21,"""E23A1E4E4D9E05E7"""
+"""A5CFC08F6A334C02_7D705BD2F667BCA0_6005_UN""","""NCC1=C(C=C(C=C1)Br)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""E23A1E4E4D9E05E7"""
+"""3A45F466C81D9618_0084043071710DC9_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=CC(=C2)OCCN(C)C""",21,"""E23A1E4E4D9E05E7"""
+"""9035C3C3ED41D088_F759C8F2E013AEF2_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""E23A1E4E4D9E05E7"""
+"""E736D8245CB60A80_C07EF0761779AD46_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""E23A1E4E4D9E05E7"""
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+"""C25C25AD9C135120_C267C07AC82CB3E6_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""E23A1E4E4D9E05E7"""
+"""80CF215FED543D37_EDF2F435DB0BD123_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""E23A1E4E4D9E05E7"""
+"""C835541E4CCE603A_E8C90A90073B030A_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""E23A1E4E4D9E05E7"""
+"""4703F1FE056E64FB_2D32AC6767BB9F3E_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""E23A1E4E4D9E05E7"""
+"""55EE4DD728600B6F_3D1E3C36B8552BCA_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""E23A1E4E4D9E05E7"""
+"""E284C14FB7BF8089_E00D650F16F6DFB0_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""E23A1E4E4D9E05E7"""
+"""C8E07E123A08BA63_707E81758F0B5565_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""E23A1E4E4D9E05E7"""
+"""9B7BCC979B281A4F_555F31C66F049BBE_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""E23A1E4E4D9E05E7"""
+"""5581EE68B6DFA598_33A28187468D2ADE_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=C(OCCC(C)C)C=C2""",21,"""E23A1E4E4D9E05E7"""
+"""ECA5E575A0BD90A4_CECFE291B8C7BA8E_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=C(C=C2)OC3CCCC3""",21,"""E23A1E4E4D9E05E7"""
+"""6A5EA674B3E98D5A_4FF93B6F0F3CD25A_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""E23A1E4E4D9E05E7"""
+"""56F16B165289FDC1_3A86595D751076ED_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""E23A1E4E4D9E05E7"""
+"""188B5235A2325E19_C5619ED1A2118800_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""E23A1E4E4D9E05E7"""
+"""BB7D047C002DFE57_32E677248968A51E_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""E23A1E4E4D9E05E7"""
+"""17913F22DDEFED6A_44ED59384104A275_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""E23A1E4E4D9E05E7"""
+"""51E1B34A62B7915B_81DDC802D8E0CB0A_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""E23A1E4E4D9E05E7"""
+"""9EE64B5CBD139938_EBB9FD2427D6C06A_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""E23A1E4E4D9E05E7"""
+"""00CB287587B31832_9A824F5136DD4E99_6005_UN""","""NCC1=C(C=C(C=C1)Br)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""E23A1E4E4D9E05E7"""
+"""F55FBE72275B0036_2849A324F49447DB_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""E23A1E4E4D9E05E7"""
+"""9C84D7C9CCE4CD61_5D8731ACCE38D7E9_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""E23A1E4E4D9E05E7"""
+"""073E7573B47EBB76_0E7B69F5F04A76F8_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(C=CC=C2)CN3CCCC3""",21,"""E23A1E4E4D9E05E7"""
+"""2EAFDDFAD597C8C2_96AF39744CF89542_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=CC(=N[N]2C3CCCCO3)C""",21,"""E23A1E4E4D9E05E7"""
+"""C22DD28BD5CE4C24_9CA81377158571BF_6005_UN""","""NCC1=C(C=C(C=C1)Br)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""E23A1E4E4D9E05E7"""
+"""82734611727C333A_690069C6DEF78419_6006_UN""","""CC2=C1OCCCC(C1=CC(=C2)C3=CN=C(OC)C=C3)=O""",21,"""E23B91BC751B837E"""
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+"""E4CEB0616E944E7B_4460A02D21C5E6F8_6006_UN""","""CC2=C1OCCCC(C1=CC(=C2)C3=C(C=C(C)C=C3)F)=O""",21,"""E23B91BC751B837E"""
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+"""E5FA48A3A3F4A438_EEFB785B2BBF6768_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)CC(C)=C""",21,"""E29A0A7B0C4571EB"""
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+"""E0A27A7816CB1760_40094C7D57362B02_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)C[C@@H](C)N""",21,"""E29A0A7B0C4571EB"""
+"""21CC642827E08FF7_7152708D968DBC80_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)C[CH]=[C]=[CH2]""",21,"""E29A0A7B0C4571EB"""
+"""AFCA637D67854D3B_868A64A15C9928CD_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)CC#CBr""",21,"""E29A0A7B0C4571EB"""
+"""C976EA9D04319877_08CE5D948801B043_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)CC(C)Cl""",21,"""E29A0A7B0C4571EB"""
+"""A48F3E4B03864B3E_187732163F27BFFE_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)CCCF""",21,"""E29A0A7B0C4571EB"""
+"""6621C89C8AC6510D_9CB42BAFCE255C64_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)CC(N)=S""",21,"""E29A0A7B0C4571EB"""
+"""9E18B7E6DF8B986B_9D2CF649B4ED8243_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)CCCS""",21,"""E29A0A7B0C4571EB"""
+"""10A78507C119D598_E2DDD61B6E26822D_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)CCCC""",21,"""E29A0A7B0C4571EB"""
+"""10645FC0CDD2F2AD_60BF1FEDAC7016D9_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)CCCN""",21,"""E29A0A7B0C4571EB"""
+"""616A42C41541F7F1_C0BE980F59C0D76A_6031_UN""","""O(C(=O)C1CN(C1)C(=O)OCC2=CC=CC=C2)CCCBr""",21,"""E29A0A7B0C4571EB"""
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+"""F409708D66C6EF2F_3DFAE13D7EF853A4_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""E2DEC3458B337D89"""
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+"""AC54537AF9E69971_55BBECCDA9A9E3D0_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""E2DEC3458B337D89"""
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+"""872BBF1E8B83F506_C58543DA64BCF06E_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""E2DEC3458B337D89"""
+"""5C2A4FEC58F8BD5C_3202AA2F4FC5DD70_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""E2DEC3458B337D89"""
+"""BFABABE8367C3901_4409843387A9DA1B_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""E2DEC3458B337D89"""
+"""E1D9DDCF8857BEF1_813915091E4DB364_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""E2DEC3458B337D89"""
+"""640AD38AE1E0DB0D_EB5D202FE17BB804_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""E2DEC3458B337D89"""
+"""5E1B88FD97EFD9C7_9A66925AF07036F7_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""E2DEC3458B337D89"""
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+"""BE279BA79A070C08_5D63ECA70895AF87_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""E2DEC3458B337D89"""
+"""2C7347A3EFAD3CDC_0E9FB4FE36E70E96_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C2=C(C=CC=C2)CN3CCCC3""",21,"""E2DEC3458B337D89"""
+"""9766A1F026771818_9C4CCE7CD32809D1_6025_UN""","""C1(=NC=C(C=C1)C(=O)O)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""E2DEC3458B337D89"""
+"""4FCE39C0F1B6D05A_E316BCBEAB67BC61_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=CC=C2)OC3CCCC3""",21,"""E2E6EDEA5AFC45BD"""
+"""846441B51D2D7012_4C6144925077109D_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=C(OCC)C=C2)OCC""",21,"""E2E6EDEA5AFC45BD"""
+"""DADBD2C3E7174767_B0613355CF9CE7B7_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=CC(=C2)OCCC(C)C""",21,"""E2E6EDEA5AFC45BD"""
+"""668B3E8F82FD7B8D_EC5BCB035CB0D1B3_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""E2E6EDEA5AFC45BD"""
+"""4DE105C3A65DA4EB_DF73A4C2DBDE271B_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=C(C=C2)OC3CCOC3""",21,"""E2E6EDEA5AFC45BD"""
+"""390221521DA9D2F4_149240B603A9D3E8_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""E2E6EDEA5AFC45BD"""
+"""16B75E9FC7F1FF30_CCFD64BA576DC260_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=CC(=C2)COCCOC""",21,"""E2E6EDEA5AFC45BD"""
+"""45E443831B3DBBD4_4590E9BB59D1C90C_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""E2E6EDEA5AFC45BD"""
+"""1E98E8EE0FF603DE_5A8BFD586E9B2E69_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=CC(=C2)OC(COC)C""",21,"""E2E6EDEA5AFC45BD"""
+"""8332419802BF45A1_08CA056CE52E8E45_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""E2E6EDEA5AFC45BD"""
+"""9DB8D34A352C48BB_1D33E3587E532F07_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""E2E6EDEA5AFC45BD"""
+"""D3ECF8F24131FC3A_64888C748969137A_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=CC=C2)CN3CCCC3""",21,"""E2E6EDEA5AFC45BD"""
+"""20ACCED0A44FB090_7DACA876E105FCFA_6005_UN""","""COC1=C(C(=CC=N1)N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""E2E6EDEA5AFC45BD"""
+"""1F1EB575D138DAF2_0058F79466134D93_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=CC(=C2)OCCN(C)C""",21,"""E2E6EDEA5AFC45BD"""
+"""3E96CC9E385E466B_F7853B56F771EEA8_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""E2E6EDEA5AFC45BD"""
+"""60DD75D2943AA3C5_C0A203D2001BED1C_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""E2E6EDEA5AFC45BD"""
+"""EC9643438675B08F_126EFD562A14C7AF_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""E2E6EDEA5AFC45BD"""
+"""EAB04515321138EB_C2BB33DEDF4EF3BC_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""E2E6EDEA5AFC45BD"""
+"""E58CFB6431D14FAE_ED2E0791CC699179_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""E2E6EDEA5AFC45BD"""
+"""1E04C463EA09F2C2_E815F93410594350_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""E2E6EDEA5AFC45BD"""
+"""AB4E2AB3BDD51E86_2DEE5FC370D9DF64_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""E2E6EDEA5AFC45BD"""
+"""13C1572B883A257B_3DC2CF92AF376B90_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""E2E6EDEA5AFC45BD"""
+"""35DB85FA592A4653_E0D196AB01949FEA_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""E2E6EDEA5AFC45BD"""
+"""A8A4712F1878BF9C_70A272D19869153F_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""E2E6EDEA5AFC45BD"""
+"""FB1A79CCDF9F2F42_5583C2627866DBE4_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""E2E6EDEA5AFC45BD"""
+"""CE7B551326C265C2_337E722351EF6A84_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=C(OCCC(C)C)C=C2""",21,"""E2E6EDEA5AFC45BD"""
+"""4C539259A9F08A4A_CE131135AFA5FAD4_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=C(C=C2)OC3CCCC3""",21,"""E2E6EDEA5AFC45BD"""
+"""4BD06764A01760DC_4F25C8CB185E9200_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""E2E6EDEA5AFC45BD"""
+"""9425FEF146EC0EAE_3A5AAAF9627236B7_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""E2E6EDEA5AFC45BD"""
+"""A7B464F94B68CD3F_C5BD6D75B573C85A_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""E2E6EDEA5AFC45BD"""
+"""C7B35A5C4E832549_323A84809E0AE544_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""E2E6EDEA5AFC45BD"""
+"""59A4331B7C17C4FC_4431AA9C5666E22F_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""E2E6EDEA5AFC45BD"""
+"""30B561D9D7745D5B_81013BA6CF828B50_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""E2E6EDEA5AFC45BD"""
+"""E51001529B4D6397_EB650E8030B48030_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""E2E6EDEA5AFC45BD"""
+"""AF1C0D4C18143650_9A5EBCF521BF0EC3_6005_UN""","""COC1=C(C(=CC=N1)N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""E2E6EDEA5AFC45BD"""
+"""A4CA28586D83C05A_28955080E3F60781_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""E2E6EDEA5AFC45BD"""
+"""DD5F08E5BE35E4D9_5D5BC208D95A97B3_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""E2E6EDEA5AFC45BD"""
+"""44AB4A36867B0172_0EA79A51E72836A2_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(C=CC=C2)CN3CCCC3""",21,"""E2E6EDEA5AFC45BD"""
+"""EDBEA2E2903FC933_9673CAD05B9AD518_6005_UN""","""COC1=C(C(=CC=N1)N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""E2E6EDEA5AFC45BD"""
+"""02EBCDC64A1F7BE1_9C74E0D302E731E5_6005_UN""","""COC1=C(C(=CC=N1)N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""E2E6EDEA5AFC45BD"""
+"""F5EADA985FC5931B_1DECDB51B3ECA844_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](CCN)(=O)=O)C2CC2""",21,"""E324A5BE6D17C55C"""
+"""82D5609932CFFAA9_86950BDB1E4FA7EA_6036_UN""","""CCC(CN1CCC(CC1)N)N(C(C)C)[S](=O)(=O)CCN""",21,"""E324A5BE6D17C55C"""
+"""C54216AEA96C9EBA_D11AE76EF00F84B6_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](C)(=O)=O)CCN=C=S""",21,"""E324A5BE6D17C55C"""
+"""BEA3A903C1DCAE80_CC0CE6D6BEA7FD7E_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](CC)(=O)=O)CCCN""",21,"""E324A5BE6D17C55C"""
+"""82FF66012324BAC4_46D3433B4873C85F_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](C)(=O)=O)C2CC(C2)N""",21,"""E324A5BE6D17C55C"""
+"""DA58704086E1429C_00094B3C78464ADE_6036_UN""","""CCC(CN1CCC(CC1)N)N(CCCN)[S](=O)(=O)CCl""",21,"""E324A5BE6D17C55C"""
+"""2CAB8A9BEAAD4F00_F5E8C77AAAD4DF9F_6036_UN""","""CCC(CN1CCC(CC1)N)N(C)[S](=O)(=O)C2CNCC2""",21,"""E324A5BE6D17C55C"""
+"""A169D5EB724841F0_4BB0CC6D153B7A5B_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](CC)(=O)=O)CCCBr""",21,"""E324A5BE6D17C55C"""
+"""64379A91F83287FC_FF6A4D6DB035F9D5_6036_UN""","""CCC(CN1CCC(CC1)N)N(CCCNC)[S](=O)(=O)C""",21,"""E324A5BE6D17C55C"""
+"""F16B768BC907404A_1A07450B39FCE38D_6036_UN""","""CCC(CN1CCC(CC1)N)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""E324A5BE6D17C55C"""
+"""4B77351CD1CEC7EA_484C2F1065C33045_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](=O)(=O)CC#N)C2CC2""",21,"""E324A5BE6D17C55C"""
+"""5B9622F63E7DA16D_CB9844668D657252_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](C)(=O)=O)C(=O)CCN""",21,"""E324A5BE6D17C55C"""
+"""402B3666EEF31797_0D9E1396693BC6A1_6036_UN""","""CCC(CN1CCC(CC1)N)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""E324A5BE6D17C55C"""
+"""8FABA8A732C75C44_AF384E0F7974D4E0_6036_UN""","""CCC(CN1CCC(CC1)N)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""E324A5BE6D17C55C"""
+"""99E39EF7DC360C8A_625F1546A63AF4BF_6036_UN""","""CCC(CN1CCC(CC1)N)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""E324A5BE6D17C55C"""
+"""895FB2204B614F2E_9622BAF1693AA416_6036_UN""","""CCC(CN1CCC(CC1)N)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""E324A5BE6D17C55C"""
+"""ABB7B3A0FE68B783_9CD65DF1F5419C10_6036_UN""","""CCC(CN1CCC(CC1)N)N(CC(CC)N)[S](=O)(=O)C""",21,"""E324A5BE6D17C55C"""
+"""283DBDEF2D5517FC_9EF808D0F74A2C3B_6036_UN""","""CCC(CN1CCC(CC1)N)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""E324A5BE6D17C55C"""
+"""166DA46CCC08DD14_0D3A179C2DB2F7DF_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](C)(=O)=O)CCN=[N]#N""",21,"""E324A5BE6D17C55C"""
+"""13FB0AAA2C816A34_DD8B203A2BCFF3FB_6036_UN""","""CCC(CN1CCC(CC1)N)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""E324A5BE6D17C55C"""
+"""C8B983F08E38B5ED_9784478BBC017476_6036_UN""","""CCC(CN1CCC(CC1)N)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""E324A5BE6D17C55C"""
+"""DFB2358BC88746C6_7BB9D9E9B62BD079_6036_UN""","""CCC(CN1CCC(CC1)N)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""E324A5BE6D17C55C"""
+"""DAEC4C53D56D1C0D_72546D8D1D7EFDC3_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](=O)(=O)C2CC2)CC#C""",21,"""E324A5BE6D17C55C"""
+"""F4DBA2DC5710A912_26547706FA703805_6036_UN""","""CCC(CN1CCC(CC1)N)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""E324A5BE6D17C55C"""
+"""C1391B1F5CF274FF_0E3F38FBDF7474ED_6036_UN""","""CCC(CN1CCC(CC1)N)N2CCCC(C)(C)[S]2(=O)=O""",21,"""E324A5BE6D17C55C"""
+"""582933FF44E825D7_C516C3AF56B2BFFE_6036_UN""","""CCC(CN1CCC(CC1)N)N2CCCC(CC)[S]2(=O)=O""",21,"""E324A5BE6D17C55C"""
+"""22A676CD998DE65F_F47FB375330B0951_6036_UN""","""CCC(CN1CCC(CC1)N)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""E324A5BE6D17C55C"""
+"""6DB2109D28BAE365_2B61D4DB4903307F_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""E324A5BE6D17C55C"""
+"""C7CBF2164636D318_80591A429D93AD53_6036_UN""","""CCC(CN1CCC(CC1)N)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""E324A5BE6D17C55C"""
+"""5909B1842AC61C4F_C035AA1298A974ED_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""E324A5BE6D17C55C"""
+"""6E78CF0A997269D9_687A30C663B46B85_6036_UN""","""CCC(CN1CCC(CC1)N)N2[S](CCN(C)CC2)(=O)=O""",21,"""E324A5BE6D17C55C"""
+"""C19DE38D96051D4C_E4ED164B0B1D8066_6036_UN""","""CCC(CN1CCC(CC1)N)N2CC(=O)NCC[S]2(=O)=O""",21,"""E324A5BE6D17C55C"""
+"""2045E3AB219B8F5C_B1160B42A6B847F2_6036_UN""","""CCC(CN1CCC(CC1)N)N2[S](CCCCC2C)(=O)=O""",21,"""E324A5BE6D17C55C"""
+"""95E8BDCF3F8D51AC_CBBE4E8E0858A80C_6036_UN""","""CCC(CN1CCC(CC1)N)N(CCN)[S](=O)(=O)C2CC2""",21,"""E324A5BE6D17C55C"""
+"""05B3F8D88002B57B_AD44684FAC743AFB_6036_UN""","""CCC(CN1CCC(CC1)N)N(CCN)[S](=O)(=O)C(F)F""",21,"""E324A5BE6D17C55C"""
+"""0C3A8D364DD7E1E3_0D41F42A927FC419_6036_UN""","""CCC(CN1CCC(CC1)N)N([S](CC)(=O)=O)C2CNC2""",21,"""E324A5BE6D17C55C"""
+"""14DA50E04D6C7A37_3FD8201605969064_6036_DP""","""CCC(CN1CCC(CC1)N)N3CC2(CNC2)C[S]3(=O)=O""",21,"""E324A5BE6D17C55C"""
+"""4A8CDED7BFFE989D_85AD5984DC55D40E_6036_UN""","""CCC(CN1CCC(CC1)N)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""E324A5BE6D17C55C"""
+"""C32426E9EBBD12D1_7946C1D4D537C4BE_6036_UN""","""CCC(CN1CCC(CC1)N)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""E324A5BE6D17C55C"""
+"""3D35579D4A7088F1_4727A66318090C25_6036_UN""","""CCC(CN1CCC(CC1)N)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""E324A5BE6D17C55C"""
+"""14C948C7B1E5C450_1DF85ECA6B7657CF_6036_UN""","""NCCCCN1CCCC1CN([S](CCN)(=O)=O)C2CC2""",21,"""E3302025B58D3AD7"""
+"""AC813D40A37A7D07_86818E40C6D55861_6036_UN""","""NCCCCN1CCCC1CN(C(C)C)[S](=O)(=O)CCN""",21,"""E3302025B58D3AD7"""
+"""8720526BD4F5CA02_D10E62F528957B3D_6036_UN""","""NCCCCN1CCCC1CN([S](C)(=O)=O)CCN=C=S""",21,"""E3302025B58D3AD7"""
+"""1A2FF64E45D1105B_CC18634D663D02F5_6036_UN""","""NCCCCN1CCCC1CN([S](CC)(=O)=O)CCCN""",21,"""E3302025B58D3AD7"""
+"""8241CA42205C64A0_46C7C6A090E937D4_6036_UN""","""NCCCCN1CCCC1CN([S](C)(=O)=O)C2CC(C2)N""",21,"""E3302025B58D3AD7"""
+"""9CC88C55288438E2_001DCEA7A0DCB555_6036_UN""","""NCCCCN1CCCC1CN(CCCN)[S](=O)(=O)CCl""",21,"""E3302025B58D3AD7"""
+"""4A6AECB4CFA6299D_F5FC42E1724E2014_6036_UN""","""NCCCCN1CCCC1CN(C)[S](=O)(=O)C2CNCC2""",21,"""E3302025B58D3AD7"""
+"""A52882235769693B_4BA449F6CDA185D0_6036_UN""","""NCCCCN1CCCC1CN([S](CC)(=O)=O)CCCBr""",21,"""E3302025B58D3AD7"""
+"""4F40F7AD37270EF7_FF7EC8F668AF065E_6036_UN""","""NCCCCN1CCCC1CN(CCCNC)[S](=O)(=O)C""",21,"""E3302025B58D3AD7"""
+"""C2C35AA111072CB6_1A13C090E1661C06_6036_UN""","""NCCCCN1CCCC1CN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""E3302025B58D3AD7"""
+"""A83278FEC686D257_4858AA8BBD59CFCE_6036_UN""","""NCCCCN1CCCC1CN([S](=O)(=O)CC#N)C2CC2""",21,"""E3302025B58D3AD7"""
+"""537C942ACFED6273_CB8CC1FD55FF8DD9_6036_UN""","""NCCCCN1CCCC1CN([S](C)(=O)=O)C(=O)CCN""",21,"""E3302025B58D3AD7"""
+"""AB4EBA178546ECC9_0D8A960DB1A1392A_6036_UN""","""NCCCCN1CCCC1CN(C)[S](=O)(=O)C2=CC=CS2""",21,"""E3302025B58D3AD7"""
+"""76C56BF75DD9FEB8_AF2CCB94A1EE2B6B_6036_UN""","""NCCCCN1CCCC1CN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""E3302025B58D3AD7"""
+"""0D42D7E4C42EDFCC_624B90DD7EA00B34_6036_UN""","""NCCCCN1CCCC1CN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""E3302025B58D3AD7"""
+"""D80FDA48CAA97682_96363F6AB1A05B9D_6036_UN""","""NCCCCN1CCCC1CN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""E3302025B58D3AD7"""
+"""E5955DB67B136BF1_9CC2D86A2DDB639B_6036_UN""","""NCCCCN1CCCC1CN(CC(CC)N)[S](=O)(=O)C""",21,"""E3302025B58D3AD7"""
+"""EF64E35F41827839_9EEC8D4B2FD0D3B0_6036_UN""","""NCCCCN1CCCC1CN(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""E3302025B58D3AD7"""
+"""D286F52AD6939BFF_0D2E9207F5280854_6036_UN""","""NCCCCN1CCCC1CN([S](C)(=O)=O)CCN=[N]#N""",21,"""E3302025B58D3AD7"""
+"""AF963357F5EA5116_DD9FA5A1F3550C70_6036_UN""","""NCCCCN1CCCC1CN(CC(C)(C)N)[S](=O)(=O)C""",21,"""E3302025B58D3AD7"""
+"""9639AAE5D48D1FBF_9790C210649B8BFD_6036_UN""","""NCCCCN1CCCC1CN2[S](CC(C)(C)C2=O)(=O)=O""",21,"""E3302025B58D3AD7"""
+"""C9A2AD34135FD1F3_7BAD5C726EB12FF2_6036_UN""","""NCCCCN1CCCC1CN2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""E3302025B58D3AD7"""
+"""94E36C0A018F549D_7240E816C5E40248_6036_UN""","""NCCCCN1CCCC1CN([S](=O)(=O)C2CC2)CC#C""",21,"""E3302025B58D3AD7"""
+"""410B2740894D105A_2640F29D22EAC78E_6036_UN""","""NCCCCN1CCCC1CN2[S](=O)(=O)C3(CCC2)CC3""",21,"""E3302025B58D3AD7"""
+"""C49978BC27F4CF63_0E2BBD6007EE8B66_6036_UN""","""NCCCCN1CCCC1CN2CCCC(C)(C)[S]2(=O)=O""",21,"""E3302025B58D3AD7"""
+"""6B6C88290974562A_C50246348E284075_6036_UN""","""NCCCCN1CCCC1CN2CCCC(CC)[S]2(=O)=O""",21,"""E3302025B58D3AD7"""
+"""229292C1838E19E3_F46B36EEEB91F6DA_6036_UN""","""NCCCCN1CCCC1CN2C(C(N)CC[S]2(=O)=O)=O""",21,"""E3302025B58D3AD7"""
+"""B3E9E6BA7589FF97_2B7551409199CFF4_6036_UN""","""NCCCCN1CCCC1CN([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""E3302025B58D3AD7"""
+"""DEE77913F4A73CCD_804D9FD9450952D8_6036_UN""","""NCCCCN1CCCC1CN2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""E3302025B58D3AD7"""
+"""6FFA361D7EE731D4_C0212F8940338B66_6036_UN""","""NCCCCN1CCCC1CN([S](C)(=O)=O)[C@H]2CNCC2""",21,"""E3302025B58D3AD7"""
+"""4DDE4AB5F58D788E_686EB55DBB2E940E_6036_UN""","""NCCCCN1CCCC1CN2[S](CCN(C)CC2)(=O)=O""",21,"""E3302025B58D3AD7"""
+"""26CBA351419F1A6F_E4F993D0D3877FED_6036_UN""","""NCCCCN1CCCC1CN2CC(=O)NCC[S]2(=O)=O""",21,"""E3302025B58D3AD7"""
+"""BFDDB9EAFB9D27FA_B1028ED97E22B879_6036_UN""","""NCCCCN1CCCC1CN2[S](CCCCC2C)(=O)=O""",21,"""E3302025B58D3AD7"""
+"""0623D6DC55E13A6E_CBAACB15D0C25787_6036_UN""","""NCCCCN1CCCC1CN(CCN)[S](=O)(=O)C2CC2""",21,"""E3302025B58D3AD7"""
+"""E55F0393086AA615_AD50EDD474EEC570_6036_UN""","""NCCCCN1CCCC1CN(CCN)[S](=O)(=O)C(F)F""",21,"""E3302025B58D3AD7"""
+"""AA1D1AB746BC925B_0D5571B14AE53B92_6036_UN""","""NCCCCN1CCCC1CN([S](CC)(=O)=O)C2CNC2""",21,"""E3302025B58D3AD7"""
+"""D9679CA1EBC36194_3FCCA58DDD0C6FEF_6036_DP""","""NCCCCN1CCCC1CN3CC2(CNC2)C[S]3(=O)=O""",21,"""E3302025B58D3AD7"""
+"""65D5D95B4CC817D0_85B9DC1F04CF2B85_6036_UN""","""NCCCCN1CCCC1CN(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""E3302025B58D3AD7"""
+"""1259CE055950C1DF_7952444F0DAD3B35_6036_UN""","""NCCCCN1CCCC1CN(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""E3302025B58D3AD7"""
+"""212A8F1610361B1E_473323F8C093F3AE_6036_UN""","""NCCCCN1CCCC1CN(C(C)(C)CN)[S](=O)(=O)C""",21,"""E3302025B58D3AD7"""
+"""0407BE0A355ADBB8_E212DA4D2687AB3E_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=CC=C2)OC3CCCC3)Br""",21,"""E3E28B19D71C52E2"""
+"""8B43C075AF4379B4_4D652261DD9707C2_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=C(OCC)C=C2)OCC)Br""",21,"""E3E28B19D71C52E2"""
+"""58D354ED31563307_B16555A6427CF0E8_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=CC(=C2)OCCC(C)C)Br""",21,"""E3E28B19D71C52E2"""
+"""62A9CC293A62020E_ED5FADF0D150C6EC_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=C(C=C2)C[N]3C=CN=C3)Br""",21,"""E3E28B19D71C52E2"""
+"""BCC56770352F20C4_DE77C231563E3044_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=C(C=C2)OC3CCOC3)Br""",21,"""E3E28B19D71C52E2"""
+"""6C40D1FA94BD437A_159626458E49C4B7_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=C(OC)C=C2)CN(C)C)Br""",21,"""E3E28B19D71C52E2"""
+"""A93E1C79128D8621_CDF90249DA8DD53F_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=CC(=C2)COCCOC)Br""",21,"""E3E28B19D71C52E2"""
+"""95B32BE793746FD8_44948F48D431DE53_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=CC(=C2)CN(C)C3CC3)Br""",21,"""E3E28B19D71C52E2"""
+"""AFF84A62665B89FE_5B8F9BABE37B3936_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=CC(=C2)OC(COC)C)Br""",21,"""E3E28B19D71C52E2"""
+"""197987EA8CCDBC21_09CE639F68CE991A_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=C(C(NOC)=O)C=C2)F)Br""",21,"""E3E28B19D71C52E2"""
+"""D1D98BB96BB6BF72_1C3785ABF3B33858_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(OC)N=C(C=C2)C(F)(F)F)Br""",21,"""E3E28B19D71C52E2"""
+"""EAE3B70D5F76ADC1_658CEA8704890425_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=CC=C2)CN3CCCC3)Br""",21,"""E3E28B19D71C52E2"""
+"""8E8B785E0D25C1F0_7CA8CE856CE5EBA5_6005_UN""","""NC1=CC(=C(C(=C1)Br)C3=CC=C([N]2C=C(C)C=N2)C=C3)Br""",21,"""E3E28B19D71C52E2"""
+"""CA7589805F816B59_015C9167EBF35ACC_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=CC(=C2)OCCN(C)C)Br""",21,"""E3E28B19D71C52E2"""
+"""D4246D94D4C9EA48_F6815DA57A91F9F7_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(C=C(C(C)C)C=C2)C(C)C)Br""",21,"""E3E28B19D71C52E2"""
+"""2F952D8A53A47582_C1A665218DFBFA43_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=C(C=C2)C3=CC=CC=C3)Br""",21,"""E3E28B19D71C52E2"""
+"""9FAE38D4A3599B51_136A9BA5A7F4D0F0_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(C=CC=C2F)OC(F)(F)F)Br""",21,"""E3E28B19D71C52E2"""
+"""777F0111F28E1B84_C3BF552D52AEE4E3_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=C(C=C2)Cl)OC(F)(F)F)Br""",21,"""E3E28B19D71C52E2"""
+"""9C13615599CD1080_EC2A616241898626_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(C=C(OC)C=C2)C(F)(F)F)Br""",21,"""E3E28B19D71C52E2"""
+"""4E0D6CF11F5160D9_E9119FC79DB9540F_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=CC(=C2F)C(N(C)C)=O)Br""",21,"""E3E28B19D71C52E2"""
+"""A0D98FD34FC99420_2CEA3930FD39C83B_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=C(OC)C=C2)C(F)(F)F)Br""",21,"""E3E28B19D71C52E2"""
+"""0C258BEDDA63AE75_3CC6A96122D77CCF_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)Br""",21,"""E3E28B19D71C52E2"""
+"""A796E96E174B1839_E1D5F0588C7488B5_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=CC=C2)C3=CC=CC=C3)Br""",21,"""E3E28B19D71C52E2"""
+"""66AF8A7BBBDF0CC4_71A6142215890260_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(OC)C=C(C=C2)C(F)(F)F)Br""",21,"""E3E28B19D71C52E2"""
+"""1DB333DF5C92A307_5487A491F586CCBB_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(C)C=C(C=C2)OC(F)(F)F)Br""",21,"""E3E28B19D71C52E2"""
+"""5FC64B9026B1338C_327A14D0DC0F7DDB_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=C(OCCC(C)C)C=C2)Br""",21,"""E3E28B19D71C52E2"""
+"""3A93685A1C4B45FF_CF1777C62245ED8B_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=C(C=C2)OC3CCCC3)Br""",21,"""E3E28B19D71C52E2"""
+"""50F901A31AE6FA6B_4E21AE3895BE855F_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(C=C(OC)C=C2)CN(C)C)Br""",21,"""E3E28B19D71C52E2"""
+"""E8D7EF931BAE3971_3B5ECC0AEF9221E8_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=C(N=C2)C(F)(F)F)OC)Br""",21,"""E3E28B19D71C52E2"""
+"""6530A079DCA4185B_C4B90B863893DF05_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(C)C=C(C=C2)OCC3CC3)Br""",21,"""E3E28B19D71C52E2"""
+"""AF618D983409FCA9_333EE27313EAF21B_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(C=CC(=C2)C3(CC3)C#N)F)Br""",21,"""E3E28B19D71C52E2"""
+"""5CAF2EFBAE365C6E_4535CC6FDB86F570_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(OCC(C)(C)C)N=CC=C2)Br""",21,"""E3E28B19D71C52E2"""
+"""6140D07DFB58F19B_80055D5542629C0F_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC=C(C=C2)C[N]3C=NC=N3)Br""",21,"""E3E28B19D71C52E2"""
+"""C1E825CAD6E63627_EA616873BD54976F_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(OCC)C=CC(=C2)[N](=O)=O)Br""",21,"""E3E28B19D71C52E2"""
+"""F41DE51C769C2038_9B5ADA06AC5F199C_6005_UN""","""NC1=CC(=C(C(=C1)Br)C3=CC2=C(C=C(OC)C=C2)C=C3)Br""",21,"""E3E28B19D71C52E2"""
+"""B5C4CDF34B4F2BB8_299136736E1610DE_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=C(C=C2C3CC3)Cl)OC)Br""",21,"""E3E28B19D71C52E2"""
+"""022B9FED1680AAD0_5C5FA4FB54BA80EC_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=CC=C2)C3=CC=NC=C3)Br""",21,"""E3E28B19D71C52E2"""
+"""03EA94243685F7D0_0FA3FCA26AC821FD_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(C=CC=C2)CN3CCCC3)Br""",21,"""E3E28B19D71C52E2"""
+"""7581A9290E2D4996_9777AC23D67AC247_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=CC(=N[N]2C3CCCCO3)C)Br""",21,"""E3E28B19D71C52E2"""
+"""1693BB0BE3E6721E_9D7086208F0726BA_6005_UN""","""NC1=CC(=C(C(=C1)Br)C2=C(C=C(C=C2)OC(F)(F)F)F)Br""",21,"""E3E28B19D71C52E2"""
+"""FA59382BD7244AC9_1A334F10105C992C_6036_UN""","""C(CNC1CCCCCCC1)N([S](CCN)(=O)=O)C2CC2""",21,"""E4FB31FFCEA7F434"""
+"""5813D37C4EFF4BDE_814A9F9ABDFF9682_6036_UN""","""C(CNC1CCCCCCC1)N(C(C)C)[S](=O)(=O)CCN""",21,"""E4FB31FFCEA7F434"""
+"""AE527C1F68766E92_D6C5732F53BFB5DE_6036_UN""","""C(CNC1CCCCCCC1)N([S](C)(=O)=O)CCN=C=S""",21,"""E4FB31FFCEA7F434"""
+"""20DB82385366F88F_CBD372971D17CC16_6036_UN""","""C(CNC1CCCCCCC1)N([S](CC)(=O)=O)CCCN""",21,"""E4FB31FFCEA7F434"""
+"""5886E3526466E790_410CD77AEBC3F937_6036_UN""","""C(CNC1CCCCCCC1)N([S](C)(=O)=O)C2CC(C2)N""",21,"""E4FB31FFCEA7F434"""
+"""CECEA106FCCBBA1A_07D6DF7DDBF67BB6_6036_UN""","""C(CNC1CCCCCCC1)N(CCCN)[S](=O)(=O)CCl""",21,"""E4FB31FFCEA7F434"""
+"""CC06BDC9EAEBC759_F237533B0964EEF7_6036_UN""","""C(CNC1CCCCCCC1)N(C)[S](=O)(=O)C2CNCC2""",21,"""E4FB31FFCEA7F434"""
+"""210CC363D970F662_4C6F582CB68B4B33_6036_UN""","""C(CNC1CCCCCCC1)N([S](CC)(=O)=O)CCCBr""",21,"""E4FB31FFCEA7F434"""
+"""A518B715E80DC95A_F8B5D92C1385C8BD_6036_UN""","""C(CNC1CCCCCCC1)N(CCCNC)[S](=O)(=O)C""",21,"""E4FB31FFCEA7F434"""
+"""CC90C89C843E98B3_1DD8D14A9A4CD2E5_6036_UN""","""C(CNC1CCCCCCC1)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""E4FB31FFCEA7F434"""
+"""144B59A5ED37DE23_4F93BB51C673012D_6036_UN""","""C(CNC1CCCCCCC1)N([S](=O)(=O)CC#N)C2CC2""",21,"""E4FB31FFCEA7F434"""
+"""956E1DC581AA17AC_CC47D0272ED5433A_6036_UN""","""C(CNC1CCCCCCC1)N([S](C)(=O)=O)C(=O)CCN""",21,"""E4FB31FFCEA7F434"""
+"""5CAA5D32A21053DE_0A4187D7CA8BF7C9_6036_UN""","""C(CNC1CCCCCCC1)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""E4FB31FFCEA7F434"""
+"""8314D9BFDAF1413E_A8E7DA4EDAC4E588_6036_UN""","""C(CNC1CCCCCCC1)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""E4FB31FFCEA7F434"""
+"""3B5277C556FE5878_65808107058AC5D7_6036_UN""","""C(CNC1CCCCCCC1)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""E4FB31FFCEA7F434"""
+"""368DB3EAD70118A3_91FD2EB0CA8A957E_6036_UN""","""C(CNC1CCCCCCC1)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""E4FB31FFCEA7F434"""
+"""A178D9330E48C607_9B09C9B056F1AD78_6036_UN""","""C(CNC1CCCCCCC1)N(CC(CC)N)[S](=O)(=O)C""",21,"""E4FB31FFCEA7F434"""
+"""73387BB9B3348F84_99279C9154FA1D53_6036_UN""","""C(CNC1CCCCCCC1)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""E4FB31FFCEA7F434"""
+"""CCC504746E0C7152_0AE583DD8E02C6B7_6036_UN""","""C(CNC1CCCCCCC1)N([S](C)(=O)=O)CCN=[N]#N""",21,"""E4FB31FFCEA7F434"""
+"""F55870D7E77F291D_DA54B47B887FC293_6036_UN""","""C(CNC1CCCCCCC1)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""E4FB31FFCEA7F434"""
+"""0706D54ACC4F53C3_905BD3CA1FB1451E_6036_UN""","""C(CNC1CCCCCCC1)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""E4FB31FFCEA7F434"""
+"""760F3F809BCF77A5_7C664DA8159BE111_6036_UN""","""C(CNC1CCCCCCC1)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""E4FB31FFCEA7F434"""
+"""057E7ACCCB2693E5_758BF9CCBECECCAB_6036_UN""","""C(CNC1CCCCCCC1)N([S](=O)(=O)C2CC2)CC#C""",21,"""E4FB31FFCEA7F434"""
+"""ECF8C4B6EC3806B5_218BE34759C0096D_6036_UN""","""C(CNC1CCCCCCC1)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""E4FB31FFCEA7F434"""
+"""D9B756FDAAA62A5B_09E0ACBA7CC44585_6036_UN""","""C(CNC1CCCCCCC1)N2CCCC(C)(C)[S]2(=O)=O""",21,"""E4FB31FFCEA7F434"""
+"""B699EE892AC23A55_C2C957EEF5028E96_6036_UN""","""C(CNC1CCCCCCC1)N2CCCC(CC)[S]2(=O)=O""",21,"""E4FB31FFCEA7F434"""
+"""5BFE09ECE549B6F5_F3A0273490BB3839_6036_UN""","""C(CNC1CCCCCCC1)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""E4FB31FFCEA7F434"""
+"""A3484C29416EAD06_2CBE409AEAB30117_6036_UN""","""C(CNC1CCCCCCC1)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""E4FB31FFCEA7F434"""
+"""C695DA4084CAABC5_87868E033E239C3B_6036_UN""","""C(CNC1CCCCCCC1)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""E4FB31FFCEA7F434"""
+"""D2F6D4578FF0B70E_C7EA3E533B194585_6036_UN""","""C(CNC1CCCCCCC1)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""E4FB31FFCEA7F434"""
+"""C69B954B7878472D_6FA5A487C0045AED_6036_UN""","""C(CNC1CCCCCCC1)N2[S](CCN(C)CC2)(=O)=O""",21,"""E4FB31FFCEA7F434"""
+"""B444939AA12BC682_E332820AA8ADB10E_6036_UN""","""C(CNC1CCCCCCC1)N2CC(=O)NCC[S]2(=O)=O""",21,"""E4FB31FFCEA7F434"""
+"""9D4CD6C6C2A3A674_B6C99F030508769A_6036_UN""","""C(CNC1CCCCCCC1)N2[S](CCCCC2C)(=O)=O""",21,"""E4FB31FFCEA7F434"""
+"""B050AD0D0C8C0FB7_CC61DACFABE89964_6036_UN""","""C(CNC1CCCCCCC1)N(CCN)[S](=O)(=O)C2CC2""",21,"""E4FB31FFCEA7F434"""
+"""44CA7650FF1AC0B8_AA9BFC0E0FC40B93_6036_UN""","""C(CNC1CCCCCCC1)N(CCN)[S](=O)(=O)C(F)F""",21,"""E4FB31FFCEA7F434"""
+"""50E871F6DB232CAF_0A9E606B31CFF571_6036_UN""","""C(CNC1CCCCCCC1)N([S](CC)(=O)=O)C2CNC2""",21,"""E4FB31FFCEA7F434"""
+"""445AA5718ADB9229_3807B457A626A10C_6036_DP""","""C(CNC1CCCCCCC1)N3CC2(CNC2)C[S]3(=O)=O""",21,"""E4FB31FFCEA7F434"""
+"""0DA79CC59919E50A_8272CDC57FE5E566_6036_UN""","""C(CNC1CCCCCCC1)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""E4FB31FFCEA7F434"""
+"""18A1B9B3EC8CBA00_7E9955957687F5D6_6036_UN""","""C(CNC1CCCCCCC1)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""E4FB31FFCEA7F434"""
+"""70ACE8C20E65DE85_40F83222BBB93D4D_6036_UN""","""C(CNC1CCCCCCC1)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""E4FB31FFCEA7F434"""
+"""FC8076153C47E7DD_E6DC7D4C29E12DD6_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC(=CC=C2)OC3CCCC3""",21,"""E72C2C18D87AD40A"""
+"""897E9523E305CE5B_49AB8560D2F1812A_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC(=C(OCC)C=C2)OCC""",21,"""E72C2C18D87AD40A"""
+"""22B2BCC6C8142794_B5ABF2A74D1A7600_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=CC(=C2)OCCC(C)C""",21,"""E72C2C18D87AD40A"""
+"""5B0505C9E5221B68_E9910AF1DE364004_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""E72C2C18D87AD40A"""
+"""FCC9E26E7E403CE1_DAB965305958B6AC_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=C(C=C2)OC3CCOC3""",21,"""E72C2C18D87AD40A"""
+"""4C93124DD237AD41_11588144812F425F_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""E72C2C18D87AD40A"""
+"""50F3CD3909D01BA3_C937A548D5EB53D7_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=CC(=C2)COCCOC""",21,"""E72C2C18D87AD40A"""
+"""3A8F0798003AB4BF_405A2849DB5758BB_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""E72C2C18D87AD40A"""
+"""DA50EFD2B87C9C93_5F413CAAEC1DBFDE_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=CC(=C2)OC(COC)C""",21,"""E72C2C18D87AD40A"""
+"""16A610F314527A17_0D00C49E67A81FF2_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""E72C2C18D87AD40A"""
+"""A81F83A2CAABBB96_18F922AAFCD5BEB0_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""E72C2C18D87AD40A"""
+"""4F608E8F18FD9FAB_61424D860BEF82CD_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC(=CC=C2)CN3CCCC3""",21,"""E72C2C18D87AD40A"""
+"""68D0F65B154C34EE_7866698463836D4D_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""E72C2C18D87AD40A"""
+"""F885CF09A0A78AD0_05923666E495DC24_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=CC(=C2)OCCN(C)C""",21,"""E72C2C18D87AD40A"""
+"""EBB4315AD9E1E473_F24FFAA475F77F1F_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""E72C2C18D87AD40A"""
+"""D61EB10A3D67AC4E_C568C220829D7CAB_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""E72C2C18D87AD40A"""
+"""2A8A406632F07EB3_17A43CA4A8925618_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""E72C2C18D87AD40A"""
+"""AF7E3E5CEFC191A6_C771F22C5DC8620B_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""E72C2C18D87AD40A"""
+"""EF5501C833572DBF_E8E4C6634EEF00CE_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""E72C2C18D87AD40A"""
+"""78A0788214E899CD_EDDF38C692DFD2E7_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""E72C2C18D87AD40A"""
+"""9B1F7E02DF23A14D_28249E31F25F4ED3_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""E72C2C18D87AD40A"""
+"""6984D2A825318EC1_38080E602DB1FA27_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""E72C2C18D87AD40A"""
+"""0F3F03131038D74A_E51B575983120E5D_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""E72C2C18D87AD40A"""
+"""9BC5BA9B4F89195E_7568B3231AEF8488_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""E72C2C18D87AD40A"""
+"""9F99E12F7C24CAF5_50490390FAE04A53_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""E72C2C18D87AD40A"""
+"""40D4E7D5A99F3F4F_36B4B3D1D369FB33_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=C(OCCC(C)C)C=C2""",21,"""E72C2C18D87AD40A"""
+"""6E98A27D64D7B120_CBD9D0C72D236B63_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC=C(C=C2)OC3CCCC3""",21,"""E72C2C18D87AD40A"""
+"""FB59C53AA2DFF477_4AEF09399AD803B7_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""E72C2C18D87AD40A"""
+"""8D03DB6A7C1D7CEE_3F906B0BE0F4A700_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""E72C2C18D87AD40A"""
+"""E77B83755752E6F1_C077AC8737F559ED_6005_UN""","""CC1=C(C=C(C(=C1)N)Br)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""E72C2C18D87AD40A"""
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+"""AB2EBB2F48809A56_3B932D33D166C9A9_6036_DP""","""COC1=C(C=CC(=C1)CCN3CC2(CNC2)C[S]3(=O)=O)N""",21,"""E76FA89BB9E79C91"""
+"""AF74CDA0C4A27062_81E654A108A58DC3_6036_UN""","""COC1=C(C=CC(=C1)CCN(C)[S](=O)(=O)C2=N[NH]C=N2)N""",21,"""E76FA89BB9E79C91"""
+"""F2B1FAEA367426BF_7D0DCCF101C79D73_6036_UN""","""COC1=C(C=CC(=C1)CCN(C)[S](=O)(=O)C2=C[NH]N=C2)N""",21,"""E76FA89BB9E79C91"""
+"""C4BF6C0E9E29B80F_436CAB46CCF955E8_6036_UN""","""COC1=C(C=CC(=C1)CCN(C(C)(C)CN)[S](=O)(=O)C)N""",21,"""E76FA89BB9E79C91"""
+"""9974C703840E6B2A_E621DAF1DA318D7A_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=CC=C2)OC3CCCC3""",21,"""E7D18BA52BAA74A6"""
+"""59A14227D9A09338_495622DD21212186_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=C(OCC)C=C2)OCC""",21,"""E7D18BA52BAA74A6"""
+"""F1B237910A9E814D_B556551ABECAD6AC_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=CC(=C2)OCCC(C)C""",21,"""E7D18BA52BAA74A6"""
+"""849DB3D2B76D6B8A_E96CAD4C2DE6E0A8_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""E7D18BA52BAA74A6"""
+"""95E490F009CF1C06_DA44C28DAA881600_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=C(C=C2)OC3CCOC3""",21,"""E7D18BA52BAA74A6"""
+"""7F91B6B0705D126C_11A526F972FFE2F3_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""E7D18BA52BAA74A6"""
+"""2557CAA1D77FC56E_C9CA02F5263BF37B_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=CC(=C2)COCCOC""",21,"""E7D18BA52BAA74A6"""
+"""9379B0238D0E21A7_40A78FF42887F817_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""E7D18BA52BAA74A6"""
+"""AAAA5984990C1D05_5FBC9B171FCD1F72_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=CC(=C2)OC(COC)C""",21,"""E7D18BA52BAA74A6"""
+"""F2E2FBF79BCB0AAB_0DFD63239478BF5E_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""E7D18BA52BAA74A6"""
+"""9220C17969C14B11_180485170F051E1C_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""E7D18BA52BAA74A6"""
+"""B0E7FF4FA2E7E8AD_61BFEA3BF83F2261_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=CC=C2)CN3CCCC3""",21,"""E7D18BA52BAA74A6"""
+"""EB25E0C803A30A52_789BCE399053CDE1_6004_UN""","""NCCC[N]1C=C(C=N1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""E7D18BA52BAA74A6"""
+"""276B16480C0E0AE7_056F91DB17457C88_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=CC(=C2)OCCN(C)C""",21,"""E7D18BA52BAA74A6"""
+"""3A9C48033E6D2715_F2B25D198627DFB3_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""E7D18BA52BAA74A6"""
+"""4CCBF9268130FBB9_C595659D714DDC07_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""E7D18BA52BAA74A6"""
+"""5B75C7A92B34130B_17599B195B42F6B4_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""E7D18BA52BAA74A6"""
+"""8BE56F5028CF802C_C78C5591AE18C2A7_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""E7D18BA52BAA74A6"""
+"""05DFB889C0EE0896_E81961DEBD3FA062_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""E7D18BA52BAA74A6"""
+"""601A5AE61A8321BB_ED229F7B610F724B_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""E7D18BA52BAA74A6"""
+"""83C9FA5C087E49D3_28D9398C018FEE7F_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""E7D18BA52BAA74A6"""
+"""6A1AF19452B99473_38F5A9DDDE615A8B_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""E7D18BA52BAA74A6"""
+"""557B9CC719BE803D_E5E6F0E470C2AEF1_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""E7D18BA52BAA74A6"""
+"""BEA8CA0F0AF8B392_7595149EE93F2424_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""E7D18BA52BAA74A6"""
+"""9CE298A5B02735B2_50B4A42D0930EAFF_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""E7D18BA52BAA74A6"""
+"""4BF05FC708F309C4_3649146C20B95B9F_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=C(OCCC(C)C)C=C2""",21,"""E7D18BA52BAA74A6"""
+"""87C6AC3EA6314306_CB24777ADEF3CBCF_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=C(C=C2)OC3CCCC3""",21,"""E7D18BA52BAA74A6"""
+"""65305BA7F20CB666_4A12AE846908A31B_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""E7D18BA52BAA74A6"""
+"""7EB8326A0943447C_3F6DCCB6132407AC_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""E7D18BA52BAA74A6"""
+"""02EC372F913A9753_C08A0B3AC425F941_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""E7D18BA52BAA74A6"""
+"""F02BC2BE764D6D7E_370DE2CFEF5CD45F_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""E7D18BA52BAA74A6"""
+"""9DF157C7BE514963_4106CCD32730D334_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""E7D18BA52BAA74A6"""
+"""0D227D6B44CA967C_84365DE9BED4BA4B_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""E7D18BA52BAA74A6"""
+"""07811E422E2BB9E2_EE5268CF41E2B12B_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""E7D18BA52BAA74A6"""
+"""A69145FB2224F68F_9F69DABA50E93FD8_6004_UN""","""NCCC[N]1C=C(C=N1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""E7D18BA52BAA74A6"""
+"""F046A605AC2CA2A9_2DA236CF92A0369A_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""E7D18BA52BAA74A6"""
+"""50C2C90E743F7B8D_586CA447A80CA6A8_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""E7D18BA52BAA74A6"""
+"""F675A2DBC88754CA_0B90FC1E967E07B9_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(C=CC=C2)CN3CCCC3""",21,"""E7D18BA52BAA74A6"""
+"""C85BD2034B82F81B_9344AC9F2ACCE403_6004_UN""","""NCCC[N]1C=C(C=N1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""E7D18BA52BAA74A6"""
+"""CAEF5DB9DC37D796_9943869C73B100FE_6004_UN""","""NCCC[N]1C=C(C=N1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""E7D18BA52BAA74A6"""
+"""29513A53DCF81A3D_167210AB44002E8C_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](CCN)(=O)=O)C2CC2""",21,"""E8BA6E449AFB4394"""
+"""2315974E63941BF4_8D0BC021E9A32122_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C(C)C)[S](=O)(=O)CCN""",21,"""E8BA6E449AFB4394"""
+"""EA36D73A376B0387_DA842C9407E3027E_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](C)(=O)=O)CCN=C=S""",21,"""E8BA6E449AFB4394"""
+"""D0DD9C56DC12B838_C7922D2C494B7BB6_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](CC)(=O)=O)CCCN""",21,"""E8BA6E449AFB4394"""
+"""D03E95620F0D8CC8_4D4D88C1BF9F4E97_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](C)(=O)=O)C2CC(C2)N""",21,"""E8BA6E449AFB4394"""
+"""CA3D35F81ABCAA41_0B9780C68FAACC16_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(CCCN)[S](=O)(=O)CCl""",21,"""E8BA6E449AFB4394"""
+"""4930B6F9041BC11A_FE760C805D385957_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C)[S](=O)(=O)C2CNCC2""",21,"""E8BA6E449AFB4394"""
+"""5DBA675DB3FA4F6E_402E0797E2D7FC93_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](CC)(=O)=O)CCCBr""",21,"""E8BA6E449AFB4394"""
+"""4CD0E88DB4E83B26_F4F4869747D97F1D_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(CCCNC)[S](=O)(=O)C""",21,"""E8BA6E449AFB4394"""
+"""C50CE88FC5ACBC58_11998EF1CE106545_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""E8BA6E449AFB4394"""
+"""BBF73A1BBCBCEC10_43D2E4EA922FB68D_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](=O)(=O)CC#N)C2CC2""",21,"""E8BA6E449AFB4394"""
+"""E31AD59DE1C1A054_C0068F9C7A89F49A_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](C)(=O)=O)C(=O)CCN""",21,"""E8BA6E449AFB4394"""
+"""F168AF4415C31B4D_0600D86C9ED74069_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""E8BA6E449AFB4394"""
+"""CC53DFEDA25268B7_A4A685F58E985228_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""E8BA6E449AFB4394"""
+"""90A2F0A451E627F1_69C1DEBC51D67277_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""E8BA6E449AFB4394"""
+"""43CF07535ACFE620_9DBC710B9ED622DE_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""E8BA6E449AFB4394"""
+"""AEA99748533E74B7_9748960B02AD1AD8_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(CC(CC)N)[S](=O)(=O)C""",21,"""E8BA6E449AFB4394"""
+"""32ADF297FDA4CE53_9566C32A00A6AAF3_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""E8BA6E449AFB4394"""
+"""FE7B1AA3B44CCE67_06A4DC66DA5E7117_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](C)(=O)=O)CCN=[N]#N""",21,"""E8BA6E449AFB4394"""
+"""170D26F3B1ACC3BF_D615EBC0DC237533_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""E8BA6E449AFB4394"""
+"""FB759B867F88E21D_9C1A8C714BEDF2BE_6036_UN""","""COCC(C1=CC(=CC=C1)N)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""E8BA6E449AFB4394"""
+"""F421118F3BCAC852_7027121341C756B1_6036_UN""","""COCC(C1=CC(=CC=C1)N)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""E8BA6E449AFB4394"""
+"""CB9F080FE29F1943_79CAA677EA927B0B_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](=O)(=O)C2CC2)CC#C""",21,"""E8BA6E449AFB4394"""
+"""5AA01D9B13EB1A3C_2DCABCFC0D9CBECD_6036_UN""","""COCC(C1=CC(=CC=C1)N)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""E8BA6E449AFB4394"""
+"""F27A5EE32BD114CD_05A1F3012898F225_6036_UN""","""COCC(C1=CC(=CC=C1)N)N2CCCC(C)(C)[S]2(=O)=O""",21,"""E8BA6E449AFB4394"""
+"""5279C5F9B24990EF_CE880855A15E3936_6036_UN""","""COCC(C1=CC(=CC=C1)N)N2CCCC(CC)[S]2(=O)=O""",21,"""E8BA6E449AFB4394"""
+"""CD0D445F80A3B6F0_FFE1788FC4E78F99_6036_UN""","""COCC(C1=CC(=CC=C1)N)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""E8BA6E449AFB4394"""
+"""A92A91DEBD481184_20FF1F21BEEFB6B7_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""E8BA6E449AFB4394"""
+"""38889375DF87EA28_8BC7D1B86A7F2B9B_6036_UN""","""COCC(C1=CC(=CC=C1)N)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""E8BA6E449AFB4394"""
+"""A15BA3DA471B7300_CBAB61E86F45F225_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""E8BA6E449AFB4394"""
+"""986F7261CB0A5F4A_63E4FB3C9458ED4D_6036_UN""","""COCC(C1=CC(=CC=C1)N)N2[S](CCN(C)CC2)(=O)=O""",21,"""E8BA6E449AFB4394"""
+"""B442E14E9CC692EE_EF73DDB1FCF106AE_6036_UN""","""COCC(C1=CC(=CC=C1)N)N2CC(=O)NCC[S]2(=O)=O""",21,"""E8BA6E449AFB4394"""
+"""510308EEB6A4EF27_BA88C0B85154C13A_6036_UN""","""COCC(C1=CC(=CC=C1)N)N2[S](CCCCC2C)(=O)=O""",21,"""E8BA6E449AFB4394"""
+"""1095AE7229CF7BD6_C0208574FFB42EC4_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(CCN)[S](=O)(=O)C2CC2""",21,"""E8BA6E449AFB4394"""
+"""9517AC3F46772D2E_A6DAA3B55B98BC33_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(CCN)[S](=O)(=O)C(F)F""",21,"""E8BA6E449AFB4394"""
+"""2C4758889E29E7AD_06DF3FD0659342D1_6036_UN""","""COCC(C1=CC(=CC=C1)N)N([S](CC)(=O)=O)C2CNC2""",21,"""E8BA6E449AFB4394"""
+"""DA49C8235CECD871_3446EBECF27A16AC_6036_DP""","""COCC(C1=CC(=CC=C1)N)N3CC2(CNC2)C[S]3(=O)=O""",21,"""E8BA6E449AFB4394"""
+"""6DB3149B4C60F62C_8E33927E2BB952C6_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""E8BA6E449AFB4394"""
+"""EE4EFB968F24671C_72D80A2E22DB4276_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""E8BA6E449AFB4394"""
+"""4DD41B5223F9823F_4CB96D99EFE58AED_6036_UN""","""COCC(C1=CC(=CC=C1)N)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""E8BA6E449AFB4394"""
+"""3452476C6CE2D2FB_E92555202FBE756C_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC(=CC=C2)OC3CCCC3""",21,"""E8D50474DE258CB0"""
+"""3887E2413B7C81E7_4652AD0CD4AED990_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(OCC)C=C2)OCC""",21,"""E8D50474DE258CB0"""
+"""4A63F9DBEA9450F7_BA52DACB4B452EBA_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)OCCC(C)C""",21,"""E8D50474DE258CB0"""
+"""8261F5835D0F582A_E668229DD86918BE_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""E8D50474DE258CB0"""
+"""940828C398DE4219_D5404D5C5F07EE16_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)OC3CCOC3""",21,"""E8D50474DE258CB0"""
+"""696B6329D01D41E2_1EA1A92887701AE5_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""E8D50474DE258CB0"""
+"""04B54FFB77B54FB8_C6CE8D24D3B40B6D_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)COCCOC""",21,"""E8D50474DE258CB0"""
+"""F7C1F3871EDC6AD0_4FA30025DD080001_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""E8D50474DE258CB0"""
+"""E9886424FED91D37_50B814C6EA42E764_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)OC(COC)C""",21,"""E8D50474DE258CB0"""
+"""1CBE9A7FF93DDF98_02F9ECF261F74748_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""E8D50474DE258CB0"""
+"""BD4B35C529443B89_17000AC6FA8AE60A_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""E8D50474DE258CB0"""
+"""1B8749FBB3AE8362_6EBB65EA0DB0DA77_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC(=CC=C2)CN3CCCC3""",21,"""E8D50474DE258CB0"""
+"""C0871BF7E262A7BC_779F41E865DC35F7_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""E8D50474DE258CB0"""
+"""58ACA88EF118C3B9_0A6B1E0AE2CA849E_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC=CC(=C2)OCCN(C)C""",21,"""E8D50474DE258CB0"""
+"""47F04B62DDFD7883_FDB6D2C873A827A5_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""E8D50474DE258CB0"""
+"""0601A39568DC1BD0_CA91EA4C84C22411_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""E8D50474DE258CB0"""
+"""A974601D5E144351_185D14C8AECD0EA2_6004_UN""","""N[S](=O)(=O)C1=C(C=CS1)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""E8D50474DE258CB0"""
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+"""66853FE41BF4700C_2103AFF8BBBBD7E9_6036_UN""","""CCC(CN([S](C)(=O)=O)[C@@H]1CNCC1)NC2=CC=CC=C2""",21,"""E946DE9D9FAF22CA"""
+"""2C9059CACC46679E_8A3B61616F2B4AC5_6036_UN""","""CCC(CN1CCCC(Cl)(Cl)[S]1(=O)=O)NC2=CC=CC=C2""",21,"""E946DE9D9FAF22CA"""
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+"""565358A8A98C6F24_967A89200009C6DB_6036_UN""","""CCC(N)(CN(CC(CC)N)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""E988716F985F9F97"""
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+"""584690487C4D10CC_9D28935A49492EBD_6036_UN""","""CCC(N)(CN1[S](CC(C)(C)C1=O)(=O)=O)C2=CC=CC=C2""",21,"""E988716F985F9F97"""
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+"""29B83F205F0A3A74_78F8B95CE836A708_6036_UN""","""CCC(N)(CN([S](=O)(=O)C1CC1)CC#C)C2=CC=CC=C2""",21,"""E988716F985F9F97"""
+"""778BF34712130FD7_2CF8A3D70F3862CE_6036_UN""","""CCC(N)(CN1[S](=O)(=O)C2(CCC1)CC2)C3=CC=CC=C3""",21,"""E988716F985F9F97"""
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+"""10C83D7F28A7DCDA_FED367A4C643539A_6036_UN""","""CCC(N)(CN1C(C(N)CC[S]1(=O)=O)=O)C2=CC=CC=C2""",21,"""E988716F985F9F97"""
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+"""3836E6FB856870E6_8AF5CE9368DBF798_6036_UN""","""CCC(N)(CN1CCCC(Cl)(Cl)[S]1(=O)=O)C2=CC=CC=C2""",21,"""E988716F985F9F97"""
+"""55035F0C8E9D5A93_CA997EC36DE12E26_6036_UN""","""CCC(N)(CN([S](C)(=O)=O)[C@H]1CNCC1)C2=CC=CC=C2""",21,"""E988716F985F9F97"""
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+"""B453D5D803546ED6_C1129A5FFD10F2C7_6036_UN""","""CCC(N)(CN(CCN)[S](=O)(=O)C1CC1)C2=CC=CC=C2""",21,"""E988716F985F9F97"""
+"""F77270889999829C_A7E8BC9E593C6030_6036_UN""","""CCC(N)(CN(CCN)[S](=O)(=O)C(F)F)C1=CC=CC=C1""",21,"""E988716F985F9F97"""
+"""5720AEE2F86A74CD_07ED20FB67379ED2_6036_UN""","""CCC(N)(CN([S](CC)(=O)=O)C1CNC1)C2=CC=CC=C2""",21,"""E988716F985F9F97"""
+"""90CD3FF34F4241B1_3574F4C7F0DECAAF_6036_DP""","""CCC(N)(CN2CC1(CNC1)C[S]2(=O)=O)C3=CC=CC=C3""",21,"""E988716F985F9F97"""
+"""416BB52BA223DEF4_8F018D55291D8EC5_6036_UN""","""CCC(N)(CN(C)[S](=O)(=O)C1=N[NH]C=N1)C2=CC=CC=C2""",21,"""E988716F985F9F97"""
+"""E14FFCE7B95BF9A0_73EA1505207F9E75_6036_UN""","""CCC(N)(CN(C)[S](=O)(=O)C1=C[NH]N=C1)C2=CC=CC=C2""",21,"""E988716F985F9F97"""
+"""EE388AD7B39C45BE_4D8B72B2ED4156EE_6036_UN""","""CCC(N)(CN(C(C)(C)CN)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""E988716F985F9F97"""
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+"""A0AFA6A43F9F3C40_E29EDCCF478BEC34_6005_UN""","""CC1=NOC(=C1C2=CC=C(C=C2)C[N]3C=CN=C3)C(=O)O""",21,"""EC23FA2641C7783A"""
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+"""86EE613ACE492228_1A57577A1892EE6F_6005_UN""","""CC1=NOC(=C1C2=CC(=C(OC)C=C2)CN(C)C)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""B3CCD1486A8BE170_C23873764C56FFE7_6005_UN""","""CC1=NOC(=C1C2=CC=CC(=C2)COCCOC)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""D1295691B4EC96EC_4B55FE7742EAF48B_6005_UN""","""CC1=NOC(=C1C2=CC=CC(=C2)CN(C)C3CC3)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""2F60076772A97085_544EEA9475A013EE_6005_UN""","""CC1=NOC(=C1C2=CC=CC(=C2)OC(COC)C)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""DAF1F321A57640F8_060F12A0FE15B3C2_6005_UN""","""CC1=NOC(=C1C2=CC(=C(C(NOC)=O)C=C2)F)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""770A8217D711590D_13F6F49465681280_6005_UN""","""CC1=NOC(=C1C2=C(OC)N=C(C=C2)C(F)(F)F)C(=O)O""",21,"""EC23FA2641C7783A"""
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+"""D0408FF38D71D1CD_0E9DE0587D287014_6005_UN""","""CC1=NOC(=C1C2=CC=CC(=C2)OCCN(C)C)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""DE462E3235A3FB7F_F9402C9AEC4AD32F_6005_UN""","""CC1=NOC(=C1C2=C(C=C(C(C)C)C=C2)C(C)C)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""B012755A7917B13F_CE67141E1B20D09B_6005_UN""","""CC1=NOC(=C1C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O""",21,"""EC23FA2641C7783A"""
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+"""217E4593D9B0D771_E3EB105DD752ACFE_6005_UN""","""CC1=NOC(=C1C2=C(C=C(OC)C=C2)C(F)(F)F)C(=O)O""",21,"""EC23FA2641C7783A"""
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+"""AC9D3A91C73AD081_3307D85EB40C5617_6005_UN""","""CC1=NOC(=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""D9A74F413B571DF8_EE1481671AAFA26D_6005_UN""","""CC1=NOC(=C1C2=CC(=CC=C2)C3=CC=CC=C3)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""71CBFD8467FC52A1_7E67651D835228B8_6005_UN""","""CC1=NOC(=C1C2=C(OC)C=C(C=C2)C(F)(F)F)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""ED711D5B3EEEB953_5B46D5AE635DE663_6005_UN""","""CC1=NOC(=C1C2=C(C)C=C(C=C2)OC(F)(F)F)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""EAB3123A2505CF26_3DBB65EF4AD45703_6005_UN""","""CC1=NOC(=C1C2=CC=C(OCCC(C)C)C=C2)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""2C988A02133F260B_C0D606F9B49EC753_6005_UN""","""CC1=NOC(=C1C2=CC=C(C=C2)OC3CCCC3)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""EE6A1EAD0E9FD90B_41E0DF070365AF87_6005_UN""","""CC1=NOC(=C1C2=C(C=C(OC)C=C2)CN(C)C)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""D64EF7CE47A71721_349FBD3579490B30_6005_UN""","""CC1=NOC(=C1C2=CC(=C(N=C2)C(F)(F)F)OC)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""25150E0BF76CBA5D_CB787AB9AE48F5DD_6005_UN""","""CC1=NOC(=C1C2=C(C)C=C(C=C2)OCC3CC3)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""C66FF29329F33667_3CFF934C8531D8C3_6005_UN""","""CC1=NOC(=C1C2=C(C=CC(=C2)C3(CC3)C#N)F)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""20AD363623F2954B_4AF4BD504D5DDFA8_6005_UN""","""CC1=NOC(=C1C2=C(OCC(C)(C)C)N=CC=C2)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""E92CC44C23CD8112_8FC42C6AD4B9B6D7_6005_UN""","""CC1=NOC(=C1C2=CC=C(C=C2)C[N]3C=NC=N3)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""4B8722110C3EE98F_E5A0194C2B8FBDB7_6005_UN""","""CC1=NOC(=C1C2=C(OCC)C=CC(=C2)[N](=O)=O)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""B79007980BEE30D3_949BAB393A843344_6005_UN""","""CC1=NOC(=C1C3=CC2=C(C=C(OC)C=C2)C=C3)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""D6E941A3003ED14F_2650474CF8CD3A06_6005_UN""","""CC1=NOC(=C1C2=CC(=C(C=C2C3CC3)Cl)OC)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""BFEC0DA1D5AB377A_539ED5C4C261AA34_6005_UN""","""CC1=NOC(=C1C2=CC(=CC=C2)C3=CC=NC=C3)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""B1963E51A2223A6F_00628D9DFC130B25_6005_UN""","""CC1=NOC(=C1C2=C(C=CC=C2)CN3CCCC3)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""6D72BCDDA4BFB341_98B6DD1C40A1E89F_6005_UN""","""CC1=NOC(=C1C2=CC(=N[N]2C3CCCCO3)C)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""0F4F3EFFA5A5289A_92B1F71F19DC0C62_6005_UN""","""CC1=NOC(=C1C2=C(C=C(C=C2)OC(F)(F)F)F)C(=O)O""",21,"""EC23FA2641C7783A"""
+"""1ED4D7CFD50690B5_EDA15A26810787A5_6005_UN""","""COCC1=C(C=CC=C1)C2=CC(=CC=C2)OC3CCCC3""",21,"""EC510B72709C7E79"""
+"""FFB488A0993F8FB0_42D6A20A7A172B59_6005_UN""","""COCC1=C(C=CC=C1)C2=CC(=C(OCC)C=C2)OCC""",21,"""EC510B72709C7E79"""
+"""C033C229C589EC7B_BED6D5CDE5FCDC73_6005_UN""","""COCC1=C(C=CC=C1)C2=CC=CC(=C2)OCCC(C)C""",21,"""EC510B72709C7E79"""
+"""6F7EC6F962DAB28F_E2EC2D9B76D0EA77_6005_UN""","""COCC1=C(C=CC=C1)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""EC510B72709C7E79"""
+"""DAD5EDA4581383C2_D1C4425AF1BE1CDF_6005_UN""","""COCC1=C(C=CC=C1)C2=CC=C(C=C2)OC3CCOC3""",21,"""EC510B72709C7E79"""
+"""B35055B2ED683944_1A25A62E29C9E82C_6005_UN""","""COCC1=C(C=CC=C1)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""EC510B72709C7E79"""
+"""DA754FA8D761F5A1_C24A82227D0DF9A4_6005_UN""","""COCC1=C(C=CC=C1)C2=CC=CC(=C2)COCCOC""",21,"""EC510B72709C7E79"""
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+"""554664E9E18EAA66_6A3F6AECA30928BE_6005_UN""","""COCC1=C(C=CC=C1)C2=CC(=CC=C2)CN3CCCC3""",21,"""EC510B72709C7E79"""
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+"""707E0192AE907C24_3375290A85575054_6005_UN""","""COCC1=C(C=CC=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""EC510B72709C7E79"""
+"""B8BAC6DB54269732_EE6670332BF4A42E_6005_UN""","""COCC1=C(C=CC=C1)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""EC510B72709C7E79"""
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+"""AF42EEB280044211_3C8D6218B46ADE80_6005_UN""","""COCC1=C(C=CC=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""EC510B72709C7E79"""
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+"""450C1C97F44B6D3D_E5D2E8181AD4BBF4_6005_UN""","""COCC1=C(C=CC=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""EC510B72709C7E79"""
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+"""D3B30DAACD5941CF_2622B618C9963C45_6005_UN""","""COCC1=C(C=CC=C1)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""EC510B72709C7E79"""
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+"""0D852DD0240B1D9B_00107CC9CD480D66_6005_UN""","""COCC1=C(C=CC=C1)C2=C(C=CC=C2)CN3CCCC3""",21,"""EC510B72709C7E79"""
+"""4C3AE1CAD2CB2A33_98C42C4871FAEEDC_6005_UN""","""COCC1=C(C=CC=C1)C2=CC(=N[N]2C3CCCCO3)C""",21,"""EC510B72709C7E79"""
+"""5A9AA83F17B92171_92C3064B28870A21_6005_UN""","""COCC1=C(C=CC=C1)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""EC510B72709C7E79"""
+"""E3486CBE0B153C43_ED6A701F1727049B_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=CC=C2)OC3CCCC3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""673EDF31931A1135_421D8833EC37A867_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=C(OCC)C=C2)OCC)N)N""",21,"""EC9A214BE6BCFD47"""
+"""D9A1C6307E6507C8_BE1DFFF473DC5F4D_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=CC(=C2)OCCC(C)C)N)N""",21,"""EC9A214BE6BCFD47"""
+"""0F553F0C0AB0A769_E22707A2E0F06949_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""7E3A114228A84466_D10F6863679E9FE1_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=C(C=C2)OC3CCOC3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""12ACB833730A3042_1AEE8C17BFE96B12_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=C(OC)C=C2)CN(C)C)N)N""",21,"""EC9A214BE6BCFD47"""
+"""00D75091DF123F22_C281A81BEB2D7A9A_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=CC(=C2)COCCOC)N)N""",21,"""EC9A214BE6BCFD47"""
+"""852B2AF046855151_4BEC251AE59171F6_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=CC(=C2)CN(C)C3CC3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""DEB0A9F1FC2F9AA4_54F731F9D2DB9693_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=CC(=C2)OC(COC)C)N)N""",21,"""EC9A214BE6BCFD47"""
+"""867A8D06F9F81D3A_06B6C9CD596E36BF_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=C(C(NOC)=O)C=C2)F)N)N""",21,"""EC9A214BE6BCFD47"""
+"""6802C5CD54164EDE_134F2FF9C21397FD_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)N)N""",21,"""EC9A214BE6BCFD47"""
+"""34B53E0403394BF0_6AF440D53529AB80_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=CC=C2)CN3CCCC3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""0CB8D2C7F02E0EC6_73D064D75D454400_6005_UN""","""CC1=C(C(=CC(=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""F51196C76ED5A1BA_0E243B35DA53F569_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=CC(=C2)OCCN(C)C)N)N""",21,"""EC9A214BE6BCFD47"""
+"""6E1DE8EAAA629AB1_F9F9F7F74B315652_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)N)N""",21,"""EC9A214BE6BCFD47"""
+"""AB9D69AA4C8B75A7_CEDECF73BC5B55E6_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=C(C=C2)C3=CC=CC=C3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""F76BFD86B7A35C3F_1C1231F796547F55_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(C=CC=C2F)OC(F)(F)F)N)N""",21,"""EC9A214BE6BCFD47"""
+"""8CF5402CA9CA9FAA_CCC7FF7F630E4B46_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)N)N""",21,"""EC9A214BE6BCFD47"""
+"""E019E1D2F0B04DC2_E352CB3070292983_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)N)N""",21,"""EC9A214BE6BCFD47"""
+"""D9FA6D8282E7D20B_E6693595AC19FBAA_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=CC(=C2F)C(N(C)C)=O)N)N""",21,"""EC9A214BE6BCFD47"""
+"""1A33D89EF6F2D5F3_23929362CC99679E_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)N)N""",21,"""EC9A214BE6BCFD47"""
+"""91BFAF535BDDBB8A_33BE03331377D36A_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N)N""",21,"""EC9A214BE6BCFD47"""
+"""20F950119DC69C1D_EEAD5A0ABDD42710_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=CC=C2)C3=CC=CC=C3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""D497CC984207FB6C_7EDEBE702429ADC5_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)N)N""",21,"""EC9A214BE6BCFD47"""
+"""449D529610C2A7E6_5BFF0EC3C426631E_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(C)C=C(C=C2)OC(F)(F)F)N)N""",21,"""EC9A214BE6BCFD47"""
+"""6AA0B150ED865DDE_3D02BE82EDAFD27E_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=C(OCCC(C)C)C=C2)N)N""",21,"""EC9A214BE6BCFD47"""
+"""247171726B49FC63_C06FDD9413E5422E_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=C(C=C2)OC3CCCC3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""619AB25A61638220_4159046AA41E2AFA_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(C=C(OC)C=C2)CN(C)C)N)N""",21,"""EC9A214BE6BCFD47"""
+"""5A175D4CEDE4B5E8_34266658DE328E4D_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=C(N=C2)C(F)(F)F)OC)N)N""",21,"""EC9A214BE6BCFD47"""
+"""E8AF07E2A14706A1_CBC1A1D4093370A0_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(C)C=C(C=C2)OCC3CC3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""91CB586059913D13_3C464821224A5DBE_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(C=CC(=C2)C3(CC3)C#N)F)N)N""",21,"""EC9A214BE6BCFD47"""
+"""FB64136287D57290_4A4D663DEA265AD5_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(OCC(C)(C)C)N=CC=C2)N)N""",21,"""EC9A214BE6BCFD47"""
+"""B7621BEE8FB93615_8F7DF70773C233AA_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC=C(C=C2)C[N]3C=NC=N3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""58EB710976F66A08_E519C2218CF438CA_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(OCC)C=CC(=C2)[N](=O)=O)N)N""",21,"""EC9A214BE6BCFD47"""
+"""DCB20A108797696F_942270549DFFB639_6005_UN""","""CC1=C(C(=CC(=C1)C3=CC2=C(C=C(OC)C=C2)C=C3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""D76F50A16A1A5D54_26E99C215FB6BF7B_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=C(C=C2C3CC3)Cl)OC)N)N""",21,"""EC9A214BE6BCFD47"""
+"""1A6D0346671769FC_53270EA9651A2F49_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=CC=C2)C3=CC=NC=C3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""E8527769D13A9641_00DB56F05B688E58_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(C=CC=C2)CN3CCCC3)N)N""",21,"""EC9A214BE6BCFD47"""
+"""674E1FD4CA4C0450_980F0671E7DA6DE2_6005_UN""","""CC1=C(C(=CC(=C1)C2=CC(=N[N]2C3CCCCO3)C)N)N""",21,"""EC9A214BE6BCFD47"""
+"""6696C74D938D5E98_92082C72BEA7891F_6005_UN""","""CC1=C(C(=CC(=C1)C2=C(C=C(C=C2)OC(F)(F)F)F)N)N""",21,"""EC9A214BE6BCFD47"""
+"""3778C10803828755_13C15A5573E31D33_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](CCN)(=O)=O)C3CC3""",21,"""ED0924BAAD18702B"""
+"""8B63F650E0386E22_88B88ADFDE40129D_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C(C)C)[S](=O)(=O)CCN""",21,"""ED0924BAAD18702B"""
+"""B87BDB787E8D5EFB_DF37666A300031C1_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](C)(=O)=O)CCN=C=S""",21,"""ED0924BAAD18702B"""
+"""D52D3362B4737BA1_C22167D27EA84809_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](CC)(=O)=O)CCCN""",21,"""ED0924BAAD18702B"""
+"""3412B0E84A4A6E89_48FEC23F887C7D28_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""ED0924BAAD18702B"""
+"""937CF913A0F65134_0E24CA38B849FFA9_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(CCCN)[S](=O)(=O)CCl""",21,"""ED0924BAAD18702B"""
+"""5EB02ADEE7416CC3_FBC5467E6ADB6AE8_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C)[S](=O)(=O)C3CNCC3""",21,"""ED0924BAAD18702B"""
+"""3C610F0785E60730_459D4D69D534CF2C_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](CC)(=O)=O)CCCBr""",21,"""ED0924BAAD18702B"""
+"""75C870AF365C653A_F147CC69703A4CA2_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(CCCNC)[S](=O)(=O)C""",21,"""ED0924BAAD18702B"""
+"""B1879D69D656A499_142AC40FF9F356FA_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""ED0924BAAD18702B"""
+"""D075CC1AB752F4C9_4661AE14A5CC8532_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](=O)(=O)CC#N)C3CC3""",21,"""ED0924BAAD18702B"""
+"""263FE4CEE1762E84_C5B5C5624D6AC725_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](C)(=O)=O)C(=O)CCN""",21,"""ED0924BAAD18702B"""
+"""B73D6F14DE39FA49_03B39292A93473D6_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""ED0924BAAD18702B"""
+"""2D0583F19650C18C_A115CF0BB97B6197_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""ED0924BAAD18702B"""
+"""D969A73BBB8DC084_6C729442663541C8_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""ED0924BAAD18702B"""
+"""E31365165E906442_980F3BF5A9351161_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""ED0924BAAD18702B"""
+"""7CEDCFA1C8BEDD34_92FBDCF5354E2967_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(CC(CC)N)[S](=O)(=O)C""",21,"""ED0924BAAD18702B"""
+"""208B34A613DC0088_90D589D43745994C_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""ED0924BAAD18702B"""
+"""17BCE420CB02086F_03179698EDBD42A8_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""ED0924BAAD18702B"""
+"""0061A897BD2DFF01_D3A6A13EEBC0468C_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""ED0924BAAD18702B"""
+"""FDDB78917218FA35_99A9C68F7C0EC101_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""ED0924BAAD18702B"""
+"""B589DD717BBA77D0_759458ED7624650E_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""ED0924BAAD18702B"""
+"""10C8500A40BC4BB4_7C79EC89DD7148B4_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](=O)(=O)C3CC3)CC#C""",21,"""ED0924BAAD18702B"""
+"""BC6838F9BECDFE4A_2879F6023A7F8D72_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""ED0924BAAD18702B"""
+"""9450EA0675841268_0012B9FF1F7BC19A_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""ED0924BAAD18702B"""
+"""01C3293EC6BB82FF_CB3B42AB96BD0A89_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N3CCCC(CC)[S]3(=O)=O""",21,"""ED0924BAAD18702B"""
+"""93170198A05BD537_FA523271F304BC26_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""ED0924BAAD18702B"""
+"""AEEEAF0EC8816336_254C55DF890C8508_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""ED0924BAAD18702B"""
+"""9AB6F39946CBC765_8E749B465D9C1824_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""ED0924BAAD18702B"""
+"""FD7A95657DF28B85_CE182B1658A6C19A_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""ED0924BAAD18702B"""
+"""AC63716B84D87643_6657B1C2A3BBDEF2_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N3[S](CCN(C)CC3)(=O)=O""",21,"""ED0924BAAD18702B"""
+"""88738AA5D485B162_EAC0974FCB123511_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N3CC(=O)NCC[S]3(=O)=O""",21,"""ED0924BAAD18702B"""
+"""57D037B0D62D2CD2_BF3B8A4666B7F285_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N3[S](CCCCC3C)(=O)=O""",21,"""ED0924BAAD18702B"""
+"""B98040DD37DEA9F4_C593CF8AC8571D7B_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(CCN)[S](=O)(=O)C3CC3""",21,"""ED0924BAAD18702B"""
+"""C1C9D0573471068D_A369E94B6C7B8F8C_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(CCN)[S](=O)(=O)C(F)F""",21,"""ED0924BAAD18702B"""
+"""732658673A7835AF_036C752E5270716E_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N([S](CC)(=O)=O)C3CNC3""",21,"""ED0924BAAD18702B"""
+"""FB77C4FE26640F50_31F5A112C5992513_6036_DP""","""C2(CCC1=C(C=CC(=C1)Br)C2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""ED0924BAAD18702B"""
+"""3487A73E146F4257_8B80D8801C5A6179_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""ED0924BAAD18702B"""
+"""07097A289D09BBF6_776B40D0153871C9_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""ED0924BAAD18702B"""
+"""EC57FBDF2386A844_490A2767D806B952_6036_UN""","""C2(CCC1=C(C=CC(=C1)Br)C2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""ED0924BAAD18702B"""
+"""6CA125666807E12D_ECB6A9B09727B554_6005_UN""","""C[N]1N=CC(=C1C2=CC(=CC=C2)OC3CCCC3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""317E52BB861B1348_43C1519C6C3719A8_6005_UN""","""C[N]1N=CC(=C1C2=CC(=C(OCC)C=C2)OCC)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""94CF0685A9F04DA2_BFC1265BF3DCEE82_6005_UN""","""C[N]1N=CC(=C1C2=CC=CC(=C2)OCCC(C)C)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""AA1F03FD57A0FDF9_E3FBDE0D60F0D886_6005_UN""","""C[N]1N=CC(=C1C2=CC=C(C=C2)C[N]3C=CN=C3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""F1BBB03693221693_D0D3B1CCE79E2E2E_6005_UN""","""C[N]1N=CC(=C1C2=CC=C(C=C2)OC3CCOC3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""2F8F46F0D7CA29A9_1B3255B83FE9DADD_6005_UN""","""C[N]1N=CC(=C1C2=CC(=C(OC)C=C2)CN(C)C)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""96E9DAFD81F311ED_C35D71B46B2DCB55_6005_UN""","""C[N]1N=CC(=C1C2=CC=CC(=C2)COCCOC)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""5AFD49FC341F765D_4A30FCB56591C039_6005_UN""","""C[N]1N=CC(=C1C2=CC=CC(=C2)CN(C)C3CC3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""579F270EF6FD4361_552BE85652DB275C_6005_UN""","""C[N]1N=CC(=C1C2=CC=CC(=C2)OC(COC)C)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""8ED1C59A96E55F7B_076A1062D96E8770_6005_UN""","""C[N]1N=CC(=C1C2=CC(=C(C(NOC)=O)C=C2)F)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""4B9100A48B8ACB0B_1293F65642132632_6005_UN""","""C[N]1N=CC(=C1C2=C(OC)N=C(C=C2)C(F)(F)F)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""039262DBAE88C9C5_6B28997AB5291A4F_6005_UN""","""C[N]1N=CC(=C1C2=CC(=CC=C2)CN3CCCC3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""9178EFC17FC7334E_720CBD78DD45F5CF_6005_UN""","""C[N]1N=CC(=C1C3=CC=C([N]2C=C(C)C=N2)C=C3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""A78185B384E23DF8_0FF8E29A5A5344A6_6005_UN""","""C[N]1N=CC(=C1C2=CC=CC(=C2)OCCN(C)C)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""A19809D4C1FACD7C_F8252E58CB31E79D_6005_UN""","""C[N]1N=CC(=C1C2=C(C=C(C(C)C)C=C2)C(C)C)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""DB00A55D3C4AF867_CF0216DC3C5BE429_6005_UN""","""C[N]1N=CC(=C1C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""9EB72B68CA4A8070_1DCEE8581654CE9A_6005_UN""","""C[N]1N=CC(=C1C2=C(C=CC=C2F)OC(F)(F)F)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""412C43F12FA6787C_CD1B26D0E30EFA89_6005_UN""","""C[N]1N=CC(=C1C2=CC(=C(C=C2)Cl)OC(F)(F)F)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""8C605E15212CD27B_E28E129FF029984C_6005_UN""","""C[N]1N=CC(=C1C2=C(C=C(OC)C=C2)C(F)(F)F)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""A044E8B6773E6E64_E7B5EC3A2C194A65_6005_UN""","""C[N]1N=CC(=C1C2=CC=CC(=C2F)C(N(C)C)=O)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""C453F76D8DDA1B01_224E4ACD4C99D651_6005_UN""","""C[N]1N=CC(=C1C2=CC(=C(OC)C=C2)C(F)(F)F)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""FFB272D239C68743_3262DA9C937762A5_6005_UN""","""C[N]1N=CC(=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""5375EF48C475FEAD_EF7183A53DD496DF_6005_UN""","""C[N]1N=CC(=C1C2=CC(=CC=C2)C3=CC=CC=C3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""18B0903EAE0FA83B_7F0267DFA4291C0A_6005_UN""","""C[N]1N=CC(=C1C2=C(OC)C=C(C=C2)C(F)(F)F)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""087F89F12FE1C763_5A23D76C4426D2D1_6005_UN""","""C[N]1N=CC(=C1C2=C(C)C=C(C=C2)OC(F)(F)F)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""17D458EE62B2DACC_3CDE672D6DAF63B1_6005_UN""","""C[N]1N=CC(=C1C2=CC=C(OCCC(C)C)C=C2)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""75D76FAA7D8929E2_C1B3043B93E5F3E1_6005_UN""","""C[N]1N=CC(=C1C2=CC=C(C=C2)OC3CCCC3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""F16ECE6CFF5233B9_4085DDC5241E9B35_6005_UN""","""C[N]1N=CC(=C1C2=C(C=C(OC)C=C2)CN(C)C)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""22C15A0AC31581A5_35FABFF75E323F82_6005_UN""","""C[N]1N=CC(=C1C2=CC(=C(N=C2)C(F)(F)F)OC)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""E81E66C57D2998A9_CA1D787B8933C16F_6005_UN""","""C[N]1N=CC(=C1C2=C(C)C=C(C=C2)OCC3CC3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""F243A6A580C95CC3_3D9A918EA24AEC71_6005_UN""","""C[N]1N=CC(=C1C2=C(C=CC(=C2)C3(CC3)C#N)F)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""597A4B668D9758BD_4B91BF926A26EB1A_6005_UN""","""C[N]1N=CC(=C1C2=C(OCC(C)(C)C)N=CC=C2)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""ADFC7AAB3EC9E262_8EA12EA8F3C28265_6005_UN""","""C[N]1N=CC(=C1C2=CC=C(C=C2)C[N]3C=NC=N3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""4BCDF9119EC6F15C_E4C51B8E0CF48905_6005_UN""","""C[N]1N=CC(=C1C2=C(OCC)C=CC(=C2)[N](=O)=O)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""4136E944ABC1FC34_95FEA9FB1DFF07F6_6005_UN""","""C[N]1N=CC(=C1C3=CC2=C(C=C(OC)C=C2)C=C3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""75BF70A7FEDBF0B0_2735458EDFB60EB4_6005_UN""","""C[N]1N=CC(=C1C2=CC(=C(C=C2C3CC3)Cl)OC)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""73E86B7A22FD8121_52FBD706E51A9E86_6005_UN""","""C[N]1N=CC(=C1C2=CC(=CC=C2)C3=CC=NC=C3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""5DA1C1786FFF5092_01078F5FDB683F97_6005_UN""","""C[N]1N=CC(=C1C2=C(C=CC=C2)CN3CCCC3)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""49AE91214684B18A_99D3DFDE67DADC2D_6005_UN""","""C[N]1N=CC(=C1C2=CC(=N[N]2C3CCCCO3)C)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""15F1503468C7599C_93D4F5DD3EA738D0_6005_UN""","""C[N]1N=CC(=C1C2=C(C=C(C=C2)OC(F)(F)F)F)C(=O)O""",21,"""ED46F8E466BC4C88"""
+"""64A7F4C030860A8B_666253CD7912B9FF_6006_UN""","""COC1=CC3=C(C(=C1)C2=CN=C(OC)C=C2)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""25784E6D8CFC771E_64B331AC8BC14CCE_6006_UN""","""COC1=CC3=C(C(=C1)C2=CC(=C(N=C2)O)C)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""CDE45CC7B97D1B72_B8B5FA32FBA49082_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C=CC=C2F)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""C7EF523562208A31_9492FF753825D4A7_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C=CC(=C2)C)C)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""3BE8506AFA258338_C24751F50EA0365B_6006_UN""","""COC1=CC3=C(C(=C1)C2=CC=C(SC)C=C2)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""DF58314F46C9E881_25A807342036C1BF_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C(=CC=C2)Cl)Cl)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""4F9786020623D8CA_922ED1B493601453_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(N=C(C=C2)O)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""E139F8BA690FEE21_D59D25BDA55EAFED_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C)C=NC(=C2)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""C5823BBAF17EEF56_BFF86A0F23AB94E1_6006_UN""","""COC1=CC3=C(C(=C1)C2=CC(=C(C=C2)F)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""536C38603F7968ED_96412B1585481A37_6006_UN""","""COC1=CC3=C(C(=C1)C2=CC(=C(C)C=C2)C)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""E4694B1DB84ADE68_46534C6CF1CBC05B_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(SC)C=CC=C2)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""747323DA97F0A469_EC285EC8398942CF_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C)C=CC=C2C)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""BFAC2B71F81FF61E_6358EA2320378006_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C)C(=NC=C2)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""4F0E35334481522C_5CD16F93EA970EDE_6006_UN""","""COC1=CC3=C(C(=C1)C2=CSC=C2C(F)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""3678344DE8A901FD_7F507EC4B077CCB9_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C(=CC=C2)Cl)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""73386D4DC9747461_BA522D5B2D0237CC_6006_UN""","""COC1=CC3=C(C(=C1)C2=CC(=C(C=C2)F)Cl)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""8CAD24CFED724EE6_FBB85E5CF29021FA_6006_UN""","""COC1=CC3=C(C(=C1)C2=CC(=CC=C2)CF)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""D655FFD5CC879D6E_EA847496AA2C3D8E_6006_UN""","""COC1=CC3=C(C(=C1)C2=CC=C(C=C2)CF)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""D61DA8910134CE70_8DA62B124BBD8238_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C)C=C(C=C2)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""532B14B7868FFFB1_3ED80FEDF78EC47B_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(CC)C=CC=C2)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""A127E96BF0129819_EC9CE1C445A380A7_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C=CC(=C2)F)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""954C46822B26E8E3_411C3A90198E2258_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(OC)N=CC=C2)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""FE581788C0800A28_2CA351771D2C20CE_6006_UN""","""COC1=CC3=C(C(=C1)C2=CC(=NC=C2)OC)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""5A292291E1906B67_4B029A268620DB1E_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C=C(C)C=C2)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""597EE2E6683D5353_6014FD16F8B02843_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C(=CC=C2)Br)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""307840BCA821B954_74D3AA593C5BC800_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C=C(C)C=C2)C)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""C559BA16EF5F8CC0_CCACDCAAA9C2F691_6006_UN""","""COC1=CC3=C(C(=C1)C2=CC=CC(=C2)CC)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""3ACE875202055C97_0EB480F7761ADA1C_6006_UN""","""COC1=CC3=C(C(=C1)C2=C([N](C)N=C2)C#N)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""D85EA124628587BA_E89205CC16B61083_6006_UN""","""COC1=CC3=C(C(=C1)C2=C(C)C=CC(=C2)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""5D4DFA9B88D4E27C_ED198C0C93AB401F_6006_UN""","""COC1=CC3=C(C(=C1)C2=CC(=C(C=C2)Cl)F)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""FE5E43AD57156AA1_F1246709FF5AB9EE_6006_UN""","""COC1=CC3=C(C(=C1)C2=CN=C(NC)C=C2)CCCC3=O""",21,"""ED59ABB7D2FEBE98"""
+"""687AC87237BAA134_4D5CBB52379EB7BF_2201_UN""","""COC1=CC2=C(C(=C1)Cl)CCC3=CC4=C(N=C23)N=CC=C4""",21,"""ED59ABB7D2FEBE98"""
+"""437CC47821264DDC_FBC1467953E96056_2201_UN""","""COC1=CC2=C(C(=C1)Cl)CCC3=CC4=C(N=C23)C=CN=C4""",21,"""ED59ABB7D2FEBE98"""
+"""79CB39C0F236D502_218D0EFC20369925_2201_UN""","""COC1=CC3=C(C(=C1)Cl)CCC4=C(C)C2=NON=C2N=C34""",21,"""ED59ABB7D2FEBE98"""
+"""4BD2E634EF741A5A_CC693FB6CD11D81C_2201_UN""","""COC1=CC3=C(C(=C1)Cl)CCC4=C(C)C2=C(SC=C2)N=C34""",21,"""ED59ABB7D2FEBE98"""
+"""B39B4250483DE470_C454C5092E6149F2_2201_UN""","""COC1=CC3=C(C(=C1)Cl)CCC4=CC2=C([N](C)N=C2)N=C34""",21,"""ED59ABB7D2FEBE98"""
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+"""B0CAD56428070FAA_E19217D119B1C93D_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""EF2F31381FFD5D33"""
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+"""F1570DF4AAF08A49_485935691CD0D182_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""EF2F31381FFD5D33"""
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+"""3343423D39921921_0503D9BEA02F96CB_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""EF2F31381FFD5D33"""
+"""7C9499A1DCD0C19D_10FA3F8A3B523789_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""EF2F31381FFD5D33"""
+"""7FC174D3F9A3EE32_694150A6CC680BF4_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC(=CC=C2)CN3CCCC3""",21,"""EF2F31381FFD5D33"""
+"""3DCDE8546455FE3F_706574A4A404E474_6004_UN""","""CNCC1=CC(=C[N]1C)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""EF2F31381FFD5D33"""
+"""1B9DEAD5A26A9A2D_0D912B462312551D_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC=CC(=C2)OCCN(C)C""",21,"""EF2F31381FFD5D33"""
+"""FD37442270D38E01_FA4CE784B270F626_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""EF2F31381FFD5D33"""
+"""0F55A6FF4E4F1C16_CD6BDF00451AF592_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""EF2F31381FFD5D33"""
+"""F1DE9BA1ECE59721_1FA721846F15DF21_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""EF2F31381FFD5D33"""
+"""91F64FE5753FD232_CF72EF0C9A4FEB32_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""EF2F31381FFD5D33"""
+"""6E8FBDAFB9910635_E0E7DB43896889F7_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""EF2F31381FFD5D33"""
+"""2E05AE3583DD2DDE_E5DC25E655585BDE_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""EF2F31381FFD5D33"""
+"""312AE1DEB0152162_2027831135D8C7EA_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""EF2F31381FFD5D33"""
+"""79BA994FDD5C83E5_300B1340EA36731E_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""EF2F31381FFD5D33"""
+"""33F7EEEB4EB04297_ED184A7944958764_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""EF2F31381FFD5D33"""
+"""F14FB150EEFB4CC9_7D6BAE03DD680DB1_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""EF2F31381FFD5D33"""
+"""41441701F68C8C18_584A1EB03D67C36A_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""EF2F31381FFD5D33"""
+"""AE25F01F9A1C0A45_3EB7AEF114EE720A_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC=C(OCCC(C)C)C=C2""",21,"""EF2F31381FFD5D33"""
+"""1BE420E9F1016D36_C3DACDE7EAA4E25A_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC=C(C=C2)OC3CCCC3""",21,"""EF2F31381FFD5D33"""
+"""678B6246389955B2_42EC14195D5F8A8E_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""EF2F31381FFD5D33"""
+"""DC9E2029BB7B12EE_3793762B27732E39_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""EF2F31381FFD5D33"""
+"""01ED85AFB4041679_C874B1A7F072D0D4_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""EF2F31381FFD5D33"""
+"""4C6DBACCA4E58704_3FF35852DB0BFDCA_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""EF2F31381FFD5D33"""
+"""499AD3FE739D6010_49F8764E1367FAA1_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""EF2F31381FFD5D33"""
+"""0FEA54A44D2A7D75_8CC8E7748A8393DE_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""EF2F31381FFD5D33"""
+"""130D61A583654F50_E6ACD25275B598BE_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""EF2F31381FFD5D33"""
+"""D3C7741E8FA6FA78_9797602764BE164D_6004_UN""","""CNCC1=CC(=C[N]1C)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""EF2F31381FFD5D33"""
+"""0AD8ACDB16126E99_255C8C52A6F71F0F_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""EF2F31381FFD5D33"""
+"""538935D8CD0645F2_50921EDA9C5B8F3D_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""EF2F31381FFD5D33"""
+"""96555C358CDC9EA4_036E4683A2292E2C_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(C=CC=C2)CN3CCCC3""",21,"""EF2F31381FFD5D33"""
+"""9308C9583A68BCD1_9BBA16021E9BCD96_6004_UN""","""CNCC1=CC(=C[N]1C)C2=CC(=N[N]2C3CCCCO3)C""",21,"""EF2F31381FFD5D33"""
+"""7BFC990993226BEC_91BD3C0147E6296B_6004_UN""","""CNCC1=CC(=C[N]1C)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""EF2F31381FFD5D33"""
+"""913BBD5703947FD4_11A910A33BCB41F3_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](CCN)(=O)=O)C2CC2""",21,"""EF616E4CE5302CEB"""
+"""70ED1237E973554A_8AD0C02996684E5D_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C(C)C)[S](=O)(=O)CCN""",21,"""EF616E4CE5302CEB"""
+"""447D5C278960E6EB_DD5F2C9C78286D01_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](C)(=O)=O)CCN=C=S""",21,"""EF616E4CE5302CEB"""
+"""47FF608919142DB8_C0492D24368014C9_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](CC)(=O)=O)CCCN""",21,"""EF616E4CE5302CEB"""
+"""C6D0BDB7D3907F5E_4A9688C9C05421E8_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2CC(C2)N""",21,"""EF616E4CE5302CEB"""
+"""456BDB4EF9BA8CD7_0C4C80CEF061A369_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(CCCN)[S](=O)(=O)CCl""",21,"""EF616E4CE5302CEB"""
+"""CE53E9A5ED8752D1_F9AD0C8822F33628_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2CNCC2""",21,"""EF616E4CE5302CEB"""
+"""7CE66B67009FF280_47F5079F9D1C93EC_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](CC)(=O)=O)CCCBr""",21,"""EF616E4CE5302CEB"""
+"""7CD0F266ABC7B42A_F32F869F38121062_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(CCCNC)[S](=O)(=O)C""",21,"""EF616E4CE5302CEB"""
+"""A8452756D2054FE1_16428EF9B1DB0A3A_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""EF616E4CE5302CEB"""
+"""712E749FCF5390C8_4409E4E2EDE4D9F2_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](=O)(=O)CC#N)C2CC2""",21,"""EF616E4CE5302CEB"""
+"""BA25C2EAE64DE28B_C7DD8F9405429BE5_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C(=O)CCN""",21,"""EF616E4CE5302CEB"""
+"""999A55BB99A28E89_01DBD864E11C2F16_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""EF616E4CE5302CEB"""
+"""6138A0D486EBA3EF_A37D85FDF1533D57_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""EF616E4CE5302CEB"""
+"""C78E2A36F61C43E7_6E1ADEB42E1D1D08_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""EF616E4CE5302CEB"""
+"""321A589C52223654_9A677103E11D4DA1_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""EF616E4CE5302CEB"""
+"""D2A68CEFEE886FD8_909396037D6675A7_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(CC(CC)N)[S](=O)(=O)C""",21,"""EF616E4CE5302CEB"""
+"""CAA52C4E75F9BAF1_92BDC3227F6DC58C_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""EF616E4CE5302CEB"""
+"""EE18C7FE8D67CC62_017FDC6EA5951E68_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](C)(=O)=O)CCN=[N]#N""",21,"""EF616E4CE5302CEB"""
+"""84DB1C56AB05249C_D1CEEBC8A3E81A4C_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""EF616E4CE5302CEB"""
+"""9F8CB4516FBB0597_9BC18C7934269DC1_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""EF616E4CE5302CEB"""
+"""D841B20DFF6CB7FC_77FC121B3E0C39CE_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""EF616E4CE5302CEB"""
+"""D39FCEF9D5F12A0F_7E11A67F95591474_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](=O)(=O)C2CC2)CC#C""",21,"""EF616E4CE5302CEB"""
+"""5D6186E63029982A_2A11BCF47257D1B2_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""EF616E4CE5302CEB"""
+"""B7D30B5A43F3640F_027AF30957539D5A_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N2CCCC(C)(C)[S]2(=O)=O""",21,"""EF616E4CE5302CEB"""
+"""3B83EE531A7910C0_C953085DDE955649_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N2CCCC(CC)[S]2(=O)=O""",21,"""EF616E4CE5302CEB"""
+"""6B55C859603CE5EB_F83A7887BB2CE0E6_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""EF616E4CE5302CEB"""
+"""FCC70167E18DA923_27241F29C124D9C8_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""EF616E4CE5302CEB"""
+"""8D0D55F9E883BDFD_8C1CD1B015B444E4_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""EF616E4CE5302CEB"""
+"""A2B81020439A0D80_CC7061E0108E9D5A_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""EF616E4CE5302CEB"""
+"""00E7AFDF531717F9_643FFB34EB938232_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N2[S](CCN(C)CC2)(=O)=O""",21,"""EF616E4CE5302CEB"""
+"""A8A342707D0E9613_E8A8DDB9833A69D1_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N2CC(=O)NCC[S]2(=O)=O""",21,"""EF616E4CE5302CEB"""
+"""B819440473D02768_BD53C0B02E9FAE45_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N2[S](CCCCC2C)(=O)=O""",21,"""EF616E4CE5302CEB"""
+"""14971F8119C4C32B_C7FB857C807F41BB_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(CCN)[S](=O)(=O)C2CC2""",21,"""EF616E4CE5302CEB"""
+"""2411F6DE5F322E0E_A101A3BD2453D34C_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(CCN)[S](=O)(=O)C(F)F""",21,"""EF616E4CE5302CEB"""
+"""962AFD61FC66EEBE_01043FD81A582DAE_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N([S](CC)(=O)=O)C2CNC2""",21,"""EF616E4CE5302CEB"""
+"""45C320A08150D617_339DEBE48DB179D3_6036_DP""","""C(CCOC1=CC(=CC=C1)Br)N3CC2(CNC2)C[S]3(=O)=O""",21,"""EF616E4CE5302CEB"""
+"""E49C6DAFDE17B3EF_89E8927654723DB9_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""EF616E4CE5302CEB"""
+"""B42BB30CA44DE0DE_75030A265D102D09_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""EF616E4CE5302CEB"""
+"""43E2C9CDB01CA0F8_4B626D91902EE592_6036_UN""","""C(CCOC1=CC(=CC=C1)Br)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""EF616E4CE5302CEB"""
+"""21737E8D2E3C7E63_EE99E2FE53F7A084_6004_UN""","""COC1=C(C=C(C=N1)N)C2=CC(=CC=C2)OC3CCCC3""",21,"""EF69B3AAA26C5958"""
+"""F47747212EADC7A3_41EE1AD2A8E70C78_6004_UN""","""COC1=C(C=C(C=N1)N)C2=CC(=C(OCC)C=C2)OCC""",21,"""EF69B3AAA26C5958"""
+"""0646780E2F545D14_BDEE6D15370CFB52_6004_UN""","""COC1=C(C=C(C=N1)N)C2=CC=CC(=C2)OCCC(C)C""",21,"""EF69B3AAA26C5958"""
+"""937C30400FB6F8DF_E1D49543A420CD56_6004_UN""","""COC1=C(C=C(C=N1)N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""EF69B3AAA26C5958"""
+"""52CCBEDEC3CD085C_D2FCFA82234E3BFE_6004_UN""","""COC1=C(C=C(C=N1)N)C2=CC=C(C=C2)OC3CCOC3""",21,"""EF69B3AAA26C5958"""
+"""C5501A7E3C9185AD_191D1EF6FB39CF0D_6004_UN""","""COC1=C(C=C(C=N1)N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""EF69B3AAA26C5958"""
+"""FC712EF385106A57_C1723AFAAFFDDE85_6004_UN""","""COC1=C(C=C(C=N1)N)C2=CC=CC(=C2)COCCOC""",21,"""EF69B3AAA26C5958"""
+"""48E2CFA0D5AB0713_481FB7FBA141D5E9_6004_UN""","""COC1=C(C=C(C=N1)N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""EF69B3AAA26C5958"""
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+"""FC27214BEDC95E25_F3FE451F2F847C22_6036_UN""","""C(CNC1(CCCCC1)C#N)N(CCCNC)[S](=O)(=O)C""",21,"""EFB0ADCCF2A640AB"""
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+"""56E4DAE2E475FA56_44D82762FA72B5B2_6036_UN""","""C(CNC1(CCCCC1)C#N)N([S](=O)(=O)CC#N)C2CC2""",21,"""EFB0ADCCF2A640AB"""
+"""B9D823C87FEDFD24_C70C4C1412D4F7A5_6036_UN""","""C(CNC1(CCCCC1)C#N)N([S](C)(=O)=O)C(=O)CCN""",21,"""EFB0ADCCF2A640AB"""
+"""93586C0B005CD539_010A1BE4F68A4356_6036_UN""","""C(CNC1(CCCCC1)C#N)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""EFB0ADCCF2A640AB"""
+"""51BDCE4539CE7475_A3AC467DE6C55117_6036_UN""","""C(CNC1(CCCCC1)C#N)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""EFB0ADCCF2A640AB"""
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+"""605C94FE52CDBD05_904255836AF019E7_6036_UN""","""C(CNC1(CCCCC1)C#N)N(CC(CC)N)[S](=O)(=O)C""",21,"""EFB0ADCCF2A640AB"""
+"""0BC55BF8E106FE8E_926C00A268FBA9CC_6036_UN""","""C(CNC1(CCCCC1)C#N)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""EFB0ADCCF2A640AB"""
+"""A2043CB93AD29F10_01AE1FEEB2037228_6036_UN""","""C(CNC1(CCCCC1)C#N)N([S](C)(=O)=O)CCN=[N]#N""",21,"""EFB0ADCCF2A640AB"""
+"""A631DBC63E8A87CD_D11F2848B47E760C_6036_UN""","""C(CNC1(CCCCC1)C#N)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""EFB0ADCCF2A640AB"""
+"""BE21C9A72BC344BE_9B104FF923B0F181_6036_UN""","""C(CNC1(CCCCC1)C#N)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""EFB0ADCCF2A640AB"""
+"""C2DBF3C0C84D707D_772DD19B299A558E_6036_UN""","""C(CNC1(CCCCC1)C#N)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""EFB0ADCCF2A640AB"""
+"""EC95B817294B4547_7EC065FF82CF7834_6036_UN""","""C(CNC1(CCCCC1)C#N)N([S](=O)(=O)C2CC2)CC#C""",21,"""EFB0ADCCF2A640AB"""
+"""D53BB0C8ABFD99E1_2AC07F7465C1BDF2_6036_UN""","""C(CNC1(CCCCC1)C#N)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""EFB0ADCCF2A640AB"""
+"""3DC2C34B42C57F7D_02AB308940C5F11A_6036_UN""","""C(CNC1(CCCCC1)C#N)N2CCCC(C)(C)[S]2(=O)=O""",21,"""EFB0ADCCF2A640AB"""
+"""C0562C8156D00124_C982CBDDC9033A09_6036_UN""","""C(CNC1(CCCCC1)C#N)N2CCCC(CC)[S]2(=O)=O""",21,"""EFB0ADCCF2A640AB"""
+"""EF1693A9F13606C2_F8EBBB07ACBA8CA6_6036_UN""","""C(CNC1(CCCCC1)C#N)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""EFB0ADCCF2A640AB"""
+"""CB8289AD907056AC_27F5DCA9D6B2B588_6036_UN""","""C(CNC1(CCCCC1)C#N)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""EFB0ADCCF2A640AB"""
+"""3023A32A70FFB971_8CCD1230022228A4_6036_UN""","""C(CNC1(CCCCC1)C#N)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""EFB0ADCCF2A640AB"""
+"""2991DF37462E3594_CCA1A2600718F11A_6036_UN""","""C(CNC1(CCCCC1)C#N)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""EFB0ADCCF2A640AB"""
+"""EAE54AC854F770A6_64EE38B4FC05EE72_6036_UN""","""C(CNC1(CCCCC1)C#N)N2[S](CCN(C)CC2)(=O)=O""",21,"""EFB0ADCCF2A640AB"""
+"""1C86AB25A46C4387_E8791E3994AC0591_6036_UN""","""C(CNC1(CCCCC1)C#N)N2CC(=O)NCC[S]2(=O)=O""",21,"""EFB0ADCCF2A640AB"""
+"""BF0B76B7FD494519_BD8203303909C205_6036_UN""","""C(CNC1(CCCCC1)C#N)N2[S](CCCCC2C)(=O)=O""",21,"""EFB0ADCCF2A640AB"""
+"""1C41B745FFD29997_C72A46FC97E92DFB_6036_UN""","""C(CNC1(CCCCC1)C#N)N(CCN)[S](=O)(=O)C2CC2""",21,"""EFB0ADCCF2A640AB"""
+"""3E44F97B2CC1F791_A1D0603D33C5BF0C_6036_UN""","""C(CNC1(CCCCC1)C#N)N(CCN)[S](=O)(=O)C(F)F""",21,"""EFB0ADCCF2A640AB"""
+"""C2EB4197AAEF4A0A_01D5FC580DCE41EE_6036_UN""","""C(CNC1(CCCCC1)C#N)N([S](CC)(=O)=O)C2CNC2""",21,"""EFB0ADCCF2A640AB"""
+"""EA64FAB13608493F_334C28649A271593_6036_DP""","""C(CNC1(CCCCC1)C#N)N3CC2(CNC2)C[S]3(=O)=O""",21,"""EFB0ADCCF2A640AB"""
+"""C1EC653E406BC4CB_893951F643E451F9_6036_UN""","""C(CNC1(CCCCC1)C#N)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""EFB0ADCCF2A640AB"""
+"""1CE5026168E5F3E4_75D2C9A64A864149_6036_UN""","""C(CNC1(CCCCC1)C#N)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""EFB0ADCCF2A640AB"""
+"""B05731DC6CF7A8B0_4BB3AE1187B889D2_6036_UN""","""C(CNC1(CCCCC1)C#N)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""EFB0ADCCF2A640AB"""
+"""5D216843B2A851C5_F1D2CA3AFE4BAD62_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=CC=C2)OC3CCCC3)C""",21,"""F0229B6E0FD054BE"""
+"""178ADF2E431F6BAD_5EA53216055B019E_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(OCC)C=C2)OCC)C""",21,"""F0229B6E0FD054BE"""
+"""699967B4B2BCE739_A2A545D19AB0F6B4_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)OCCC(C)C)C""",21,"""F0229B6E0FD054BE"""
+"""C25AFABBEA16916E_FE9FBD87099CC0B0_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)C[N]3C=CN=C3)C""",21,"""F0229B6E0FD054BE"""
+"""41FD205A72616C11_CDB7D2468EF23618_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)OC3CCOC3)C""",21,"""F0229B6E0FD054BE"""
+"""4C4CFCBB57642C85_065636325685C2EB_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)CN(C)C)C""",21,"""F0229B6E0FD054BE"""
+"""B9D01A3C7312BB9C_DE39123E0241D363_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)COCCOC)C""",21,"""F0229B6E0FD054BE"""
+"""A85058E764C3223B_57549F3F0CFDD80F_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)CN(C)C3CC3)C""",21,"""F0229B6E0FD054BE"""
+"""CCC2ABD5A68A217A_484F8BDC3BB73F6A_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)OC(COC)C)C""",21,"""F0229B6E0FD054BE"""
+"""5026997D35388291_1A0E73E8B0029F46_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(C(NOC)=O)C=C2)F)C""",21,"""F0229B6E0FD054BE"""
+"""0C09DF799A17C0E3_0FF795DC2B7F3E04_6005_UN""","""COC1=CC(=C(C=C1)C2=C(OC)N=C(C=C2)C(F)(F)F)C""",21,"""F0229B6E0FD054BE"""
+"""FC7D6FFF754DF6B3_764CFAF0DC450279_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=CC=C2)CN3CCCC3)C""",21,"""F0229B6E0FD054BE"""
+"""131C23741BCAAB1A_6F68DEF2B429EDF9_6005_UN""","""COC1=CC(=C(C=C1)C3=CC=C([N]2C=C(C)C=N2)C=C3)C""",21,"""F0229B6E0FD054BE"""
+"""167AAE9B2703BAED_129C8110333F5C90_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2)OCCN(C)C)C""",21,"""F0229B6E0FD054BE"""
+"""8142D74901F0EDA0_E5414DD2A25DFFAB_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=C(C(C)C)C=C2)C(C)C)C""",21,"""F0229B6E0FD054BE"""
+"""04D3E102225704C0_D26675565537FC1F_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)C""",21,"""F0229B6E0FD054BE"""
+"""E6839520036B975F_00AA8BD27F38D6AC_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=CC=C2F)OC(F)(F)F)C""",21,"""F0229B6E0FD054BE"""
+"""F132091B624085A9_D07F455A8A62E2BF_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(C=C2)Cl)OC(F)(F)F)C""",21,"""F0229B6E0FD054BE"""
+"""FC23A03B7FF34C09_FFEA71159945807A_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=C(OC)C=C2)C(F)(F)F)C""",21,"""F0229B6E0FD054BE"""
+"""CED7D633E7FFC718_FAD18FB045755253_6005_UN""","""COC1=CC(=C(C=C1)C2=CC=CC(=C2F)C(N(C)C)=O)C""",21,"""F0229B6E0FD054BE"""
+"""EAFC9C4B2D0EB881_3F2A294725F5CE67_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=C(OC)C=C2)C(F)(F)F)C""",21,"""F0229B6E0FD054BE"""
+"""3C421CA959A58D84_2F06B916FA1B7A93_6005_UN""","""COC1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)C""",21,"""F0229B6E0FD054BE"""
+"""7BE05360C6F64CB7_F215E02F54B88EE9_6005_UN""","""COC1=CC(=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3)C""",21,"""F0229B6E0FD054BE"""
+"""B6F44C73CFEA6917_62660455CD45043C_6005_UN""","""COC1=CC(=C(C=C1)C2=C(OC)C=C(C=C2)C(F)(F)F)C""",21,"""F0229B6E0FD054BE"""
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+"""6A57AC24EA5F237A_D86E197121585F4E_6036_UN""","""CC(CN)(CN(CCN)[S](=O)(=O)C1CC1)C2=CC=CC=C2""",21,"""F0F4F2414417321E"""
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+"""10B115BFB3E16675_2C0877E92C966726_6036_DP""","""CC(CN)(CN2CC1(CNC1)C[S]2(=O)=O)C3=CC=CC=C3""",21,"""F0F4F2414417321E"""
+"""1B61C2B97E661767_967D0E7BF555234C_6036_UN""","""CC(CN)(CN(C)[S](=O)(=O)C1=N[NH]C=N1)C2=CC=CC=C2""",21,"""F0F4F2414417321E"""
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+"""B7C126E35497252E_54F7F19C3109FB67_6036_UN""","""CC(CN)(CN(C(C)(C)CN)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""F0F4F2414417321E"""
+"""284F96ED63F3F5F8_F0A658DB1EA6DABE_6004_UN""","""CC1=C(C=NC=C1C2=CC(=CC=C2)OC3CCCC3)CN""",21,"""F156098FEF3D2362"""
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+"""DEFBA687B9F82A8D_A3D1D7307A5D8168_6004_UN""","""CC1=C(C=NC=C1C2=CC=CC(=C2)OCCC(C)C)CN""",21,"""F156098FEF3D2362"""
+"""F935911358400F82_FFEB2F66E971B76C_6004_UN""","""CC1=C(C=NC=C1C2=CC=C(C=C2)C[N]3C=CN=C3)CN""",21,"""F156098FEF3D2362"""
+"""8B26842285A54380_CCC340A76E1F41C4_6004_UN""","""CC1=C(C=NC=C1C2=CC=C(C=C2)OC3CCOC3)CN""",21,"""F156098FEF3D2362"""
+"""CE77FD61B802BC79_0722A4D3B668B537_6004_UN""","""CC1=C(C=NC=C1C2=CC(=C(OC)C=C2)CN(C)C)CN""",21,"""F156098FEF3D2362"""
+"""2852538900F828D8_DF4D80DFE2ACA4BF_6004_UN""","""CC1=C(C=NC=C1C2=CC=CC(=C2)COCCOC)CN""",21,"""F156098FEF3D2362"""
+"""88B0DFD32CD12417_56200DDEEC10AFD3_6004_UN""","""CC1=C(C=NC=C1C2=CC=CC(=C2)CN(C)C3CC3)CN""",21,"""F156098FEF3D2362"""
+"""04A6B287A1937910_493B193DDB5A48B6_6004_UN""","""CC1=C(C=NC=C1C2=CC=CC(=C2)OC(COC)C)CN""",21,"""F156098FEF3D2362"""
+"""14B9B51D852FA8AB_1B7AE10950EFE89A_6004_UN""","""CC1=C(C=NC=C1C2=CC(=C(C(NOC)=O)C=C2)F)CN""",21,"""F156098FEF3D2362"""
+"""950F1E88F4A78209_0E83073DCB9249D8_6004_UN""","""CC1=C(C=NC=C1C2=C(OC)N=C(C=C2)C(F)(F)F)CN""",21,"""F156098FEF3D2362"""
+"""C222C162C375D2F8_773868113CA875A5_6004_UN""","""CC1=C(C=NC=C1C2=CC(=CC=C2)CN3CCCC3)CN""",21,"""F156098FEF3D2362"""
+"""974063A575C24409_6E1C4C1354C49A25_6004_UN""","""CC1=C(C=NC=C1C3=CC=C([N]2C=C(C)C=N2)C=C3)CN""",21,"""F156098FEF3D2362"""
+"""489B122C3F9C6FA3_13E813F1D3D22B4C_6004_UN""","""CC1=C(C=NC=C1C2=CC=CC(=C2)OCCN(C)C)CN""",21,"""F156098FEF3D2362"""
+"""514E9B877566C338_E435DF3342B08877_6004_UN""","""CC1=C(C=NC=C1C2=C(C=C(C(C)C)C=C2)C(C)C)CN""",21,"""F156098FEF3D2362"""
+"""91CCB333AFA0091E_D312E7B7B5DA8BC3_6004_UN""","""CC1=C(C=NC=C1C2=CC=C(C=C2)C3=CC=CC=C3)CN""",21,"""F156098FEF3D2362"""
+"""BD14D55585EBF68F_01DE19339FD5A170_6004_UN""","""CC1=C(C=NC=C1C2=C(C=CC=C2F)OC(F)(F)F)CN""",21,"""F156098FEF3D2362"""
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+"""27C8B115689E95AF_FE9EE3F479A8F7A6_6004_UN""","""CC1=C(C=NC=C1C2=C(C=C(OC)C=C2)C(F)(F)F)CN""",21,"""F156098FEF3D2362"""
+"""E49C8A3C9DCD23AD_FBA51D51A598258F_6004_UN""","""CC1=C(C=NC=C1C2=CC=CC(=C2F)C(N(C)C)=O)CN""",21,"""F156098FEF3D2362"""
+"""E1F241A233887035_3E5EBBA6C518B9BB_6004_UN""","""CC1=C(C=NC=C1C2=CC(=C(OC)C=C2)C(F)(F)F)CN""",21,"""F156098FEF3D2362"""
+"""4204A4EF2DDAB95F_2E722BF71AF60D4F_6004_UN""","""CC1=C(C=NC=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)CN""",21,"""F156098FEF3D2362"""
+"""0E0FBCF6B26EC2D4_F36172CEB455F935_6004_UN""","""CC1=C(C=NC=C1C2=CC(=CC=C2)C3=CC=CC=C3)CN""",21,"""F156098FEF3D2362"""
+"""19790F4CED03C900_631296B42DA873E0_6004_UN""","""CC1=C(C=NC=C1C2=C(OC)C=C(C=C2)C(F)(F)F)CN""",21,"""F156098FEF3D2362"""
+"""D25C980BEA0F2F9F_46332607CDA7BD3B_6004_UN""","""CC1=C(C=NC=C1C2=C(C)C=C(C=C2)OC(F)(F)F)CN""",21,"""F156098FEF3D2362"""
+"""15EFCFE487283448_20CE9646E42E0C5B_6004_UN""","""CC1=C(C=NC=C1C2=CC=C(OCCC(C)C)C=C2)CN""",21,"""F156098FEF3D2362"""
+"""790C911CF0A738A1_DDA3F5501A649C0B_6004_UN""","""CC1=C(C=NC=C1C2=CC=C(C=C2)OC3CCCC3)CN""",21,"""F156098FEF3D2362"""
+"""B28E2F293C8C4AA9_5C952CAEAD9FF4DF_6004_UN""","""CC1=C(C=NC=C1C2=C(C=C(OC)C=C2)CN(C)C)CN""",21,"""F156098FEF3D2362"""
+"""6B909CA15A082394_29EA4E9CD7B35068_6004_UN""","""CC1=C(C=NC=C1C2=CC(=C(N=C2)C(F)(F)F)OC)CN""",21,"""F156098FEF3D2362"""
+"""12980BEF70C3F088_D60D891000B2AE85_6004_UN""","""CC1=C(C=NC=C1C2=C(C)C=C(C=C2)OCC3CC3)CN""",21,"""F156098FEF3D2362"""
+"""EE99A336561F896B_218A60E52BCB839B_6004_UN""","""CC1=C(C=NC=C1C2=C(C=CC(=C2)C3(CC3)C#N)F)CN""",21,"""F156098FEF3D2362"""
+"""A59284E6E49E8142_57814EF9E3A784F0_6004_UN""","""CC1=C(C=NC=C1C2=C(OCC(C)(C)C)N=CC=C2)CN""",21,"""F156098FEF3D2362"""
+"""B5E0BAB0757E6EF3_92B1DFC37A43ED8F_6004_UN""","""CC1=C(C=NC=C1C2=CC=C(C=C2)C[N]3C=NC=N3)CN""",21,"""F156098FEF3D2362"""
+"""CFF183A2C01689C2_F8D5EAE58575E6EF_6004_UN""","""CC1=C(C=NC=C1C2=C(OCC)C=CC(=C2)[N](=O)=O)CN""",21,"""F156098FEF3D2362"""
+"""23E51A796F4777AE_89EE5890947E681C_6004_UN""","""CC1=C(C=NC=C1C3=CC2=C(C=C(OC)C=C2)C=C3)CN""",21,"""F156098FEF3D2362"""
+"""C07C80ED6CD76B64_3B25B4E55637615E_6004_UN""","""CC1=C(C=NC=C1C2=CC(=C(C=C2C3CC3)Cl)OC)CN""",21,"""F156098FEF3D2362"""
+"""6A72FD877E243B62_4EEB266D6C9BF16C_6004_UN""","""CC1=C(C=NC=C1C2=CC(=CC=C2)C3=CC=NC=C3)CN""",21,"""F156098FEF3D2362"""
+"""5AD7CDEC4FF97502_1D177E3452E9507D_6004_UN""","""CC1=C(C=NC=C1C2=C(C=CC=C2)CN3CCCC3)CN""",21,"""F156098FEF3D2362"""
+"""6811DEA9336E295E_85C32EB5EE5BB3C7_6004_UN""","""CC1=C(C=NC=C1C2=CC(=N[N]2C3CCCCO3)C)CN""",21,"""F156098FEF3D2362"""
+"""BD0C308205787222_8FC404B6B726573A_6004_UN""","""CC1=C(C=NC=C1C2=C(C=C(C=C2)OC(F)(F)F)F)CN""",21,"""F156098FEF3D2362"""
+"""982E8EE51F722C3D_F0385F553DA149D4_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""F1C80E01CC3AB008"""
+"""21D4001008D6C190_5F4FA779C6B1E528_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""F1C80E01CC3AB008"""
+"""FD045B143444209A_A34FD0BE595A1202_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""F1C80E01CC3AB008"""
+"""5592D22A835553B4_FF7528E8CA762406_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""F1C80E01CC3AB008"""
+"""FD35F2A84370D7A6_CC5D47294D18D2AE_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""F1C80E01CC3AB008"""
+"""83CFD12297F84FCE_07BCA35D956F265D_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""F1C80E01CC3AB008"""
+"""73906A715473811D_DFD38751C1AB37D5_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=CC(=C2)COCCOC""",21,"""F1C80E01CC3AB008"""
+"""E76E7005F6F958C8_56BE0A50CF173CB9_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""F1C80E01CC3AB008"""
+"""854166FA914158C5_49A51EB3F85DDBDC_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""F1C80E01CC3AB008"""
+"""8FEA3A623EE64F0E_1BE4E68773E87BF0_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""F1C80E01CC3AB008"""
+"""A9FFA5D8102EE129_0E1D00B3E895DAB2_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""F1C80E01CC3AB008"""
+"""2FDAF20CF5EE5A6E_77A66F9F1FAFE6CF_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""F1C80E01CC3AB008"""
+"""87761E4A522214D4_6E824B9D77C3094F_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""F1C80E01CC3AB008"""
+"""2B08E3D29AEBDC8C_1376147FF0D5B826_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""F1C80E01CC3AB008"""
+"""136AECDE9D32C6C8_E4ABD8BD61B71B1D_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""F1C80E01CC3AB008"""
+"""6367929AA313C0D0_D38CE03996DD18A9_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""F1C80E01CC3AB008"""
+"""EE0DE859215D8437_01401EBDBCD2321A_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""F1C80E01CC3AB008"""
+"""7093F9D2A24FEEAC_D195D03549880609_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""F1C80E01CC3AB008"""
+"""298CE98206A7692D_6A1A60259307EEA7_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""F1C80E01CC3AB008"""
+"""3BA9AD929667338A_FE00E47A5AAF64CC_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""F1C80E01CC3AB008"""
+"""C03567361CD4E9EC_FB3B1ADF869FB6E5_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""F1C80E01CC3AB008"""
+"""00D0BAE53AD3A9A3_3EC0BC28E61F2AD1_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""F1C80E01CC3AB008"""
+"""1537B252EA959E0D_2EEC2C7939F19E25_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""F1C80E01CC3AB008"""
+"""901DD6290AD1F043_F3FF754097526A5F_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""F1C80E01CC3AB008"""
+"""F7D16D708B9B93C9_638C913A0EAFE08A_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""F1C80E01CC3AB008"""
+"""6323BADF1057D579_46AD2189EEA02E51_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""F1C80E01CC3AB008"""
+"""CBEFCA73ABDB0008_205091C8C7299F31_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""F1C80E01CC3AB008"""
+"""9C1C0F3173B764A8_DD3DF2DE39630F61_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""F1C80E01CC3AB008"""
+"""31907E2C77609995_5C0B2B208E9867B5_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""F1C80E01CC3AB008"""
+"""7EE7C0263D815AE0_29744912F4B4C302_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""F1C80E01CC3AB008"""
+"""48FF63DDC7C9A227_D6938E9E23B53DEF_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""F1C80E01CC3AB008"""
+"""FC10B05A3414835D_2114676B08CC10F1_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""F1C80E01CC3AB008"""
+"""FCD0CAE9F55274BE_571F4977C0A0179A_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""F1C80E01CC3AB008"""
+"""581840236DCA11C9_922FD84D59447EE5_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""F1C80E01CC3AB008"""
+"""51A146A26D17874E_F84BED6BA6727585_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""F1C80E01CC3AB008"""
+"""03322778507F2147_89705F1EB779FB76_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""F1C80E01CC3AB008"""
+"""B6B5C373B1ED269E_3BBBB36B7530F234_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""F1C80E01CC3AB008"""
+"""45222A5747BEAB81_4E7521E34F9C6206_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""F1C80E01CC3AB008"""
+"""ED0CA4C2540BB559_1D8979BA71EEC317_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(C=CC=C2)CN3CCCC3""",21,"""F1C80E01CC3AB008"""
+"""A60F92DF7B2ADFEF_8F5A03389421C450_6025_UN""","""C1(=NC(=C(C(=N1)Cl)F)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""F1C80E01CC3AB008"""
+"""EF95C8ADBF9D7767_F3817A93DBDBC9F5_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""F2712BC72A403029"""
+"""479B0FD2285E5456_5CF682BF20CB6509_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""F2712BC72A403029"""
+"""ADE10CAA91D1BB21_A0F6F578BF209223_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""F2712BC72A403029"""
+"""B9699D21022245A2_FCCC0D2E2C0CA427_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""F2712BC72A403029"""
+"""BC76250AD142BBE0_CFE462EFAB62528F_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""F2712BC72A403029"""
+"""732EF52BC09A45A9_0405869B7315A67C_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""F2712BC72A403029"""
+"""544C2ED1EE7C09FE_DC6AA29727D1B7F4_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2)COCCOC""",21,"""F2712BC72A403029"""
+"""C71FB994A8F39F80_55072F96296DBC98_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""F2712BC72A403029"""
+"""74BD94776BD0AEB0_4A1C3B751E275BFD_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""F2712BC72A403029"""
+"""001D6139D7FA3094_185DC3419592FBD1_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""F2712BC72A403029"""
+"""56B120FFF221AAFF_0DA425750EEF5A93_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""F2712BC72A403029"""
+"""1F0A9B2A9577D49A_741F4A59F9D566EE_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""F2712BC72A403029"""
+"""17E1987E039812E4_6D3B6E5B91B9896E_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""F2712BC72A403029"""
+"""80F71E0B873C8004_10CF31B916AF3807_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""F2712BC72A403029"""
+"""4FE20D9054919F8C_E712FD7B87CD9B3C_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""F2712BC72A403029"""
+"""B2021049EBC96427_D035C5FF70A79888_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""F2712BC72A403029"""
+"""CC77BA7753580430_02F93B7B5AA8B23B_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""F2712BC72A403029"""
+"""2E985DBD68C95AEB_D22CF5F3AFF28628_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""F2712BC72A403029"""
+"""A3E37F61F91A0307_FDB9C1BCBCD5E4ED_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""F2712BC72A403029"""
+"""1AD304765CB3B302_F8823F1960E536C4_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""F2712BC72A403029"""
+"""BBC84E2ECA41570E_3D7999EE0065AAF0_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""F2712BC72A403029"""
+"""C68FF574E6416A4C_2D5509BFDF8B1E04_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""F2712BC72A403029"""
+"""577A090405155707_F04650867128EA7E_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""F2712BC72A403029"""
+"""B6E02E5A03B76268_6035B4FCE8D560AB_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""F2712BC72A403029"""
+"""9F3C036D81EADEDC_4514044F08DAAE70_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""F2712BC72A403029"""
+"""9C30C2A5D52DDB56_23E9B40E21531F10_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""F2712BC72A403029"""
+"""0938CE26B9ADA82E_DE84D718DF198F40_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""F2712BC72A403029"""
+"""482B71292B6688D5_5FB20EE668E2E794_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""F2712BC72A403029"""
+"""A2C3A0EFF518388E_2ACD6CD412CE4323_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""F2712BC72A403029"""
+"""23389D1CA28CEE4C_D52AAB58C5CFBDCE_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""F2712BC72A403029"""
+"""5D23CAC390323F06_22AD42ADEEB690D0_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""F2712BC72A403029"""
+"""1E8CA326514E0E14_54A66CB126DA97BB_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""F2712BC72A403029"""
+"""BC849A9A63004B8D_9196FD8BBF3EFEC4_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""F2712BC72A403029"""
+"""02D7D8825098C1A0_FBF2C8AD4008F5A4_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""F2712BC72A403029"""
+"""F9328228400A6B9F_8AC97AD851037B57_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""F2712BC72A403029"""
+"""6C4CCFD1B1A2E48A_380296AD934A7215_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""F2712BC72A403029"""
+"""C20E94DAF01BAD06_4DCC0425A9E6E227_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""F2712BC72A403029"""
+"""91A96BA445146394_1E305C7C97944336_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(C=CC=C2)CN3CCCC3""",21,"""F2712BC72A403029"""
+"""3BC80D138E525E33_86E40CFD2B26A08C_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=CC(=N[N]2C3CCCCO3)C""",21,"""F2712BC72A403029"""
+"""2C76AD91612F9DF5_8CE326FE725B4471_6005_UN""","""NCC1=C(C=CC(=C1)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""F2712BC72A403029"""
+"""E06CF15ADB88E790_F2BD4120BA897BA9_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=CC=C2)OC3CCCC3)N""",21,"""F34D10744B128275"""
+"""4AB6192547BF8FBF_5DCAB90C4199D755_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=C(OCC)C=C2)OCC)N""",21,"""F34D10744B128275"""
+"""2CAF2AD9997DC21A_A1CACECBDE72207F_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=CC(=C2)OCCC(C)C)N""",21,"""F34D10744B128275"""
+"""880E8E364A792058_FDF0369D4D5E167B_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=C(C=C2)C[N]3C=CN=C3)N""",21,"""F34D10744B128275"""
+"""DCDC0DC28E6C1D4F_CED8595CCA30E0D3_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=C(C=C2)OC3CCOC3)N""",21,"""F34D10744B128275"""
+"""04E80041929E1835_0539BD2812471420_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=C(OC)C=C2)CN(C)C)N""",21,"""F34D10744B128275"""
+"""022A28E00B391C3D_DD569924468305A8_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=CC(=C2)COCCOC)N""",21,"""F34D10744B128275"""
+"""184CE52982AC80B4_543B1425483F0EC4_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=CC(=C2)CN(C)C3CC3)N""",21,"""F34D10744B128275"""
+"""C0A18F294DE56E63_4B2000C67F75E9A1_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=CC(=C2)OC(COC)C)N""",21,"""F34D10744B128275"""
+"""74ACBC8ADBD6588C_1961F8F2F4C0498D_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=C(C(NOC)=O)C=C2)F)N""",21,"""F34D10744B128275"""
+"""4ACCE53ADA081AEA_0C981EC66FBDE8CF_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(OC)N=C(C=C2)C(F)(F)F)N""",21,"""F34D10744B128275"""
+"""4DA0C2996BF41B53_752371EA9887D4B2_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=CC=C2)CN3CCCC3)N""",21,"""F34D10744B128275"""
+"""1EAC325520D00EC7_6C0755E8F0EB3B32_6005_UN""","""CC(C)C1=N[NH]C(=C1C3=CC=C([N]2C=C(C)C=N2)C=C3)N""",21,"""F34D10744B128275"""
+"""8F6907AA17710261_11F30A0A77FD8A5B_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=CC(=C2)OCCN(C)C)N""",21,"""F34D10744B128275"""
+"""E12939C267E5F8CB_E62EC6C8E69F2960_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(C=C(C(C)C)C=C2)C(C)C)N""",21,"""F34D10744B128275"""
+"""E6FD034F039DE3AA_D109FE4C11F52AD4_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=C(C=C2)C3=CC=CC=C3)N""",21,"""F34D10744B128275"""
+"""0A5C8627D78368F1_03C500C83BFA0067_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(C=CC=C2F)OC(F)(F)F)N""",21,"""F34D10744B128275"""
+"""00B15E7D43C85D51_D310CE40CEA03474_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=C(C=C2)Cl)OC(F)(F)F)N""",21,"""F34D10744B128275"""
+"""B254B721CE02442F_FC85FA0FDD8756B1_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(C=C(OC)C=C2)C(F)(F)F)N""",21,"""F34D10744B128275"""
+"""DA4C62E1E402FB5F_F9BE04AA01B78498_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=CC(=C2F)C(N(C)C)=O)N""",21,"""F34D10744B128275"""
+"""89FA6A02CFC7AF43_3C45A25D613718AC_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=C(OC)C=C2)C(F)(F)F)N""",21,"""F34D10744B128275"""
+"""AA561EB3685DE550_2C69320CBED9AC58_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)N""",21,"""F34D10744B128275"""
+"""D1069DD31695084F_F17A6B35107A5822_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=CC=C2)C3=CC=CC=C3)N""",21,"""F34D10744B128275"""
+"""57F7FD8FD6171AA7_61098F4F8987D2F7_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(OC)C=C(C=C2)C(F)(F)F)N""",21,"""F34D10744B128275"""
+"""10FB3BD054B84151_44283FFC69881C2C_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(C)C=C(C=C2)OC(F)(F)F)N""",21,"""F34D10744B128275"""
+"""F042C94E3D4E256C_22D58FBD4001AD4C_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=C(OCCC(C)C)C=C2)N""",21,"""F34D10744B128275"""
+"""4A7B1CDBD1F848D3_DFB8ECABBE4B3D1C_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=C(C=C2)OC3CCCC3)N""",21,"""F34D10744B128275"""
+"""55E2A4D46D029470_5E8E355509B055C8_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(C=C(OC)C=C2)CN(C)C)N""",21,"""F34D10744B128275"""
+"""67756BF28864A090_2BF15767739CF17F_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=C(N=C2)C(F)(F)F)OC)N""",21,"""F34D10744B128275"""
+"""B7DC51E1E2A9C908_D41690EBA49D0F92_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(C)C=C(C=C2)OCC3CC3)N""",21,"""F34D10744B128275"""
+"""E9C5211609F27C7F_2391791E8FE4228C_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(C=CC(=C2)C3(CC3)C#N)F)N""",21,"""F34D10744B128275"""
+"""295EBC90FFD04A2B_559A5702478825E7_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(OCC(C)(C)C)N=CC=C2)N""",21,"""F34D10744B128275"""
+"""DB021359F0637FC6_90AAC638DE6C4C98_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC=C(C=C2)C[N]3C=NC=N3)N""",21,"""F34D10744B128275"""
+"""43B0DE19F3393B67_FACEF31E215A47F8_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(OCC)C=CC(=C2)[N](=O)=O)N""",21,"""F34D10744B128275"""
+"""4BFC69D072E4242E_8BF5416B3051C90B_6005_UN""","""CC(C)C1=N[NH]C(=C1C3=CC2=C(C=C(OC)C=C2)C=C3)N""",21,"""F34D10744B128275"""
+"""CEB679B3B2B2982F_393EAD1EF218C049_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=C(C=C2C3CC3)Cl)OC)N""",21,"""F34D10744B128275"""
+"""CA7096DCE1594B73_4CF03F96C8B4507B_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=CC=C2)C3=CC=NC=C3)N""",21,"""F34D10744B128275"""
+"""F6A28F741EECEEE0_1F0C67CFF6C6F16A_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(C=CC=C2)CN3CCCC3)N""",21,"""F34D10744B128275"""
+"""CE010648A2FE5A8E_87D8374E4A7412D0_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=CC(=N[N]2C3CCCCO3)C)N""",21,"""F34D10744B128275"""
+"""1815B65466549497_8DDF1D4D1309F62D_6005_UN""","""CC(C)C1=N[NH]C(=C1C2=C(C=C(C=C2)OC(F)(F)F)F)N""",21,"""F34D10744B128275"""
+"""7AA97026FE90884A_F2A831395CDC728D_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=CC=C3)OC4CCCC4""",21,"""F358606DAD478B51"""
+"""69E9AC1A89B606CE_5DDFC915A7CCDE71_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=C(OCC)C=C3)OCC""",21,"""F358606DAD478B51"""
+"""D63528DD90FDA3CD_A1DFBED23827295B_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=CC(=C3)OCCC(C)C""",21,"""F358606DAD478B51"""
+"""C8EFE08DB5287A23_FDE54684AB0B1F5F_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""F358606DAD478B51"""
+"""35BB0A78B7804AD8_CECD29452C65E9F7_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=C(C=C3)OC4CCOC4""",21,"""F358606DAD478B51"""
+"""4CC4D02F58BD9286_052CCD31F4121D04_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""F358606DAD478B51"""
+"""AE5141B5C1D0B6CF_DD43E93DA0D60C8C_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=CC(=C3)COCCOC""",21,"""F358606DAD478B51"""
+"""DC1E9A63953E2DE1_542E643CAE6A07E0_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""F358606DAD478B51"""
+"""81712999898F4013_4B3570DF9920E085_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=CC(=C3)OC(COC)C""",21,"""F358606DAD478B51"""
+"""5AD351832D5A45CC_197488EB129540A9_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""F358606DAD478B51"""
+"""7E5B2D36F4A726CB_0C8D6EDF89E8E1EB_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""F358606DAD478B51"""
+"""FBF9AD046488AE88_753601F37ED2DD96_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=CC=C3)CN4CCCC4""",21,"""F358606DAD478B51"""
+"""EDD01C4058A2781E_6C1225F116BE3216_6005_UN""","""C1(=CN=C2CCCC[N]12)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""F358606DAD478B51"""
+"""8D5E237FF92536E1_11E67A1391A8837F_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=CC(=C3)OCCN(C)C""",21,"""F358606DAD478B51"""
+"""893EFAAFA5320191_E63BB6D100CA2044_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""F358606DAD478B51"""
+"""801E317B5C794F00_D11C8E55F7A023F0_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""F358606DAD478B51"""
+"""1C792DDE876DBE00_03D070D1DDAF0943_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""F358606DAD478B51"""
+"""06E0101453A1A5B2_D305BE5928F53D50_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""F358606DAD478B51"""
+"""4AEBD2689100FE14_FC908A163BD25F95_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""F358606DAD478B51"""
+"""BA3A542FE8D19999_F9AB74B3E7E28DBC_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""F358606DAD478B51"""
+"""01F81B21CC5AA0F4_3C50D24487621188_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""F358606DAD478B51"""
+"""6CFD02E2FCFC84E5_2C7C4215588CA57C_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""F358606DAD478B51"""
+"""F069AFD4FCA1981E_F16F1B2CF62F5106_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""F358606DAD478B51"""
+"""2921DD5E56005503_611CFF566FD2DBD3_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""F358606DAD478B51"""
+"""B29EA9DFB9A8EC7F_443D4FE58FDD1508_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""F358606DAD478B51"""
+"""DF02BE0B216AD5E0_22C0FFA4A654A468_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=C(OCCC(C)C)C=C3""",21,"""F358606DAD478B51"""
+"""6BD273DCCE71EFD6_DFAD9CB2581E3438_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=C(C=C3)OC4CCCC4""",21,"""F358606DAD478B51"""
+"""EAEDFC809ACEF85C_5E9B454CEFE55CEC_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""F358606DAD478B51"""
+"""A8ABD8A4B967B754_2BE4277E95C9F85B_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""F358606DAD478B51"""
+"""56D5FBA8D80C6566_D403E0F242C806B6_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(C)C=C(C=C3)OCC4CC4""",21,"""F358606DAD478B51"""
+"""B2BDCCE8095677DD_2384090769B12BA8_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(C=CC(=C3)C4(CC4)C#N)F""",21,"""F358606DAD478B51"""
+"""4D913902D16D50C4_558F271BA1DD2CC3_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(OCC(C)(C)C)N=CC=C3""",21,"""F358606DAD478B51"""
+"""A8E9CE5172FC24A4_90BFB621383945BC_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC=C(C=C3)C[N]4C=NC=N4""",21,"""F358606DAD478B51"""
+"""6FE9FB01DB12E036_FADB8307C70F4EDC_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""F358606DAD478B51"""
+"""4665F67653682368_8BE03172D604C02F_6005_UN""","""C1(=CN=C2CCCC[N]12)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""F358606DAD478B51"""
+"""DC1BEC31F48BD9EA_392BDD07144DC96D_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""F358606DAD478B51"""
+"""E665BCCDB88E5627_4CE54F8F2EE1595F_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""F358606DAD478B51"""
+"""A14235E1F16FB8FD_1F1917D61093F84E_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(C=CC=C3)CN4CCCC4""",21,"""F358606DAD478B51"""
+"""44241A844724FB52_87CD4757AC211BF4_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=CC(=N[N]3C4CCCCO4)C""",21,"""F358606DAD478B51"""
+"""033BCD48F3A03C49_8DCA6D54F55CFF09_6005_UN""","""C1(=CN=C2CCCC[N]12)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""F358606DAD478B51"""
+"""A5AE10E54F1362CC_F272E0B7255EE3A4_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC(=CC=C3)OC4CCCC4""",21,"""F382B1E3D4C51A78"""
+"""516957DCB7555554_5D05189BDE4E4F58_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC(=C(OCC)C=C3)OCC""",21,"""F382B1E3D4C51A78"""
+"""A480BD872F063F60_A1056F5C41A5B872_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=CC(=C3)OCCC(C)C""",21,"""F382B1E3D4C51A78"""
+"""71A7B9DBAAE3EEC9_FD3F970AD2898E76_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""F382B1E3D4C51A78"""
+"""4B695F14E5F9ADC1_CE17F8CB55E778DE_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=C(C=C3)OC4CCOC4""",21,"""F382B1E3D4C51A78"""
+"""91B7D73B84DB32B8_05F61CBF8D908C2D_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""F382B1E3D4C51A78"""
+"""33A81259CF6CF1D5_DD9938B3D9549DA5_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=CC(=C3)COCCOC""",21,"""F382B1E3D4C51A78"""
+"""027353B3B50ED381_54F4B5B2D7E896C9_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""F382B1E3D4C51A78"""
+"""4B6166759554E095_4BEFA151E0A271AC_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=CC(=C3)OC(COC)C""",21,"""F382B1E3D4C51A78"""
+"""599CD57E7E3AA3F5_19AE59656B17D180_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""F382B1E3D4C51A78"""
+"""FE49ADB0A2D3495E_0C57BF51F06A70C2_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""F382B1E3D4C51A78"""
+"""CE32F4A1C84D6AA9_75ECD07D07504CBF_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC(=CC=C3)CN4CCCC4""",21,"""F382B1E3D4C51A78"""
+"""3F5976F775CBFE14_6CC8F47F6F3CA33F_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""F382B1E3D4C51A78"""
+"""43E390439F42A7A0_113CAB9DE82A1256_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=CC(=C3)OCCN(C)C""",21,"""F382B1E3D4C51A78"""
+"""DCA3D6841FB1B5D3_E6E1675F7948B16D_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""F382B1E3D4C51A78"""
+"""5C79FEDE6F9DD6D9_D1C65FDB8E22B2D9_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""F382B1E3D4C51A78"""
+"""7D99F50AF4106EBB_030AA15FA42D986A_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""F382B1E3D4C51A78"""
+"""647FA3FD645CBC30_D3DF6FD75177AC79_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""F382B1E3D4C51A78"""
+"""EDAA74B26773386E_FC4A5B984250CEBC_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""F382B1E3D4C51A78"""
+"""DA8BE7D41BE38D8B_F971A53D9E601C95_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""F382B1E3D4C51A78"""
+"""F99F219C9D15C9CB_3C8A03CAFEE080A1_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""F382B1E3D4C51A78"""
+"""C0DF9A803AC4F890_2CA6939B210E3455_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""F382B1E3D4C51A78"""
+"""A62D6732CF4898F6_F1B5CAA28FADC02F_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""F382B1E3D4C51A78"""
+"""C040DC72DCFAFCE9_61C62ED816504AFA_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""F382B1E3D4C51A78"""
+"""1F2F7B9D27AFFD58_44E79E6BF65F8421_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""F382B1E3D4C51A78"""
+"""F173E45ECACD6224_221A2E2ADFD63541_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=C(OCCC(C)C)C=C3""",21,"""F382B1E3D4C51A78"""
+"""1F08C5259B2B0198_DF774D3C219CA511_6005_UN""","""C1(=CC2=C(C=C1)CC=C2)C3=CC=C(C=C3)OC4CCCC4""",21,"""F382B1E3D4C51A78"""
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+"""594C15903F21708B_3A24D8CB99269811_6005_UN""","""NC1=C(C=CC=C1C2=CC(=C(OC)C=C2)C(F)(F)F)C#N""",21,"""F52C6AE2B30302C8"""
+"""A46CABD4860EF33E_2A08489A46C82CE5_6005_UN""","""NC1=C(C=CC=C1C2=C(C=C(C=C2)C(=O)O)[N](=O)=O)C#N""",21,"""F52C6AE2B30302C8"""
+"""0363616277B39FFE_F71B11A3E86BD89F_6005_UN""","""NC1=C(C=CC=C1C2=CC(=CC=C2)C3=CC=CC=C3)C#N""",21,"""F52C6AE2B30302C8"""
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+"""52DA463D41A80B02_4249456A91999C91_6005_UN""","""NC1=C(C=CC=C1C2=C(C)C=C(C=C2)OC(F)(F)F)C#N""",21,"""F52C6AE2B30302C8"""
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+"""00E1D15436A71727_D9D9963D465ABDA1_6005_UN""","""NC1=C(C=CC=C1C2=CC=C(C=C2)OC3CCCC3)C#N""",21,"""F52C6AE2B30302C8"""
+"""05EAB0F340288955_58EF4FC3F1A1D575_6005_UN""","""NC1=C(C=CC=C1C2=C(C=C(OC)C=C2)CN(C)C)C#N""",21,"""F52C6AE2B30302C8"""
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+"""FBB67659600DC8D7_25F0038877F5A231_6005_UN""","""NC1=C(C=CC=C1C2=C(C=CC(=C2)C3(CC3)C#N)F)C#N""",21,"""F52C6AE2B30302C8"""
+"""C31820642296B266_53FB2D94BF99A55A_6005_UN""","""NC1=C(C=CC=C1C2=C(OCC(C)(C)C)N=CC=C2)C#N""",21,"""F52C6AE2B30302C8"""
+"""AF12EB829FA045B3_96CBBCAE267DCC25_6005_UN""","""NC1=C(C=CC=C1C2=CC=C(C=C2)C[N]3C=NC=N3)C#N""",21,"""F52C6AE2B30302C8"""
+"""C3B84AC901C7AF1D_FCAF8988D94BC745_6005_UN""","""NC1=C(C=CC=C1C2=C(OCC)C=CC(=C2)[N](=O)=O)C#N""",21,"""F52C6AE2B30302C8"""
+"""812D3DCF4B2A7394_8D943BFDC84049B6_6005_UN""","""NC1=C(C=CC=C1C3=CC2=C(C=C(OC)C=C2)C=C3)C#N""",21,"""F52C6AE2B30302C8"""
+"""CC39DD53F9BD9F53_3F5FD7880A0940F4_6005_UN""","""NC1=C(C=CC=C1C2=CC(=C(C=C2C3CC3)Cl)OC)C#N""",21,"""F52C6AE2B30302C8"""
+"""242FE0050CC15C1F_4A91450030A5D0C6_6005_UN""","""NC1=C(C=CC=C1C2=CC(=CC=C2)C3=CC=NC=C3)C#N""",21,"""F52C6AE2B30302C8"""
+"""89A32787392FF49F_196D1D590ED771D7_6005_UN""","""NC1=C(C=CC=C1C2=C(C=CC=C2)CN3CCCC3)C#N""",21,"""F52C6AE2B30302C8"""
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+"""4FDC34069E31960A_F8F4C5887691EBA9_6005_UN""","""C2(=C1C=CC=C[N]1N=N2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""F73C2FF3E0043F6D"""
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+"""F03BDA72A4CBD5FA_FEBFCC998A4CFAE0_6005_UN""","""C2(=C1C=CC=C[N]1N=N2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""F73C2FF3E0043F6D"""
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+"""910BDEB0413C7478_3D4F9299590E7D51_6005_UN""","""C2(=C1C=CC=C[N]1N=N2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""F73C2FF3E0043F6D"""
+"""989C82E12A356E31_4881001163A2ED63_6005_UN""","""C2(=C1C=CC=C[N]1N=N2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""F73C2FF3E0043F6D"""
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+"""68712E7A63B55ECD_9DBE4D45B349394D_6036_UN""","""COC(=O)C(C1CNCCC1)N(C(C)C)[S](=O)(=O)CCN""",21,"""F80FE320C0115BFB"""
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+"""3E7D00F2FC2FDFD7_5DF805A5E57556F8_6036_UN""","""COC(=O)C(C1CNCCC1)N([S](C)(=O)=O)C2CC(C2)N""",21,"""F80FE320C0115BFB"""
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+"""52F6775ED2E3D2A3_EEC381E407D24138_6036_UN""","""COC(=O)C(C1CNCCC1)N(C)[S](=O)(=O)C2CNCC2""",21,"""F80FE320C0115BFB"""
+"""99C46EB3708C2C23_509B8AF3B83DE4FC_6036_UN""","""COC(=O)C(C1CNCCC1)N([S](CC)(=O)=O)CCCBr""",21,"""F80FE320C0115BFB"""
+"""E7D68592E4CF9FC4_E4410BF31D336772_6036_UN""","""COC(=O)C(C1CNCCC1)N(CCCNC)[S](=O)(=O)C""",21,"""F80FE320C0115BFB"""
+"""28F484F9EDC88CB4_012C039594FA7D2A_6036_UN""","""COC(=O)C(C1CNCCC1)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""F80FE320C0115BFB"""
+"""B5E436D8D7394CA6_5367698EC8C5AEE2_6036_UN""","""COC(=O)C(C1CNCCC1)N([S](=O)(=O)CC#N)C2CC2""",21,"""F80FE320C0115BFB"""
+"""9BD06D95406EB5F4_D0B302F82063ECF5_6036_UN""","""COC(=O)C(C1CNCCC1)N([S](C)(=O)=O)C(=O)CCN""",21,"""F80FE320C0115BFB"""
+"""C4EE67C7380F610D_16B55508C43D5806_6036_UN""","""COC(=O)C(C1CNCCC1)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""F80FE320C0115BFB"""
+"""669CA2BB4DAC3739_B4130891D4724A47_6036_UN""","""COC(=O)C(C1CNCCC1)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""F80FE320C0115BFB"""
+"""413E1A7120A88829_797453D80B3C6A18_6036_UN""","""COC(=O)C(C1CNCCC1)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""F80FE320C0115BFB"""
+"""09FB0838D1EBFD44_8D09FC6FC43C3AB1_6036_UN""","""COC(=O)C(C1CNCCC1)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""F80FE320C0115BFB"""
+"""0337DF306DF7A239_87FD1B6F584702B7_6036_UN""","""COC(=O)C(C1CNCCC1)N(CC(CC)N)[S](=O)(=O)C""",21,"""F80FE320C0115BFB"""
+"""21D4DE3B8EB3BD22_85D34E4E5A4CB29C_6036_UN""","""COC(=O)C(C1CNCCC1)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""F80FE320C0115BFB"""
+"""C1868C6508CD4E07_1611510280B46978_6036_UN""","""COC(=O)C(C1CNCCC1)N([S](C)(=O)=O)CCN=[N]#N""",21,"""F80FE320C0115BFB"""
+"""BEC4A6B3F12B0AEA_C6A066A486C96D5C_6036_UN""","""COC(=O)C(C1CNCCC1)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""F80FE320C0115BFB"""
+"""AA23BBCD0F6B6583_8CAF01151107EAD1_6036_UN""","""COC(=O)C(C1CNCCC1)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""F80FE320C0115BFB"""
+"""1230AD47E75E999B_60929F771B2D4EDE_6036_UN""","""COC(=O)C(C1CNCCC1)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""F80FE320C0115BFB"""
+"""55F2993212D5A416_697F2B13B0786364_6036_UN""","""COC(=O)C(C1CNCCC1)N([S](=O)(=O)C2CC2)CC#C""",21,"""F80FE320C0115BFB"""
+"""107E5BBF35D6B8AC_3D7F31985776A6A2_6036_UN""","""COC(=O)C(C1CNCCC1)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""F80FE320C0115BFB"""
+"""2C388610936B69EF_15147E657272EA4A_6036_UN""","""COC(=O)C(C1CNCCC1)N2CCCC(C)(C)[S]2(=O)=O""",21,"""F80FE320C0115BFB"""
+"""BE10699474590893_DE3D8531FBB42159_6036_UN""","""COC(=O)C(C1CNCCC1)N2CCCC(CC)[S]2(=O)=O""",21,"""F80FE320C0115BFB"""
+"""C61B0CC5322BD221_EF54F5EB9E0D97F6_6036_UN""","""COC(=O)C(C1CNCCC1)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""F80FE320C0115BFB"""
+"""FCBF4095B5B0D8ED_304A9245E405AED8_6036_UN""","""COC(=O)C(C1CNCCC1)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""F80FE320C0115BFB"""
+"""5041F87B5D784E6B_9B725CDC309533F4_6036_UN""","""COC(=O)C(C1CNCCC1)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""F80FE320C0115BFB"""
+"""06FA1135B8DE5D97_DB1EEC8C35AFEA4A_6036_UN""","""COC(=O)C(C1CNCCC1)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""F80FE320C0115BFB"""
+"""DA3FF54DD783C066_73517658CEB2F522_6036_UN""","""COC(=O)C(C1CNCCC1)N2[S](CCN(C)CC2)(=O)=O""",21,"""F80FE320C0115BFB"""
+"""D9AC469B1B04FBDC_FFC650D5A61B1EC1_6036_UN""","""COC(=O)C(C1CNCCC1)N2CC(=O)NCC[S]2(=O)=O""",21,"""F80FE320C0115BFB"""
+"""BB373CBD90C36409_AA3D4DDC0BBED955_6036_UN""","""COC(=O)C(C1CNCCC1)N2[S](CCCCC2C)(=O)=O""",21,"""F80FE320C0115BFB"""
+"""FAF3568C8CBAA0BF_D0950810A55E36AB_6036_UN""","""COC(=O)C(C1CNCCC1)N(CCN)[S](=O)(=O)C2CC2""",21,"""F80FE320C0115BFB"""
+"""E78B8D379C7DA186_B66F2ED10172A45C_6036_UN""","""COC(=O)C(C1CNCCC1)N(CCN)[S](=O)(=O)C(F)F""",21,"""F80FE320C0115BFB"""
+"""D8746AEF46A3E3D3_166AB2B43F795ABE_6036_UN""","""COC(=O)C(C1CNCCC1)N([S](CC)(=O)=O)C2CNC2""",21,"""F80FE320C0115BFB"""
+"""C6AF572440A78227_24F36688A8900EC3_6036_DP""","""COC(=O)C(C1CNCCC1)N3CC2(CNC2)C[S]3(=O)=O""",21,"""F80FE320C0115BFB"""
+"""F0BDF8F6D06DA9E6_9E861F1A71534AA9_6036_UN""","""COC(=O)C(C1CNCCC1)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""F80FE320C0115BFB"""
+"""009F53F5C45F3FE2_626D874A78315A19_6036_UN""","""COC(=O)C(C1CNCCC1)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""F80FE320C0115BFB"""
+"""3A731DA03DC08D63_5C0CE0FDB50F9282_6036_UN""","""COC(=O)C(C1CNCCC1)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""F80FE320C0115BFB"""
+"""D81514A27BFFC14F_F94106A46FF85164_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=CC=C3)OC4CCCC4""",21,"""F8B157F09E63A8B8"""
+"""8DB334173B8F91A7_5636FE8894E8FD98_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=C(OCC)C=C3)OCC""",21,"""F8B157F09E63A8B8"""
+"""9ABCD87DF797673B_AA36894F0B030AB2_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=CC(=C3)OCCC(C)C""",21,"""F8B157F09E63A8B8"""
+"""8EB7D4F3CE07C360_F60C7119982F3CB6_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=C(C=C3)C[N]4C=CN=C4""",21,"""F8B157F09E63A8B8"""
+"""B39B3AD97196F37D_C5241ED81F41CA1E_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=C(C=C3)OC4CCOC4""",21,"""F8B157F09E63A8B8"""
+"""B3B2ACA9E3A5ECE6_0EC5FAACC7363EED_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=C(OC)C=C3)CN(C)C""",21,"""F8B157F09E63A8B8"""
+"""A847950523B02094_D6AADEA093F22F65_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=CC(=C3)COCCOC""",21,"""F8B157F09E63A8B8"""
+"""A966C60F6D332F9B_5FC753A19D4E2409_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=CC(=C3)CN(C)C4CC4""",21,"""F8B157F09E63A8B8"""
+"""A7A83008154FFD00_40DC4742AA04C36C_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=CC(=C3)OC(COC)C""",21,"""F8B157F09E63A8B8"""
+"""61DCE763EF0679AB_129DBF7621B16340_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=C(C(NOC)=O)C=C3)F""",21,"""F8B157F09E63A8B8"""
+"""E4E368FEF96513A3_07645942BACCC202_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=C(OC)N=C(C=C3)C(F)(F)F""",21,"""F8B157F09E63A8B8"""
+"""A23C6D9DC3EBA8F6_7EDF366E4DF6FE7F_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=CC=C3)CN4CCCC4""",21,"""F8B157F09E63A8B8"""
+"""B1D9E2E3BCB16F6E_67FB126C259A11FF_6005_UN""","""C2(=C[N]1CCCCC1=N2)C4=CC=C([N]3C=C(C)C=N3)C=C4""",21,"""F8B157F09E63A8B8"""
+"""ACCA72663E2693FE_1A0F4D8EA28CA096_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=CC(=C3)OCCN(C)C""",21,"""F8B157F09E63A8B8"""
+"""AF1C5135FD7F4F72_EDD2814C33EE03AD_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""F8B157F09E63A8B8"""
+"""6A8756F8F5E8084F_DAF5B9C8C4840019_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=C(C=C3)C4=CC=CC=C4""",21,"""F8B157F09E63A8B8"""
+"""BEA597738EB72A87_0839474CEE8B2AAA_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""F8B157F09E63A8B8"""
+"""F0589384BE978BEA_D8EC89C41BD11EB9_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""F8B157F09E63A8B8"""
+"""731F0D6182397C4D_F779BD8B08F67C7C_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""F8B157F09E63A8B8"""
+"""0B1BC5D95CFD07AE_F242432ED4C6AE55_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=CC(=C3F)C(N(C)C)=O""",21,"""F8B157F09E63A8B8"""
+"""DC9AB47DB40F857F_37B9E5D9B4463261_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=C(OC)C=C3)C(F)(F)F""",21,"""F8B157F09E63A8B8"""
+"""38B63C44D07E1490_279575886BA88695_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""F8B157F09E63A8B8"""
+"""B596F20150809AC9_FA862CB1C50B72EF_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=CC=C3)C4=CC=CC=C4""",21,"""F8B157F09E63A8B8"""
+"""4315296DCDC5E244_6AF5C8CB5CF6F83A_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=C(OC)C=C(C=C3)C(F)(F)F""",21,"""F8B157F09E63A8B8"""
+"""D0B5F34093AC859D_4FD47878BCF936E1_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=C(C)C=C(C=C3)OC(F)(F)F""",21,"""F8B157F09E63A8B8"""
+"""2E83943909118F53_2929C83995708781_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=C(OCCC(C)C)C=C3""",21,"""F8B157F09E63A8B8"""
+"""DB18F292F7D53152_D444AB2F6B3A17D1_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC=C(C=C3)OC4CCCC4""",21,"""F8B157F09E63A8B8"""
+"""F074FF78D31F94F3_557272D1DCC17F05_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=C(C=C(OC)C=C3)CN(C)C""",21,"""F8B157F09E63A8B8"""
+"""7B9803030B74DD84_200D10E3A6EDDBB2_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""F8B157F09E63A8B8"""
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+"""EE691CF7E5338CA2_470C78121DC57AB6_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""F8B157F09E63A8B8"""
+"""6649A710C44BFB37_14F0204B23B7DBA7_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=C(C=CC=C3)CN4CCCC4""",21,"""F8B157F09E63A8B8"""
+"""3891D6C7FFFB1784_8C2470CA9F05381D_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=CC(=N[N]3C4CCCCO4)C""",21,"""F8B157F09E63A8B8"""
+"""7F1899FBA08CACBE_86235AC9C678DCE0_6005_UN""","""C2(=C[N]1CCCCC1=N2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""F8B157F09E63A8B8"""
+"""FF696F402EC0A1E0_72BB3A44FFC13E66_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CN=C(OC)C=C3""",21,"""F980C23E542D3901"""
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+"""FEC10909652D0AE1_AC6C93BB7D77171B_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C=CC=C3F)F""",21,"""F980C23E542D3901"""
+"""2839426157995ADD_804B96FCBEF6533E_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C=CC(=C3)C)C""",21,"""F980C23E542D3901"""
+"""B5A2B78A34BA60D4_D69E387C8873B1C2_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CC=C(SC)C=C3""",21,"""F980C23E542D3901"""
+"""537DE0799813EB0B_31716EBDA6E54626_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C(=CC=C3)Cl)Cl""",21,"""F980C23E542D3901"""
+"""8A410DA12024B39E_86F7B83D15B393CA_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(N=C(C=C3)O)F""",21,"""F980C23E542D3901"""
+"""45ADC26F62A8CC15_C1444C34238D2874_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C)C=NC(=C3)F""",21,"""F980C23E542D3901"""
+"""4E931E30C9B5DF24_AB210386A5781378_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CC(=C(C=C3)F)F""",21,"""F980C23E542D3901"""
+"""DB06DFB4DC3BE175_8298429C039B9DAE_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CC(=C(C)C=C3)C""",21,"""F980C23E542D3901"""
+"""0E4370BF6A7108B0_528A25E5771847C2_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(SC)C=CC=C3""",21,"""F980C23E542D3901"""
+"""3E41E7F1A5E93B09_F8F13741BF5AC556_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C)C=CC=C3C""",21,"""F980C23E542D3901"""
+"""90BE596456AF57B7_778183AAA6E4079F_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C)C(=NC=C3)F""",21,"""F980C23E542D3901"""
+"""846D31140F9BB596_4808061A6C448947_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CSC=C3C(F)F""",21,"""F980C23E542D3901"""
+"""9F89C68E320776AB_6B89174D36A44B20_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C(=CC=C3)Cl)F""",21,"""F980C23E542D3901"""
+"""6EF3CFBF7EE62B9B_AE8B44D2ABD1B055_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CC(=C(C=C3)F)Cl""",21,"""F980C23E542D3901"""
+"""E3471A4C62C71F7A_EF6137D57443A663_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CC(=CC=C3)CF""",21,"""F980C23E542D3901"""
+"""FFAD895834B851B8_FE5D1D1F2CFFBA17_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CC=C(C=C3)CF""",21,"""F980C23E542D3901"""
+"""524C67826DFF6C15_997F429BCD6E05A1_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C)C=C(C=C3)F""",21,"""F980C23E542D3901"""
+"""7D8377E27542CCE7_2A016664715D43E2_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(CC)C=CC=C3""",21,"""F980C23E542D3901"""
+"""EFBBE3A410E92006_F845884DC370073E_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C=CC(=C3)F)F""",21,"""F980C23E542D3901"""
+"""4BED723ED9F6E6E5_55C553199F5DA5C1_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(OC)N=CC=C3""",21,"""F980C23E542D3901"""
+"""CEFA0C5B08F13AC2_387A38FE9BFFA757_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CC(=NC=C3)OC""",21,"""F980C23E542D3901"""
+"""42DAC3F76A8E78E4_5FDBF3AF00F35C87_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C=C(C)C=C3)F""",21,"""F980C23E542D3901"""
+"""4AA6493D06DBC94D_74CD949F7E63AFDA_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C(=CC=C3)Br)F""",21,"""F980C23E542D3901"""
+"""76C4F3EC7A8EF4B5_600AC3D0BA884F99_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C=C(C)C=C3)C""",21,"""F980C23E542D3901"""
+"""02CABB99F1E7FF4F_D875B5232F117108_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CC=CC(=C3)CC""",21,"""F980C23E542D3901"""
+"""783B02B8D2FC48B7_1A6DE97EF0C95D85_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C([N](C)N=C3)C#N""",21,"""F980C23E542D3901"""
+"""365E5F516E016270_FC4B6C459065971A_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=C(C)C=CC(=C3)F""",21,"""F980C23E542D3901"""
+"""A528C57A1F6C735F_F9C0E5851578C786_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CC(=C(C=C3)Cl)F""",21,"""F980C23E542D3901"""
+"""BAD9D3A68B88DD9C_E5FD0E8079893E77_6006_UN""","""COC1=C(C2=C(C=C1)CCCC2=O)C3=CN=C(NC)C=C3""",21,"""F980C23E542D3901"""
+"""D8C97C0D134C5FB4_5985D2DBB14D3026_2201_UN""","""COC1=C(C2=C(C=C1)CCC3=CC4=C(N=C23)N=CC=C4)Cl""",21,"""F980C23E542D3901"""
+"""A8EA5538169AE928_EF182FF0D53AE7CF_2201_UN""","""COC1=C(C2=C(C=C1)CCC3=CC4=C(N=C23)C=CN=C4)Cl""",21,"""F980C23E542D3901"""
+"""3E38B15FB862053F_35546775A6E51EBC_2201_UN""","""COC1=C(C3=C(C=C1)CCC4=C(C)C2=NON=C2N=C34)Cl""",21,"""F980C23E542D3901"""
+"""7031A7EC17CDF293_D8B0563F4BC25F85_2201_UN""","""COC1=C(C3=C(C=C1)CCC4=C(C)C2=C(SC=C2)N=C34)Cl""",21,"""F980C23E542D3901"""
+"""0372E146CA3125D0_D08DAC80A8B2CE6B_2201_UN""","""COC1=C(C3=C(C=C1)CCC4=CC2=C([N](C)N=C2)N=C34)Cl""",21,"""F980C23E542D3901"""
+"""A51767EF96A11E3A_2C0A71CF4F2330BE_2201_UN""","""COC1=C(C2=C(C=C1)CCC3=CC4=C(N=C23)C=NC=C4)Cl""",21,"""F980C23E542D3901"""
+"""A942FE3436D7ABA1_F355AC3780AC50A9_2201_UN""","""COC1=C(C3=C(C=C1)CCC4=CC2=C(ON=C2C)N=C34)Cl""",21,"""F980C23E542D3901"""
+"""F7B721AE5596AA70_B58B6E449C507366_2201_UN""","""COC1=C(C3=C(C=C1)CCC4=CC2=C(C)[NH]N=C2N=C34)Cl""",21,"""F980C23E542D3901"""
+"""06A4AD806FC39260_272DFDF1D6793185_2201_UN""","""COC1=C(C2=C(C=C1)CCC3=CC4=C(N=C23)N=CN=C4)Cl""",21,"""F980C23E542D3901"""
+"""CC4BCC271335F896_F8521B39EEA71043_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=CC=C2)OC3CCCC3""",21,"""F9A24A6D1F3CE99F"""
+"""39D83843125FA3FC_5725E31515B7BCBF_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=C(OCC)C=C2)OCC""",21,"""F9A24A6D1F3CE99F"""
+"""86886BBE78F15B80_AB2594D28A5C4B95_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=CC(=C2)OCCC(C)C""",21,"""F9A24A6D1F3CE99F"""
+"""850AAAC9A85376BF_F71F6C8419707D91_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""F9A24A6D1F3CE99F"""
+"""C449BA24741D5F16_C43703459E1E8B39_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=C(C=C2)OC3CCOC3""",21,"""F9A24A6D1F3CE99F"""
+"""F987F52829AD8E6F_0FD6E73146697FCA_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""F9A24A6D1F3CE99F"""
+"""5EF64EB5E99B7BE5_D7B9C33D12AD6E42_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=CC(=C2)COCCOC""",21,"""F9A24A6D1F3CE99F"""
+"""2A14107A0DAF2ADF_5ED44E3C1C11652E_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""F9A24A6D1F3CE99F"""
+"""BE06992AEC1696D9_41CF5ADF2B5B824B_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=CC(=C2)OC(COC)C""",21,"""F9A24A6D1F3CE99F"""
+"""D7036BBE9DCD2224_138EA2EBA0EE2267_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""F9A24A6D1F3CE99F"""
+"""EB62033E6A661014_067744DF3B938325_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""F9A24A6D1F3CE99F"""
+"""D1059156AD44039D_7FCC2BF3CCA9BF58_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=CC=C2)CN3CCCC3""",21,"""F9A24A6D1F3CE99F"""
+"""0BBEAF78BC6A2495_66E80FF1A4C550D8_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""F9A24A6D1F3CE99F"""
+"""38E1C0615AF90CEE_1B1C501323D3E1B1_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=CC(=C2)OCCN(C)C""",21,"""F9A24A6D1F3CE99F"""
+"""62322FE2E97AB2D5_ECC19CD1B2B1428A_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""F9A24A6D1F3CE99F"""
+"""FC1F0F6994A91452_DBE6A45545DB413E_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""F9A24A6D1F3CE99F"""
+"""40944CE2A3B2BD4A_092A5AD16FD46B8D_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""F9A24A6D1F3CE99F"""
+"""6A568AD56969AF3A_D9FF94599A8E5F9E_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""F9A24A6D1F3CE99F"""
+"""8BB1199093A5411E_F66AA01689A93D5B_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""F9A24A6D1F3CE99F"""
+"""563BD70D7FF46140_F3515EB35599EF72_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""F9A24A6D1F3CE99F"""
+"""CB40111B5CDA30A7_36AAF84435197346_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""F9A24A6D1F3CE99F"""
+"""98594538C969FE83_26866815EAF7C7B2_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""F9A24A6D1F3CE99F"""
+"""CDB28957BCAED818_FB95312C445433C8_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""F9A24A6D1F3CE99F"""
+"""E484A0F2A86C38CF_6BE6D556DDA9B91D_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""F9A24A6D1F3CE99F"""
+"""4BCD7C5C4CE9DCD4_4EC765E53DA677C6_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""F9A24A6D1F3CE99F"""
+"""70F1F2ABF526122E_283AD5A4142FC6A6_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=C(OCCC(C)C)C=C2""",21,"""F9A24A6D1F3CE99F"""
+"""713EE28243CC97FE_D557B6B2EA6556F6_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=C(C=C2)OC3CCCC3""",21,"""F9A24A6D1F3CE99F"""
+"""DDC7A477F064D851_54616F4C5D9E3E22_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""F9A24A6D1F3CE99F"""
+"""CA2954FB8A18E834_211E0D7E27B29A95_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""F9A24A6D1F3CE99F"""
+"""7CCE0F795EF79A0B_DEF9CAF2F0B36478_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""F9A24A6D1F3CE99F"""
+"""D201AE9CCA6C2825_297E2307DBCA4966_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""F9A24A6D1F3CE99F"""
+"""DB077172DA86A13A_5F750D1B13A64E0D_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""F9A24A6D1F3CE99F"""
+"""294695D07450DB42_9A459C218A422772_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""F9A24A6D1F3CE99F"""
+"""B71379AB52E95EE0_F021A90775742C12_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""F9A24A6D1F3CE99F"""
+"""36CFE772104D267D_811A1B72647FA2E1_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""F9A24A6D1F3CE99F"""
+"""0071BADBB712E97C_33D1F707A636ABA3_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""F9A24A6D1F3CE99F"""
+"""F385A9DECB1427CA_461F658F9C9A3B91_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""F9A24A6D1F3CE99F"""
+"""7FB1B33A5DADF0A1_15E33DD6A2E89A80_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(C=CC=C2)CN3CCCC3""",21,"""F9A24A6D1F3CE99F"""
+"""609617C9E0E19B96_8D376D571E5A793A_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=CC(=N[N]2C3CCCCO3)C""",21,"""F9A24A6D1F3CE99F"""
+"""26963EE9AFAE8E87_8730475447279DC7_6005_UN""","""CC1=N[NH]C(=C1C(=O)O)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""F9A24A6D1F3CE99F"""
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+"""7EEF561D2355103C_00E5BAAA85EF7878_6036_UN""","""NC(CCN(C(C)(C)C#N)[S](=O)(=O)C)CC1=CC=CC=C1""",21,"""F9C65A1FD1045EA9"""
+"""D7F28426DB069FD6_52AED0B1D9D0ABB0_6036_UN""","""NC(CCN([S](=O)(=O)CC#N)C1CC1)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""3778B5441A201F37_D17ABBC73176E9A7_6036_UN""","""NC(CCN([S](C)(=O)=O)C(=O)CCN)CC1=CC=CC=C1""",21,"""F9C65A1FD1045EA9"""
+"""E68F60014DB663CA_177CEC37D5285D54_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1=CC=CS1)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
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+"""A41889E6B369234D_78BDEAE71A296F4A_6036_UN""","""NC(CCN(C(C)(C)C)[S](=O)(=O)CBr)CC1=CC=CC=C1""",21,"""F9C65A1FD1045EA9"""
+"""A82F8D8F240658C7_8CC04550D5293FE3_6036_UN""","""NC(CCN(C(C)(C)C#C)[S](=O)(=O)C)CC1=CC=CC=C1""",21,"""F9C65A1FD1045EA9"""
+"""DE92E1CADBC4E889_8634A250495207E5_6036_UN""","""NC(CCN(CC(CC)N)[S](=O)(=O)C)CC1=CC=CC=C1""",21,"""F9C65A1FD1045EA9"""
+"""062917069DD04B3A_841AF7714B59B7CE_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1=C[NH]C=N1)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""80BF91BF72533104_17D8E83D91A16C2A_6036_UN""","""NC(CCN([S](C)(=O)=O)CCN=[N]#N)CC1=CC=CC=C1""",21,"""F9C65A1FD1045EA9"""
+"""72F98FE8E119DE00_C769DF9B97DC680E_6036_UN""","""NC(CCN(CC(C)(C)N)[S](=O)(=O)C)CC1=CC=CC=C1""",21,"""F9C65A1FD1045EA9"""
+"""422A57C40EE713A3_8D66B82A0012EF83_6036_UN""","""NC(CCN1[S](CC(C)(C)C1=O)(=O)=O)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""1B4A8C64EA0819AC_615B26480A384B8C_6036_UN""","""NC(CCN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2)CC3=CC=CC=C3""",21,"""F9C65A1FD1045EA9"""
+"""BD32BF56E0844255_68B6922CA16D6636_6036_UN""","""NC(CCN([S](=O)(=O)C1CC1)CC#C)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""1269AE6D6D94F659_3CB688A74663A3F0_6036_UN""","""NC(CCN1[S](=O)(=O)C2(CCC1)CC2)CC3=CC=CC=C3""",21,"""F9C65A1FD1045EA9"""
+"""3153C09F032E3A76_14DDC75A6367EF18_6036_UN""","""NC(CCN1CCCC(C)(C)[S]1(=O)=O)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""44894F2DCCA1BF58_DFF43C0EEAA1240B_6036_UN""","""NC(CCN1CCCC(CC)[S]1(=O)=O)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""AFB39D46AE5B49CE_EE9D4CD48F1892A4_6036_UN""","""NC(CCN1C(C(N)CC[S]1(=O)=O)=O)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""69C5164534C591C6_31832B7AF510AB8A_6036_UN""","""NC(CCN([S](C)(=O)=O)[C@@H]1CNCC1)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""2989A9B602AD7C41_9ABBE5E3218036A6_6036_UN""","""NC(CCN1CCCC(Cl)(Cl)[S]1(=O)=O)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""29BA71B00C132C66_DAD755B324BAEF18_6036_UN""","""NC(CCN([S](C)(=O)=O)[C@H]1CNCC1)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""3C1C7D81537B6177_7298CF67DFA7F070_6036_UN""","""NC(CCN1[S](CCN(C)CC1)(=O)=O)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""CF0CE557121F2841_FE0FE9EAB70E1B93_6036_UN""","""NC(CCN1CC(=O)NCC[S]1(=O)=O)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""1B693F84A6BABE9F_ABF4F4E31AABDC07_6036_UN""","""NC(CCN1[S](CCCCC1C)(=O)=O)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""C4792449F876CFCA_D15CB12FB44B33F9_6036_UN""","""NC(CCN(CCN)[S](=O)(=O)C1CC1)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""271213989A68C694_B7A697EE1067A10E_6036_UN""","""NC(CCN(CCN)[S](=O)(=O)C(F)F)CC1=CC=CC=C1""",21,"""F9C65A1FD1045EA9"""
+"""71E7D81015BF2CF6_17A30B8B2E6C5FEC_6036_UN""","""NC(CCN([S](CC)(=O)=O)C1CNC1)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""01356D5976C407CA_253ADFB7B9850B91_6036_DP""","""NC(CCN2CC1(CNC1)C[S]2(=O)=O)CC3=CC=CC=C3""",21,"""F9C65A1FD1045EA9"""
+"""5A3687AF1EF00CAD_9F4FA62560464FFB_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1=N[NH]C=N1)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""F3BA62F86958AD17_63A43E7569245F4B_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1=C[NH]N=C1)CC2=CC=CC=C2""",21,"""F9C65A1FD1045EA9"""
+"""9D162F0241F72782_5DC559C2A41A97D0_6036_UN""","""NC(CCN(C(C)(C)CN)[S](=O)(=O)C)CC1=CC=CC=C1""",21,"""F9C65A1FD1045EA9"""
+"""90182F112119E5E8_FDE49C8AD15F0094_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC(=CC=C2)OC3CCCC3""",21,"""FC14CDDE20C4F948"""
+"""E9EBFDD12C288CE4_529364A62A4FAC68_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC(=C(OCC)C=C2)OCC""",21,"""FC14CDDE20C4F948"""
+"""401E365AF8FD7DCA_AE931361B5A45B42_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC=CC(=C2)OCCC(C)C""",21,"""FC14CDDE20C4F948"""
+"""40A6F9E21C5DECD6_F2A9EB3726886D46_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""FC14CDDE20C4F948"""
+"""7B272A0BE9375A09_C18184F6A1E69BEE_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC=C(C=C2)OC3CCOC3""",21,"""FC14CDDE20C4F948"""
+"""23F999AB1B67D654_0A60608279916F1D_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""FC14CDDE20C4F948"""
+"""876567EAE4E64BDC_D20F448E2D557E95_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC=CC(=C2)COCCOC""",21,"""FC14CDDE20C4F948"""
+"""33E099978D36AC6D_5B62C98F23E975F9_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""FC14CDDE20C4F948"""
+"""C12525D3B34DC803_4479DD6C14A3929C_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC=CC(=C2)OC(COC)C""",21,"""FC14CDDE20C4F948"""
+"""E49924415AADD6FB_163825589F1632B0_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""FC14CDDE20C4F948"""
+"""6B364B2C2A7CF1CB_03C1C36C046B93F2_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""FC14CDDE20C4F948"""
+"""E860296CA6D391FE_7A7AAC40F351AF8F_6025_UN""","""C1(=NC(=CC=N1)C(=O)C)C2=CC(=CC=C2)CN3CCCC3""",21,"""FC14CDDE20C4F948"""
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+"""A39C06506906F3AE_7A98BA2DF1A20B3D_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=CC(=CC=C3)CN4CCCC4""",21,"""FCF6DBB322375DFA"""
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+"""044B0E8FB5E61B78_0C7ECB0F52DFDFE8_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=C(C=CC=C3F)OC(F)(F)F""",21,"""FCF6DBB322375DFA"""
+"""2F6AB1308C33B0B8_DCAB0587A785EBFB_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=CC(=C(C=C3)Cl)OC(F)(F)F""",21,"""FCF6DBB322375DFA"""
+"""DB46E151B89BA0B4_F33E31C8B4A2893E_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=C(C=C(OC)C=C3)C(F)(F)F""",21,"""FCF6DBB322375DFA"""
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+"""034DD08A5126C221_23D2F9CBD7FC73D7_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=C(C=C(C=C3)C(=O)O)[N](=O)=O""",21,"""FCF6DBB322375DFA"""
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+"""5C9A54C251AC5ED6_244A9CA01AB92EF0_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=CC(=C(N=C3)C(F)(F)F)OC""",21,"""FCF6DBB322375DFA"""
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+"""BB0E231F201426B7_F57538D9487F9877_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""FCF6DBB322375DFA"""
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+"""5717A49667628C0D_368566D99B3D1FC6_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=CC(=C(C=C3C4CC4)Cl)OC""",21,"""FCF6DBB322375DFA"""
+"""1D7F69B68EA2A932_434BF451A1918FF4_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=CC(=CC=C3)C4=CC=NC=C4""",21,"""FCF6DBB322375DFA"""
+"""771B22225E6B9ECC_10B7AC089FE32EE5_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=C(C=CC=C3)CN4CCCC4""",21,"""FCF6DBB322375DFA"""
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+"""7CB08B079965FAD0_8264D68A7A2C29A2_6004_UN""","""C1(=CC2=C(N=C1)CNC2)C3=C(C=C(C=C3)OC(F)(F)F)F""",21,"""FCF6DBB322375DFA"""
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+"""371EA9CE0B4AA93D_D23CDF6384EE11AA_6036_UN""","""CCCCCCCNCCCN([S](CC)(=O)=O)CCCN""",21,"""FD149C0B575E2988"""
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+"""CF7A1960FA375721_1E397289420FA60A_6036_UN""","""CCCCCCCNCCCN(CCCN)[S](=O)(=O)CCl""",21,"""FD149C0B575E2988"""
+"""FED030CE302833EB_EBD8FECF909D334B_6036_UN""","""CCCCCCCNCCCN(C)[S](=O)(=O)C1CNCC1""",21,"""FD149C0B575E2988"""
+"""E9677877F49EC903_5580F5D82F72968F_6036_UN""","""CCCCCCCNCCCN([S](CC)(=O)=O)CCCBr""",21,"""FD149C0B575E2988"""
+"""4287DC0D3D6DA9FD_E15A74D88A7C1501_6036_UN""","""CCCCCCCNCCCN(CCCNC)[S](=O)(=O)C""",21,"""FD149C0B575E2988"""
+"""C655BEB60B8E969D_04377CBE03B50F59_6036_UN""","""CCCCCCCNCCCN(C(C)(C)C#N)[S](=O)(=O)C""",21,"""FD149C0B575E2988"""
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+"""F5290117B1EB8298_D5A87DD3B72C9E86_6036_UN""","""CCCCCCCNCCCN([S](C)(=O)=O)C(=O)CCN""",21,"""FD149C0B575E2988"""
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+"""FE6CE3D6B1DF4FCC_B10877BA433D3834_6036_UN""","""CCCCCCCNCCCN(C(C)(C)C)[S](=O)(=O)CCl""",21,"""FD149C0B575E2988"""
+"""2CA2CF51F982FA18_7C6F2CF39C73186B_6036_UN""","""CCCCCCCNCCCN(C(C)(C)C)[S](=O)(=O)CBr""",21,"""FD149C0B575E2988"""
+"""19823FFCA4E41A54_88128344537348C2_6036_UN""","""CCCCCCCNCCCN(C(C)(C)C#C)[S](=O)(=O)C""",21,"""FD149C0B575E2988"""
+"""35CBEB626F4C294A_82E66444CF0870C4_6036_UN""","""CCCCCCCNCCCN(CC(CC)N)[S](=O)(=O)C""",21,"""FD149C0B575E2988"""
+"""6EC184E7C8E0C933_80C83165CD03C0EF_6036_UN""","""CCCCCCCNCCCN(C)[S](=O)(=O)C1=C[NH]C=N1""",21,"""FD149C0B575E2988"""
+"""E35DE588B0B1289E_130A2E2917FB1B0B_6036_UN""","""CCCCCCCNCCCN([S](C)(=O)=O)CCN=[N]#N""",21,"""FD149C0B575E2988"""
+"""C938D10B94413382_C3BB198F11861F2F_6036_UN""","""CCCCCCCNCCCN(CC(C)(C)N)[S](=O)(=O)C""",21,"""FD149C0B575E2988"""
+"""1A70595683D5A9AA_89B47E3E864898A2_6036_UN""","""CCCCCCCNCCCN1[S](CC(C)(C)C1=O)(=O)=O""",21,"""FD149C0B575E2988"""
+"""E1AC86D7F436D0AE_6589E05C8C623CAD_6036_UN""","""CCCCCCCNCCCN1[C@H]2CC[C@@H](C[S]1(=O)=O)C2""",21,"""FD149C0B575E2988"""
+"""5170637205AED448_6C64543827371117_6036_UN""","""CCCCCCCNCCCN([S](=O)(=O)C1CC1)CC#C""",21,"""FD149C0B575E2988"""
+"""0CB6CB1FA5307F5A_38644EB3C039D4D1_6036_UN""","""CCCCCCCNCCCN1[S](=O)(=O)C2(CCC1)CC2""",21,"""FD149C0B575E2988"""
+"""AFF7E97F8824B256_100F014EE53D9839_6036_UN""","""CCCCCCCNCCCN1CCCC(C)(C)[S]1(=O)=O""",21,"""FD149C0B575E2988"""
+"""DF7718095C0F1A1E_DB26FA1A6CFB532A_6036_UN""","""CCCCCCCNCCCN1CCCC(CC)[S]1(=O)=O""",21,"""FD149C0B575E2988"""
+"""DBE4D18C461190CC_EA4F8AC00942E585_6036_UN""","""CCCCCCCNCCCN1C(C(N)CC[S]1(=O)=O)=O""",21,"""FD149C0B575E2988"""
+"""972827C5544145BE_3551ED6E734ADCAB_6036_UN""","""CCCCCCCNCCCN([S](C)(=O)=O)[C@@H]1CNCC1""",21,"""FD149C0B575E2988"""
+"""B68B6E713FB45304_9E6923F7A7DA4187_6036_UN""","""CCCCCCCNCCCN1CCCC(Cl)(Cl)[S]1(=O)=O""",21,"""FD149C0B575E2988"""
+"""314B2DAFC3359C67_DE0593A7A2E09839_6036_UN""","""CCCCCCCNCCCN([S](C)(=O)=O)[C@H]1CNCC1""",21,"""FD149C0B575E2988"""
+"""E5BC794447761CC5_764A097359FD8751_6036_UN""","""CCCCCCCNCCCN1[S](CCN(C)CC1)(=O)=O""",21,"""FD149C0B575E2988"""
+"""C07E590DDDED5522_FADD2FFE31546CB2_6036_UN""","""CCCCCCCNCCCN1CC(=O)NCC[S]1(=O)=O""",21,"""FD149C0B575E2988"""
+"""47A72B1903481C03_AF2632F79CF1AB26_6036_UN""","""CCCCCCCNCCCN1[S](CCCCC1C)(=O)=O""",21,"""FD149C0B575E2988"""
+"""A608091BF2643348_D58E773B321144D8_6036_UN""","""CCCCCCCNCCCN(CCN)[S](=O)(=O)C1CC1""",21,"""FD149C0B575E2988"""
+"""353B846995256F59_B37451FA963DD62F_6036_UN""","""CCCCCCCNCCCN(CCN)[S](=O)(=O)C(F)F""",21,"""FD149C0B575E2988"""
+"""479A99BEB3F8B5C4_1371CD9FA83628CD_6036_UN""","""CCCCCCCNCCCN([S](CC)(=O)=O)C1CNC1""",21,"""FD149C0B575E2988"""
+"""136FECF76084BFA8_21E819A33FDF7CB0_6036_DP""","""CCCCCCCNCCCN2CC1(CNC1)C[S]2(=O)=O""",21,"""FD149C0B575E2988"""
+"""AD494ACB41A2F366_9B9D6031E61C38DA_6036_UN""","""CCCCCCCNCCCN(C)[S](=O)(=O)C1=N[NH]C=N1""",21,"""FD149C0B575E2988"""
+"""7398292111F6D18B_6776F861EF7E286A_6036_UN""","""CCCCCCCNCCCN(C)[S](=O)(=O)C1=C[NH]N=C1""",21,"""FD149C0B575E2988"""
+"""3CFB2D139FEBDD79_59179FD62240E0F1_6036_UN""","""CCCCCCCNCCCN(C(C)(C)CN)[S](=O)(=O)C""",21,"""FD149C0B575E2988"""
+"""A696F00BC70C02CC_03131DB57BCAD64F_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](CCN)(=O)=O)C3CC3""",21,"""FDDB635AA531BB57"""
+"""A9C3460D36747E47_986ACD3FD669D9E1_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C(C)C)[S](=O)(=O)CCN""",21,"""FDDB635AA531BB57"""
+"""BFAAF4E8FD5B666A_CFE5218A3829FABD_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](C)(=O)=O)CCN=C=S""",21,"""FDDB635AA531BB57"""
+"""687D26C3AB3380E3_D2F3203276818375_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](CC)(=O)=O)CCCN""",21,"""FDDB635AA531BB57"""
+"""EBC09F23954F41BA_582C85DF8055B654_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](C)(=O)=O)C3CC(C3)N""",21,"""FDDB635AA531BB57"""
+"""56E194160F3AD9C9_1EF68DD8B06034D5_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(CCCN)[S](=O)(=O)CCl""",21,"""FDDB635AA531BB57"""
+"""9596650C9103A28F_EB17019E62F2A194_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C)[S](=O)(=O)C3CNCC3""",21,"""FDDB635AA531BB57"""
+"""45AB96A557A57D26_554F0A89DD1D0450_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](CC)(=O)=O)CCCBr""",21,"""FDDB635AA531BB57"""
+"""4EDE7F5B8F6A201D_E1958B89781387DE_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(CCCNC)[S](=O)(=O)C""",21,"""FDDB635AA531BB57"""
+"""6C285BA2EE505793_04F883EFF1DA9D86_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""FDDB635AA531BB57"""
+"""844203A6157B1A93_56B3E9F4ADE54E4E_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](=O)(=O)CC#N)C3CC3""",21,"""FDDB635AA531BB57"""
+"""2D79B2AD2542B26C_D567828245430C59_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](C)(=O)=O)C(=O)CCN""",21,"""FDDB635AA531BB57"""
+"""DC7D8E2572C76C72_1361D572A11DB8AA_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C)[S](=O)(=O)C3=CC=CS3""",21,"""FDDB635AA531BB57"""
+"""A12DAC4A5E3ECFAA_B1C788EBB152AAEB_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""FDDB635AA531BB57"""
+"""929588D650D3BFCF_7CA0D3A26E1C8AB4_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""FDDB635AA531BB57"""
+"""01B22999AE91B163_88DD7C15A11CDA1D_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""FDDB635AA531BB57"""
+"""AF75DC4AD174FCEE_82299B153D67E21B_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(CC(CC)N)[S](=O)(=O)C""",21,"""FDDB635AA531BB57"""
+"""8C48C1D573B4ACE0_8007CE343F6C5230_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C)[S](=O)(=O)C3=C[NH]C=N3""",21,"""FDDB635AA531BB57"""
+"""B93FF8EDE2DD8965_13C5D178E59489D4_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](C)(=O)=O)CCN=[N]#N""",21,"""FDDB635AA531BB57"""
+"""7F105D7C252A3FA9_C374E6DEE3E98DF0_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""FDDB635AA531BB57"""
+"""29603B48E582E242_897B816F74270A7D_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N3[S](CC(C)(C)C3=O)(=O)=O""",21,"""FDDB635AA531BB57"""
+"""1D8194B00EEB3E9A_65461F0D7E0DAE72_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N3[C@H]4CC[C@@H](C[S]3(=O)=O)C4""",21,"""FDDB635AA531BB57"""
+"""B98AA9C23F2F3C18_6CABAB69D55883C8_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](=O)(=O)C3CC3)CC#C""",21,"""FDDB635AA531BB57"""
+"""FFB755E5267A77CB_38ABB1E23256460E_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N3[S](=O)(=O)C4(CCC3)CC4""",21,"""FDDB635AA531BB57"""
+"""04D1EB57F4235C47_10C0FE1F17520AE6_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N3CCCC(C)(C)[S]3(=O)=O""",21,"""FDDB635AA531BB57"""
+"""AFEBC08A5EA61FA4_DBE9054B9E94C1F5_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N3CCCC(CC)[S]3(=O)=O""",21,"""FDDB635AA531BB57"""
+"""F4BFB7432DBE71C9_EA807591FB2D775A_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N3C(C(N)CC[S]3(=O)=O)=O""",21,"""FDDB635AA531BB57"""
+"""779CE562B5D5675A_359E123F81254E74_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](C)(=O)=O)[C@@H]3CNCC3""",21,"""FDDB635AA531BB57"""
+"""E9F79FBF83008BB1_9EA6DCA655B5D358_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N3CCCC(Cl)(Cl)[S]3(=O)=O""",21,"""FDDB635AA531BB57"""
+"""E5BFDCBDC178CF7B_DECA6CF6508F0AE6_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](C)(=O)=O)[C@H]3CNCC3""",21,"""FDDB635AA531BB57"""
+"""147A3C1BEF8B6E9E_7685F622AB92158E_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N3[S](CCN(C)CC3)(=O)=O""",21,"""FDDB635AA531BB57"""
+"""89022619934E60AF_FA12D0AFC33BFE6D_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N3CC(=O)NCC[S]3(=O)=O""",21,"""FDDB635AA531BB57"""
+"""60C6B1F31E0D47DF_AFE9CDA66E9E39F9_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N3[S](CCCCC3C)(=O)=O""",21,"""FDDB635AA531BB57"""
+"""7E714EE0B19481AE_D541886AC07ED607_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(CCN)[S](=O)(=O)C3CC3""",21,"""FDDB635AA531BB57"""
+"""34CDEFBF227B2E31_B3BBAEAB645244F0_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(CCN)[S](=O)(=O)C(F)F""",21,"""FDDB635AA531BB57"""
+"""51EBB8D06BE7BCA9_13BE32CE5A59BA12_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N([S](CC)(=O)=O)C3CNC3""",21,"""FDDB635AA531BB57"""
+"""506D0C5163923419_2127E6F2CDB0EE6F_6036_DP""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N4CC3(CNC3)C[S]4(=O)=O""",21,"""FDDB635AA531BB57"""
+"""EF7CCC0242E1FEB1_9B529F601473AA05_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C)[S](=O)(=O)C3=N[NH]C=N3""",21,"""FDDB635AA531BB57"""
+"""64CC521B0ECA314F_67B907301D11BAB5_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C)[S](=O)(=O)C3=C[NH]N=C3""",21,"""FDDB635AA531BB57"""
+"""1B9864BEF65CF1D6_59D86087D02F722E_6036_UN""","""C(C2=NC1=C(C=C(C=C1)Br)O2)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""FDDB635AA531BB57"""
+"""A3A2505B0C94609D_FC0FA99ECF86BE14_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=CC=C2)OC3CCCC3""",21,"""FDFFF8CA3E1D47C8"""
+"""326370224E674F2D_537851B2349612E8_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=C(OCC)C=C2)OCC""",21,"""FDFFF8CA3E1D47C8"""
+"""0630940883BCD3FF_AF782675AB7DE5C2_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=CC(=C2)OCCC(C)C""",21,"""FDFFF8CA3E1D47C8"""
+"""D7F0ED1DCC69126C_F342DE233851D3C6_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""FDFFF8CA3E1D47C8"""
+"""88314DEB6022A953_C06AB1E2BF3F256E_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=C(C=C2)OC3CCOC3""",21,"""FDFFF8CA3E1D47C8"""
+"""1094A74520E261B8_0B8B55966748D19D_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""FDFFF8CA3E1D47C8"""
+"""B7F425B3AE94382B_D3E4719A338CC015_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=CC(=C2)COCCOC""",21,"""FDFFF8CA3E1D47C8"""
+"""E89D16E27546C7A0_5A89FC9B3D30CB79_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""FDFFF8CA3E1D47C8"""
+"""8011AA6276A707C9_4592E8780A7A2C1C_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=CC(=C2)OC(COC)C""",21,"""FDFFF8CA3E1D47C8"""
+"""D66A07E9B12F95B6_17D3104C81CF8C30_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""FDFFF8CA3E1D47C8"""
+"""2C5AC6202228CEBA_022AF6781AB22D72_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""FDFFF8CA3E1D47C8"""
+"""9234ADD729AF540E_7B919954ED88110F_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=CC=C2)CN3CCCC3""",21,"""FDFFF8CA3E1D47C8"""
+"""FB28644BC712012F_62B5BD5685E4FE8F_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""FDFFF8CA3E1D47C8"""
+"""16836B2A47BD3BA0_1F41E2B402F24FE6_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=CC(=C2)OCCN(C)C""",21,"""FDFFF8CA3E1D47C8"""
+"""E3D5C62AA031A4DC_E89C2E769390ECDD_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""FDFFF8CA3E1D47C8"""
+"""20A119885DF0C10A_DFBB16F264FAEF69_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""FDFFF8CA3E1D47C8"""
+"""69F4933BA15F9C94_0D77E8764EF5C5DA_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""FDFFF8CA3E1D47C8"""
+"""8A0C48D43B90EF18_DDA226FEBBAFF1C9_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""FDFFF8CA3E1D47C8"""
+"""0FE5827EEA92D2D1_F23712B1A888930C_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""FDFFF8CA3E1D47C8"""
+"""3909272FFABB0A3C_F70CEC1474B84125_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""FDFFF8CA3E1D47C8"""
+"""F558563DA38895B8_32F74AE31438DD11_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""FDFFF8CA3E1D47C8"""
+"""64BEF7588DDF60AC_22DBDAB2CBD669E5_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""FDFFF8CA3E1D47C8"""
+"""A4D81C55813B88F2_FFC8838B65759D9F_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""FDFFF8CA3E1D47C8"""
+"""720E0E314895D397_6FBB67F1FC88174A_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""FDFFF8CA3E1D47C8"""
+"""DC854427E8A3F04A_4A9AD7421C87D991_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""FDFFF8CA3E1D47C8"""
+"""9BA857BFE0AE0E42_2C676703350E68F1_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=C(OCCC(C)C)C=C2""",21,"""FDFFF8CA3E1D47C8"""
+"""FBA0817B2A00DCA7_D10A0415CB44F8A1_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=C(C=C2)OC3CCCC3""",21,"""FDFFF8CA3E1D47C8"""
+"""B73EBDF74436FDAB_503CDDEB7CBF9075_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""FDFFF8CA3E1D47C8"""
+"""59FCAB92FE629812_2543BFD9069334C2_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""FDFFF8CA3E1D47C8"""
+"""6701CB93F3F675C7_DAA47855D192CA2F_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""FDFFF8CA3E1D47C8"""
+"""FF56A9400CA54DD4_2D2391A0FAEBE731_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""FDFFF8CA3E1D47C8"""
+"""A01BD0261FE2F67A_5B28BFBC3287E05A_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""FDFFF8CA3E1D47C8"""
+"""41D1BD38EA411EAC_9E182E86AB638925_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""FDFFF8CA3E1D47C8"""
+"""E7E6D4CC7A99B600_F47C1BA054558245_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""FDFFF8CA3E1D47C8"""
+"""2021E6BA162C010E_8547A9D5455E0CB6_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""FDFFF8CA3E1D47C8"""
+"""6F736EC87D00FF44_378C45A0871705F4_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""FDFFF8CA3E1D47C8"""
+"""C184D5508473805D_4242D728BDBB95C6_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""FDFFF8CA3E1D47C8"""
+"""25D44CF75A6A87CB_11BE8F7183C934D7_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(C=CC=C2)CN3CCCC3""",21,"""FDFFF8CA3E1D47C8"""
+"""0DDA45D5340DEE83_896ADFF03F7BD76D_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=CC(=N[N]2C3CCCCO3)C""",21,"""FDFFF8CA3E1D47C8"""
+"""0F29BABDFC5B3E2A_836DF5F366063390_6005_UN""","""C[N]1N=CC(=C1C(=O)O)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""FDFFF8CA3E1D47C8"""
+"""AFA70BCF129622DB_01BA6DEF88D08AB4_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](CCN)(=O)=O)C2CC2""",21,"""FF721300562BE7AC"""
+"""DC3EFCC783C473E2_9AC3BD652573851A_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C(C)C)[S](=O)(=O)CCN""",21,"""FF721300562BE7AC"""
+"""31393354D1E890A4_CD4C51D0CB33A646_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](C)(=O)=O)CCN=C=S""",21,"""FF721300562BE7AC"""
+"""AEA9D27122EEA708_D05A5068859BDF8E_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](CC)(=O)=O)CCCN""",21,"""FF721300562BE7AC"""
+"""E6EFF03DD6268EE6_5A85F585734FEAAF_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](C)(=O)=O)C2CC(C2)N""",21,"""FF721300562BE7AC"""
+"""BC441AC9E949F319_1C5FFD82437A682E_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(CCCN)[S](=O)(=O)CCl""",21,"""FF721300562BE7AC"""
+"""16E3E40002B9C67F_E9BE71C491E8FD6F_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C)[S](=O)(=O)C2CNCC2""",21,"""FF721300562BE7AC"""
+"""2498146C30F0A1A8_57E67AD32E0758AB_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](CC)(=O)=O)CCCBr""",21,"""FF721300562BE7AC"""
+"""3F8E46795E737D93_E33CFBD38B09DB25_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(CCCNC)[S](=O)(=O)C""",21,"""FF721300562BE7AC"""
+"""D35160ABCCA9AF8E_0651F3B502C0C17D_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C(C)(C)C#N)[S](=O)(=O)C""",21,"""FF721300562BE7AC"""
+"""AFB5D390BBC3D02B_541A99AE5EFF12B5_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](=O)(=O)CC#N)C2CC2""",21,"""FF721300562BE7AC"""
+"""7097F3B55A46AC23_D7CEF2D8B65950A2_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](C)(=O)=O)C(=O)CCN""",21,"""FF721300562BE7AC"""
+"""96999AA554246740_11C8A5285207E451_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C)[S](=O)(=O)C2=CC=CS2""",21,"""FF721300562BE7AC"""
+"""28C42C343A6659E7_B36EF8B14248F610_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C(C)(C)C)[S](=O)(=O)CCl""",21,"""FF721300562BE7AC"""
+"""30F1C2D3118AB7C0_7E09A3F89D06D64F_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C(C)(C)C)[S](=O)(=O)CBr""",21,"""FF721300562BE7AC"""
+"""FAE632328BDFDDFD_8A740C4F520686E6_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C(C)(C)C#C)[S](=O)(=O)C""",21,"""FF721300562BE7AC"""
+"""F680451A1022AAA1_8080EB4FCE7DBEE0_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(CC(CC)N)[S](=O)(=O)C""",21,"""FF721300562BE7AC"""
+"""053494332C717B25_82AEBE6ECC760ECB_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C)[S](=O)(=O)C2=C[NH]C=N2""",21,"""FF721300562BE7AC"""
+"""34B13F27011859A8_116CA122168ED52F_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](C)(=O)=O)CCN=[N]#N""",21,"""FF721300562BE7AC"""
+"""3EC21766C8BED5F2_C1DD968410F3D10B_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(CC(C)(C)N)[S](=O)(=O)C""",21,"""FF721300562BE7AC"""
+"""3233C2F70D7BA937_8BD2F135873D5686_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N2[S](CC(C)(C)C2=O)(=O)=O""",21,"""FF721300562BE7AC"""
+"""73BB8D7A9C395E1B_67EF6F578D17F289_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N2[C@H]3CC[C@@H](C[S]2(=O)=O)C3""",21,"""FF721300562BE7AC"""
+"""787F3838A1382C80_6E02DB332642DF33_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](=O)(=O)C2CC2)CC#C""",21,"""FF721300562BE7AC"""
+"""FDD10CF67C7FDB31_3A02C1B8C14C1AF5_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N2[S](=O)(=O)C3(CCC2)CC3""",21,"""FF721300562BE7AC"""
+"""7BC75C8C3768696C_12698E45E448561D_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N2CCCC(C)(C)[S]2(=O)=O""",21,"""FF721300562BE7AC"""
+"""552712F1A40FA662_D94075116D8E9D0E_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N2CCCC(CC)[S]2(=O)=O""",21,"""FF721300562BE7AC"""
+"""9D90E237D7287E2F_E82905CB08372BA1_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N2C(C(N)CC[S]2(=O)=O)=O""",21,"""FF721300562BE7AC"""
+"""A39329DFB58E828D_37376265723F128F_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](C)(=O)=O)[C@@H]2CNCC2""",21,"""FF721300562BE7AC"""
+"""B90F553476C35D87_9C0FACFCA6AF8FA3_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N2CCCC(Cl)(Cl)[S]2(=O)=O""",21,"""FF721300562BE7AC"""
+"""EE1F2B783DFD8E55_DC631CACA395561D_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](C)(=O)=O)[C@H]2CNCC2""",21,"""FF721300562BE7AC"""
+"""A4CAAE93D78D5FCB_742C867858884975_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N2[S](CCN(C)CC2)(=O)=O""",21,"""FF721300562BE7AC"""
+"""6A15E6E76EB0E7A9_F8BBA0F53021A296_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N2CC(=O)NCC[S]2(=O)=O""",21,"""FF721300562BE7AC"""
+"""01A3213BF6F535CB_AD40BDFC9D846502_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N2[S](CCCCC2C)(=O)=O""",21,"""FF721300562BE7AC"""
+"""0A5B21739C2FCEFB_D7E8F83033648AFC_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(CCN)[S](=O)(=O)C2CC2""",21,"""FF721300562BE7AC"""
+"""E0609D1E41B07D61_B112DEF19748180B_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(CCN)[S](=O)(=O)C(F)F""",21,"""FF721300562BE7AC"""
+"""0AF8DE1B65A74AFE_11174294A943E6E9_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N([S](CC)(=O)=O)C2CNC2""",21,"""FF721300562BE7AC"""
+"""D18FCA0EF7660A97_238E96A83EAAB294_6036_DP""","""NCC(C1=C(C=CC=C1F)Cl)N3CC2(CNC2)C[S]3(=O)=O""",21,"""FF721300562BE7AC"""
+"""26C385EEAAA7B763_99FBEF3AE769F6FE_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C)[S](=O)(=O)C2=N[NH]C=N2""",21,"""FF721300562BE7AC"""
+"""4EAAEE7060A3DE1B_6510776AEE0BE64E_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C)[S](=O)(=O)C2=C[NH]N=C2""",21,"""FF721300562BE7AC"""
+"""375C756203649F9A_5B7110DD23352ED5_6036_UN""","""NCC(C1=C(C=CC=C1F)Cl)N(C(C)(C)CN)[S](=O)(=O)C""",21,"""FF721300562BE7AC"""
+"""67C5BC360BA60C50_FE54D79652E36944_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC(=CC=C2)OC3CCCC3""",21,"""FFA486C2A3789098"""
+"""212BDEF3923E0ADE_51232FBAA9F3C5B8_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC(=C(OCC)C=C2)OCC""",21,"""FFA486C2A3789098"""
+"""15100C169ABD4542_AD23587D36183292_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2)OCCC(C)C""",21,"""FFA486C2A3789098"""
+"""CAD43A271EB4405C_F119A02BA5340496_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""FFA486C2A3789098"""
+"""28B7402D2DAF9B53_C231CFEA225AF23E_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)OC3CCOC3""",21,"""FFA486C2A3789098"""
+"""0914058B144C401B_09D02B9EFA2D06CD_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""FFA486C2A3789098"""
+"""7924C153C9143E2F_D1BF0F92AEE91745_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2)COCCOC""",21,"""FFA486C2A3789098"""
+"""11603000277F4674_58D28293A0551C29_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""FFA486C2A3789098"""
+"""62EDE1AFA9CF5501_47C99670971FFB4C_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2)OC(COC)C""",21,"""FFA486C2A3789098"""
+"""5D1D88716CDB6360_15886E441CAA5B60_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""FFA486C2A3789098"""
+"""0E8B5BA81EEBBD66_0071887087D7FA22_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""FFA486C2A3789098"""
+"""44FA4D3D6E3030C8_79CAE75C70EDC65F_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC(=CC=C2)CN3CCCC3""",21,"""FFA486C2A3789098"""
+"""17468802BFE80848_60EEC35E188129DF_6004_DP""","""NC1=C(C=CC(=C1)C#N)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""FFA486C2A3789098"""
+"""6AA9DAE8FA9E899E_1D1A9CBC9F9798B6_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC=CC(=C2)OCCN(C)C""",21,"""FFA486C2A3789098"""
+"""7CF651FB7B5E5865_EAC7507E0EF53B8D_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""FFA486C2A3789098"""
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+"""4FA6AD2A2142731B_6DE019F961EDC01A_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""FFA486C2A3789098"""
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+"""B19368E15AC9F368_2E3C190BA86BBFA1_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC=C(OCCC(C)C)C=C2""",21,"""FFA486C2A3789098"""
+"""D880E0EF5AF324C9_D3517A1D56212FF1_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)OC3CCCC3""",21,"""FFA486C2A3789098"""
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+"""A52FBB35FFB3A5FE_2718C1D19BF6E392_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""FFA486C2A3789098"""
+"""C611C5545D839CD4_D8FF065D4CF71D7F_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""FFA486C2A3789098"""
+"""949767E092ECBA8A_2F78EFA8678E3061_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""FFA486C2A3789098"""
+"""21DF11F395AE6DFE_5973C1B4AFE2370A_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""FFA486C2A3789098"""
+"""34114E67ED20CBC7_9C43508E36065E75_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""FFA486C2A3789098"""
+"""3B08568121A381E3_F62765A8C9305515_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""FFA486C2A3789098"""
+"""01512170513DEA11_871CD7DDD83BDBE6_6004_DP""","""NC1=C(C=CC(=C1)C#N)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""FFA486C2A3789098"""
+"""BC2B35ED71030C37_35D73BA81A72D2A4_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""FFA486C2A3789098"""
+"""B7FAF6FE4DE0F7B9_4019A92020DE4296_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""FFA486C2A3789098"""
+"""CD8DB36ED50A051D_13E5F1791EACE387_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=C(C=CC=C2)CN3CCCC3""",21,"""FFA486C2A3789098"""
+"""223C0860B9E5E88E_8B31A1F8A21E003D_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=CC(=N[N]2C3CCCCO3)C""",21,"""FFA486C2A3789098"""
+"""EFA179AC03549C35_81368BFBFB63E4C0_6004_DP""","""NC1=C(C=CC(=C1)C#N)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""FFA486C2A3789098"""
+"""382EDE5BF275A84C_0EDF686A267D9B69_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(C)=C)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""4A86459F30E0917B_12C11889F9F34BC8_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(F)F)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""98A9FEA7CBB15C51_AA24F408AD7E7093_6031_DP""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCNC)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""F08000A6D6137B04_AE04397A4FF12BFD_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OC[C@H](C)N)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""E3193DE90B1B9DC8_725048EC5B11433E_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(C)S)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""238D078C17B36344_0F72BCD40FD04633_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCSC)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""79B852BC3EC56795_4CAAB601DFB4BF44_6031_DP""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(C)N)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""CCF069AD21B42EF9_1815998BA8482AC5_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC#CC)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""2B32325DE9733845_8D64AE25D25C991A_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCON)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""60547AB2F1E6703A_8A1F3CC536B5221A_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(=C)Br)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""DAE7623158CDF14C_A02D5C4C5AF4D703_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OC[C@@H](C)N)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""393FD7E6C35AA5BD_917660BC9B4F4081_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OC[CH]=[C]=[CH2])C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""6A0F19DEFB30D61D_66AE7490515BD4CC_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC#CBr)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""C2E25C8145CA6AC1_E8EA4DA585C34C42_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(C)Cl)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""2FBCB639F3E9E4E4_F853222732E543FF_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCCF)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""0EDAAA83E631E4B8_7C903B9EC3E7A065_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(N)=S)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""62E9A6D257A1D4EF_7D08E678B92F7E42_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCCS)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""7B5C9FFA3558787D_02F9C62A63E47E2C_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCCC)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""1E1B6472FBDEB1A7_809B0FDCA1B2EAD8_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCCN)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""EC0F054E94EB9FEA_209A883E54022B6B_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCCBr)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""E46403BCC45BAD37_6546BC89F1A4874B_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(C)C)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""9C24F6006C5B0BF2_570C6248FA371FFC_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC3CC3)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""C29D2FFDB2385568_0983DE86812BCCFB_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCC=C)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""81E60AA2FFB1CCC7_C88B74DD4739CC97_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCC#C)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""2E86DE36A7635ADE_D2E10701873CD658_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCCCl)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""94935815A8654929_7C1B8994C45BF0F7_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCC#N)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""1ADD03423F5E1D50_036DD4CFBDF0F8DF_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(F)Br)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""53F8304A61228149_B48B5496A82C30ED_6031_DP""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCNN)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""92F6553E2DE59616_4BF8CA11337B1FE6_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(=C)F)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""8A0E44B493E23508_4F308E0CD192EB43_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC=CBr)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""9836F391A61F9408_DDF42305A7D09456_6031_DP""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCCO)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""232652DA48A2EE4B_33EF4C1D1A0DB571_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCOC)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""1F619915B4B38B17_67EBDBBD9B18ABC5_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OC[C@@H]3CO3)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""8594479E2D715242_80E48A3415DCE0E2_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OC[C@H]3CO3)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""2A1E8945BD4ECCD4_6EDD093C5477B386_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC3CO3)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""4700F35FAA6D3612_6A9D6FE0CC996655_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(Cl)Cl)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""8453325EC4589369_3D615FF28B72522C_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(=C)Cl)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""2FCC2E7E216C34B4_5A8EE4EAD4B3EF94_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(C)F)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""4E8E90EE94322FD0_E4C2EDF7A2567E73_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC=CCl)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""8ACA9710D8FFA31E_7A4AB8B598156DC8_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCC(C)Br)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""754E0C36CD3E0A96_AFEADEA1B50BFA8A_6031_UN""","""C[N]1C(=NC2=C1C=CC(=C2)C(=O)OCCCI)C(F)(F)F""",21,"""02BE1A4A01878DEA"""
+"""BCC97980894E82E1_0F86F8981DA7E68B_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(C)=C)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""A12CCEB676FEBFE4_1398887BC229362A_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(F)F)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""FED2008020583698_AB7D64FA96A40D71_6031_DP""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCNC)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""5F42E43F2AF17339_AF5DA988742B561F_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OC[C@H](C)N)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""F8B284B29D46DFE7_7309D81E60CB3EDC_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(C)S)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""BCC5EE0E9B16F529_0E2B2C26340A3BD1_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCSC)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""AFC20E205E1A3F60_4DF326F3E46EC2A6_6031_DP""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(C)N)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""1FF60C75F4A595E3_194C097993925727_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC#CC)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""698D652E58654A94_8C3D3ED7E986E4F8_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCON)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""68A3BBFBFCB460ED_8B46AC370D6F5FF8_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(=C)Br)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""76E280125FCB0E3A_A174CCBE612EAAE1_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OC[C@@H](C)N)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""13E175086A1463FE_902FF04EA0953D63_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OC[CH]=[C]=[CH2])C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""32202211830121B8_67F7E4626A81A92E_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC#CBr)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""96528E7D53537B30_E9B3DD57BE1931A0_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(C)Cl)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""A86ABEEA80AC5752_F90AB2D5093F3E1D_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCCF)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""322F1E95670C7032_7DC9AB6CF83DDD87_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(N)=S)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""0ABDE8355299EE62_7C51768A82F503A0_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCCS)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""AE4CFAADD7184A75_03A056D8583E03CE_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCCC)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""FC41E458D2EC102A_81C29F2E9A68973A_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCCN)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""E5E7102EF426A727_21C318CC6FD85689_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCCBr)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""0AB8BBCC541C00E2_641F2C7BCA7EFAA9_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(C)C)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""805FB6B87ADA5A12_5655F2BAC1ED621E_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC2CC2)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""796126F7023B5C49_08DA4E74BAF1B119_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCC=C)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""58C9ED8F02ED85E4_C9D2E42F7CE3B175_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCC#C)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""4A0856FE6F95E31E_D3B897F3BCE6ABBA_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCCCl)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""2ADC6A178CB61DCF_7D421966FF818D15_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCCC#N)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""36FB48037C0BCF77_0234443D862A853D_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(F)Br)C(F)(F)F""",21,"""03E78AB83A5DF008"""
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+"""10C3C0D540C8E470_4E691EFEEA4896A1_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC=CBr)C(F)(F)F""",21,"""03E78AB83A5DF008"""
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+"""9F0A9E279EDAE9B2_66B24B4FA0C2D627_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OC[C@@H]2CO2)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""7EB320C80944086A_81BD1AC62E069D00_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OC[C@H]2CO2)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""38AF9E6004C23354_6F8499CE6FADCE64_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC2CO2)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""9571260BABBD293B_6BC4FF12F7431BB7_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(Cl)Cl)C(F)(F)F""",21,"""03E78AB83A5DF008"""
+"""A3F04BF02D714EE1_3C38CF00B0A82FCE_6031_UN""","""COC1=C(C=CC=C1)C(N)(C(=O)OCC(=C)Cl)C(F)(F)F""",21,"""03E78AB83A5DF008"""
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+"""1590156B8A6600B5_FB78AF9633B780AD_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CC=C(C)C=C2)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""46E31FA3CE822592_42D769E0BEC8DCF7_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CC(=CC=C2)F)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
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+"""767C46B5AA972A66_CA4443076F66F1A2_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(N=CC=C2)F)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
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+"""AF5F71306F78C23E_5AA1BA852E93BCFE_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CN=C(C=C2)Cl)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""B90600901285E5A7_711C542910A7C1C3_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CC=CC(=C2)N)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""DC43EC45EB7BF45B_0BC9A0331C31C9D2_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CN=C(N)C=C2)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
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+"""7B809A0F41BA95F1_834477090EC19D50_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CSC(=C2)C#N)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""B32D14CB30125307_5E466A29CDF0B548_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CC=N[N]2CC)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
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+"""C1598D0613FB8093_514A507B82B15ECD_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CC(=NS2)OC)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""BC77E306B8BB387A_22BD838086734AE7_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CC(=CC=C2)Cl)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
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+"""08A963351C412A36_C3E3515BA47A90AE_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CC=C(C=C2)F)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""E6C12BC74A75F6C0_153A3BBD069174E5_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CC(=NC=C2)Cl)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""2145AB25CB2DD5AC_0F2F5F0B2B664C6F_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(C)C=CC=C2)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""BF2AE52983F08FA1_4F8E324CE319D64E_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(SC=C2)C#N)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""A2347716A1788F54_BA726DBEF263D589_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(C=NC=C2)F)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""3A35866D5CD8DAB3_B87136399409928E_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(C)SC(=C2)C)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""DC0759E24261CB4D_0F7A113107FBCDB1_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(OC=C2)C#N)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""9C7BDB428129414E_FC17E921D1C3FBAE_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(N)C=NC=C2)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""4407BEC133EADE7B_87D7E18AA0C4BDA1_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(N)N=CC=C2)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""6A38CAC86447B054_8BBF5FE31921583A_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(C=CO2)C#N)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""66ED738FBBFD6915_A7970FD66F60E6BA_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(C)C=NC=C2)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""1709CF9D4C2B49E0_4E3628F8BE6AAFB4_6004_DP""","""COC(=O)C1=C(C=C(C=C1)C2=CC=C(CN)O2)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""B5427BF7EE5A5586_4DF997DEF79ADE72_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=C(SC(=C2)Cl)Cl)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""71561CE91CEF8205_9888293B1729A3FF_6004_DP""","""COC(=O)C1=C(C=C(C=C1)C2=CC=C(CN)S2)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""A127C0B27C7C47EF_F1E95C750B3695C2_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=N[N](C=C2C)C)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""45547D5A71EA8312_185F0F9F35BFA03C_6004_DP""","""COC(=O)C1=C(C=C(C=C1)C2=CC=C(O)C=C2)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""D1973490D3BD1ED2_0EB3AEB57AEA6C7C_6004_UN""","""COC(=O)C1=C(C=C(C=C1)C2=CC=C(C#N)O2)[S](=O)(=O)N""",21,"""047FCAE5B90C17CB"""
+"""4EEE113E0356CD9F_DBBBD98BECD68904_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC=CC(=C2)C)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""212E7BEB82531A22_FA67A241279F3797_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC=C(C)C=C2)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""058C11BB574D8EAE_43C86437AAE06BCD_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC(=CC=C2)F)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""5C66EBEBC07FD22D_D9D8BDD5C0845506_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC(=CN=C2)F)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""3EFAB4F2B179F7BC_AE9A0FAFDA8F1D63_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(N)C=CN=C2)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""74E8D2E52812F3DF_BA3AA3804CBB560C_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CN=C(C=C2)F)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""737F723C775AF199_A7AAB31384F985E5_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(C=CC=C2)Cl)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""99B4DE18B233B46F_1D47D39C7F71C2B0_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC=C(C#N)S2)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""B5ED5E78FAA97E9F_DAA4BFB926B12E79_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(N=CC=C2)Cl)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""EF5642642EDD5E41_34D31D54028EC0E6_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC(=CC=C2)O)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""BFD35C281C3F6983_CB5B4ED07B4E4698_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(N=CC=C2)F)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""0D94A78F2EC060D9_41015760D3AFF09C_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC=C(C=C2)O)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""F69904C8BBFD8509_5BBEB7523ABB0BC4_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CN=C(C=C2)Cl)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""815CE377245FC3E8_700359FE048F76F9_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC=CC(=C2)N)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""2C56993C47952A12_0AD6ADE408197EE8_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CN=C(N)C=C2)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""7D40F142002C2803_DD35F3F525AF0AE0_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(ON=C2C)C)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""FDC08C8F50ACC48A_825B7ADE1AE92A6A_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CSC(=C2)C#N)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""45E181973B3D3A16_5F5967FED9D80272_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC=N[N]2CC)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""F2BC96ABFDD51B00_7B92AD22D14FCDFB_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC(=C(Cl)S2)Cl)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""03A9C214AD127768_50555DAC9699E9F7_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC(=NS2)OC)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""B14E1505363CF49A_23A28E57925BFDDD_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC(=CC=C2)Cl)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""A792C559DE008199_A5ABD742DC293166_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(C=CC=C2)O)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""7AF7DD10F4EDE888_99A0FC2AE1E10EE0_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC=C(C=C2)Cl)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""DAAE865C57B49FF5_71B031856412D737_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(C=CC=N2)Cl)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""AA7EE771A54217C6_C2FC5C8CB0522794_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC=C(C=C2)F)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""925C36997E4085B2_1425366A12B9C3DF_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=CC(=NC=C2)Cl)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""2DE4687C751AC1C8_0E3052DC3F4EFB55_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(C)C=CC=C2)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""DF7356F336834DE2_4E913F9BF7316174_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(SC=C2)C#N)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""E304AB8C32439C44_BB6D6069E64B62B3_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(C=NC=C2)F)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""38CA11103C9FC228_B96E3BEE802125B4_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(C)SC(=C2)C)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""36131BAB6BCCFEB3_0E651CE613D37A8B_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(OC=C2)C#N)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""3C17E77F1EEC838E_FD08E4F6C5EB4C94_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(N)C=NC=C2)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""21AFA2DF017C6D26_86C8EC5DB4EC0A9B_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(N)N=CC=C2)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""1EB826366BB85276_8AA052340D09EF00_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(C=CO2)C#N)NC(=S)N""",21,"""0560C732AD24A0F1"""
+"""07E0E201B15FCB82_A68802017B485180_6004_UN""","""COC(=O)C1=CC(=C(C=C1)C2=C(C)C=NC=C2)NC(=S)N""",21,"""0560C732AD24A0F1"""
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+"""ACAE2D200B430034_95C19401560A8483_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)C[CH]=[C]=[CH2]""",21,"""0609EEF7CCC249E8"""
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+"""6DC8ED2270644CAF_61F148343CE14349_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC(C)C""",21,"""0609EEF7CCC249E8"""
+"""0C32221FF763910F_53BB96F53772DBFE_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC3CC3""",21,"""0609EEF7CCC249E8"""
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+"""4B57891ECF8D9900_07DA207270B53CDD_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC(F)Br""",21,"""0609EEF7CCC249E8"""
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+"""E24C644A3EE1DED9_4F4F3EACFE3EDBE4_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC(=C)F""",21,"""0609EEF7CCC249E8"""
+"""88E36353BCD9D942_4B877AB11CD72F41_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC=CBr""",21,"""0609EEF7CCC249E8"""
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+"""D7B53E8393924848_3758B8A0D7487173_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CCOC""",21,"""0609EEF7CCC249E8"""
+"""3E694BA116279DCF_635C2F00565D6FC7_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)C[C@@H]3CO3""",21,"""0609EEF7CCC249E8"""
+"""E6CAD3E1D1A61D48_84537E89D89924E0_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)C[C@H]3CO3""",21,"""0609EEF7CCC249E8"""
+"""F398DB5BC3D81E91_6A6AFD8199327784_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC3CO3""",21,"""0609EEF7CCC249E8"""
+"""F34DCA14A3FEE19E_6E2A9B5D01DCA257_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC(Cl)Cl""",21,"""0609EEF7CCC249E8"""
+"""9B5B02EA6DE99940_39D6AB4F4637962E_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC(=C)Cl""",21,"""0609EEF7CCC249E8"""
+"""F3DA9D1B11F2D8B3_5E39105719F62B96_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC(C)F""",21,"""0609EEF7CCC249E8"""
+"""BA3DC301152EC629_E075194A6F13BA71_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC=CCl""",21,"""0609EEF7CCC249E8"""
+"""AA149FBF597BDED0_7EFD4C085550A9CA_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CC(C)Br""",21,"""0609EEF7CCC249E8"""
+"""BC02EAB5F0D72448_AB5D2A1C784E3E88_6031_UN""","""O(C(=O)C1=NOC(=C1Cl)C2=C(C=C(C=C2)Cl)Cl)CCCI""",21,"""0609EEF7CCC249E8"""
+"""7A08F4E8F1480701_0BD29884ADE8A5E6_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(S2)[N]3C=CC=C3)CC(C)=C""",21,"""07B3EAA48A12B365"""
+"""8AA57BB2AC5ACBC1_17CCE86772667547_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(S2)[N]3C=CC=C3)CC(F)F""",21,"""07B3EAA48A12B365"""
+"""23494FD4DD6AB664_AF2904E626EB4E1C_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)N=C(S2)[N]3C=CC=C3)CCNC""",21,"""07B3EAA48A12B365"""
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+"""E742EFA304D6988F_A9E4B89618E5D05E_6031_UN""","""O(C(=O)C(C1CCCCCC1)N2CCCCC2)C[C@@H](C)N""",21,"""0B77FE9043968AB7"""
+"""B9C9E54ED0B3856C_98BF8466D95E47DC_6031_UN""","""O(C(=O)C(C1CCCCCC1)N2CCCCC2)C[CH]=[C]=[CH2]""",21,"""0B77FE9043968AB7"""
+"""619E5163D7DD9C46_6F67904A134AD391_6031_UN""","""O(C(=O)C(C1CCCCCC1)N2CCCCC2)CC#CBr""",21,"""0B77FE9043968AB7"""
+"""7E892DAF1BE274F7_E123A97FC7D24B1F_6031_UN""","""O(C(=O)C(C1CCCCCC1)N2CCCCC2)CC(C)Cl""",21,"""0B77FE9043968AB7"""
+"""8A7787FC6E4FA629_F19AC6FD70F444A2_6031_UN""","""O(C(=O)C(C1CCCCCC1)N2CCCCC2)CCCF""",21,"""0B77FE9043968AB7"""
+"""F7503612A841DC5E_7559DF4481F6A738_6031_UN""","""O(C(=O)C(C1CCCCCC1)N2CCCCC2)CC(N)=S""",21,"""0B77FE9043968AB7"""
+"""5B7D8D5AF45930EA_74C102A2FB3E791F_6031_UN""","""O(C(=O)C(C1CCCCCC1)N2CCCCC2)CCCS""",21,"""0B77FE9043968AB7"""
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+"""46115EE817F44ED3_305AEF6FDEEF6BB4_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=CC(=CC=C2)Cl""",21,"""1698A60AE1903698"""
+"""989C606D7C4B9606_B653B67A909DA70F_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(C=CC=C2)O""",21,"""1698A60AE1903698"""
+"""60B5D15289946E4C_8A589D12AD559889_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=CC=C(C=C2)Cl""",21,"""1698A60AE1903698"""
+"""915946373E5F31CC_624850BD28A6415E_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(C=CC=N2)Cl""",21,"""1698A60AE1903698"""
+"""429F5A37F09EB272_D1043DB4FCE6B1FD_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=CC=C(C=C2)F""",21,"""1698A60AE1903698"""
+"""455ADA20305D5F91_07DD57525E0D55B6_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=CC(=NC=C2)Cl""",21,"""1698A60AE1903698"""
+"""76EBF8BA70BCE694_1DC833E473FA6D3C_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(C)C=CC=C2""",21,"""1698A60AE1903698"""
+"""C16132F615D7EEAF_5D695EA3BB85F71D_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(SC=C2)C#N""",21,"""1698A60AE1903698"""
+"""D4F9583D9C85FA38_A8950151AAFFF4DA_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(C=NC=C2)F""",21,"""1698A60AE1903698"""
+"""25E1DE7905E11674_AA965AD6CC95B3DD_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(C)SC(=C2)C""",21,"""1698A60AE1903698"""
+"""8284F468454499D9_1D9D7DDE5F67ECE2_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(OC=C2)C#N""",21,"""1698A60AE1903698"""
+"""070D7207A3D30E4D_EEF085CE895FDAFD_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(N)C=NC=C2""",21,"""1698A60AE1903698"""
+"""44292F7AC66E8A1E_95308D65F8589CF2_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(N)N=CC=C2""",21,"""1698A60AE1903698"""
+"""848F8C70131460F9_9958330C41BD7969_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(C=CO2)C#N""",21,"""1698A60AE1903698"""
+"""AAA4C7D2FE6FE84A_B570633937FCC7E9_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(C)C=NC=C2""",21,"""1698A60AE1903698"""
+"""17E3DE7C3587AB0C_5CD14417E6F68EE7_6004_DP""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=CC=C(CN)O2""",21,"""1698A60AE1903698"""
+"""734F2E96E4960ED9_5F1EFB31AF06FF21_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=C(SC(=C2)Cl)Cl""",21,"""1698A60AE1903698"""
+"""EF4360B9BBB3A418_8A6F45D44FB582AC_6004_DP""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=CC=C(CN)S2""",21,"""1698A60AE1903698"""
+"""323F98B002FB58FA_E30E309A53AAB491_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=N[N](C=C2C)C""",21,"""1698A60AE1903698"""
+"""46DCA22B3255AC36_0AB863706D23816F_6004_DP""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=CC=C(O)C=C2""",21,"""1698A60AE1903698"""
+"""FBB6F1927B8D9AA4_1C54C25A22764D2F_6004_UN""","""N[S](=O)(=O)C1=C(C(=CC=C1)C(F)(F)F)C2=CC=C(C#N)O2""",21,"""1698A60AE1903698"""
+"""DC17188B4D10D07C_1B550103EC07527E_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC(C)=C""",21,"""17347323CBFD44FD"""
+"""5C8B581B0447CE42_074B71E0338982DF_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC(F)F""",21,"""17347323CBFD44FD"""
+"""033C691ECEEA8900_BFAE9D616704B984_6031_DP""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCNC""",21,"""17347323CBFD44FD"""
+"""A28F860B9DB0D9F9_BB8E5013858BE2EA_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)C[C@H](C)N""",21,"""17347323CBFD44FD"""
+"""60F37F8D7DF4731D_67DA2185916B8A29_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC(C)S""",21,"""17347323CBFD44FD"""
+"""5E9EFC65A29523FF_1AF8D5BDC5AA8F24_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCSC""",21,"""17347323CBFD44FD"""
+"""B99B427FE6EE8833_5920DF6815CE7653_6031_DP""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC(C)N""",21,"""17347323CBFD44FD"""
+"""9F0FA4E8F19DCFDA_0D9FF0E26232E3D2_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC#CC""",21,"""17347323CBFD44FD"""
+"""2949409925456E35_98EEC74C1826500D_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCON""",21,"""17347323CBFD44FD"""
+"""7D5AD226A9A62F06_9F9555ACFCCFEB0D_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC(=C)Br""",21,"""17347323CBFD44FD"""
+"""973D422707B7A0E8_B5A73525908E1E14_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)C[C@@H](C)N""",21,"""17347323CBFD44FD"""
+"""5CE2281813FEF257_84FC09D551358996_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)C[CH]=[C]=[CH2]""",21,"""17347323CBFD44FD"""
+"""802497824B276939_73241DF99B211DDB_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC#CBr""",21,"""17347323CBFD44FD"""
+"""1B7A638DD31579DA_FD6024CC4FB98555_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC(C)Cl""",21,"""17347323CBFD44FD"""
+"""D1F2E33F01B6A5C2_EDD94B4EF89F8AE8_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCCF""",21,"""17347323CBFD44FD"""
+"""B32047D8DFD87683_691A52F7099D6972_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC(N)=S""",21,"""17347323CBFD44FD"""
+"""60D955E2F9C4F88D_68828F117355B755_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCCS""",21,"""17347323CBFD44FD"""
+"""50B523CA411AC17B_1773AF43A99EB73B_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCCC""",21,"""17347323CBFD44FD"""
+"""71837B85C7412F15_951166B56BC823CF_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCCN""",21,"""17347323CBFD44FD"""
+"""F8EDF0E3443E3915_3510E1579E78E27C_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCCBr""",21,"""17347323CBFD44FD"""
+"""1DE8AF4AE1DB28DE_70CCD5E03BDE4E5C_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC(C)C""",21,"""17347323CBFD44FD"""
+"""CA41BDF74E6AA2CD_42860B21304DD6EB_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC3CC3""",21,"""17347323CBFD44FD"""
+"""6927F05879ADD545_1C09B7EF4B5105EC_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCC=C""",21,"""17347323CBFD44FD"""
+"""99D22D178485250F_DD011DB48D430580_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCC#C""",21,"""17347323CBFD44FD"""
+"""00B502E092CCF727_C76B6E684D461F4F_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCCCl""",21,"""17347323CBFD44FD"""
+"""C52266EC606A22D5_6991E0FD0E2139E0_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCC#N""",21,"""17347323CBFD44FD"""
+"""9530062CCFE51A74_16E7BDA6778A31C8_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC(F)Br""",21,"""17347323CBFD44FD"""
+"""D84C525685910DEA_A1013DFF6256F9FA_6031_DP""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CCNN""",21,"""17347323CBFD44FD"""
+"""EA93F97F98904CBF_5E72A378F901D6F1_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC(=C)F""",21,"""17347323CBFD44FD"""
+"""06E18483E8FD379A_5ABAE7651BE82254_6031_UN""","""O(C(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(F)F)CC=CBr""",21,"""17347323CBFD44FD"""
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+"""A52A815380CBAC0C_732C15A38AA06158_6031_UN""","""O(C(=O)C1=CC=C(C=C1)N2CC3CCC(C2)O3)CC(Cl)Cl""",21,"""1B0F600947BE8AE7"""
+"""064538D441F721DE_24D025B1CD4B5521_6031_UN""","""O(C(=O)C1=CC=C(C=C1)N2CC3CCC(C2)O3)CC(=C)Cl""",21,"""1B0F600947BE8AE7"""
+"""28787CF3A20C022D_433F9EA9928AE899_6031_UN""","""O(C(=O)C1=CC=C(C=C1)N2CC3CCC(C2)O3)CC(C)F""",21,"""1B0F600947BE8AE7"""
+"""101406F44D7ABFB5_FD7397B4E46F797E_6031_UN""","""O(C(=O)C1=CC=C(C=C1)N2CC3CCC(C2)O3)CC=CCl""",21,"""1B0F600947BE8AE7"""
+"""BB0FBF0C22310C3D_63FBC2F6DE2C6AC5_6031_UN""","""O(C(=O)C1=CC=C(C=C1)N2CC3CCC(C2)O3)CC(C)Br""",21,"""1B0F600947BE8AE7"""
+"""D0510DB0433ECEA2_B65BA4E2F332FD87_6031_UN""","""O(C(=O)C1=CC=C(C=C1)N2CC3CCC(C2)O3)CCCI""",21,"""1B0F600947BE8AE7"""
+"""0DCDD963383B9BD1_10264B5FF3794EC6_6031_UN""","""CCCC(C(=O)OCC(C)=C)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
+"""2BD49A3FDF149046_0C383BBC2CF79E67_6031_UN""","""CCCC(C(=O)OCC(F)F)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
+"""C36D92F2B1518D31_B4DDD73D787AA53C_6031_DP""","""CCCC(C(=O)OCCNC)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
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+"""C3D52A286ED4C91D_94E61FF0E3B1F7B5_6031_UN""","""CCCC(C(=O)OCC(=C)Br)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
+"""FEAFDE3570BA2877_BED47F798FF002AC_6031_UN""","""CCCC(C(=O)OC[C@@H](C)N)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
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+"""F6FDF2F2C493B631_177AFDB3542F1954_6031_UN""","""CCCC(C(=O)OCCC=C)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
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+"""E29014737835C825_51C9AD3904963EEC_6031_UN""","""CCCC(C(=O)OCC=CBr)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
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+"""5FD4784401F31B83_7912F8884E1C7E6A_6031_UN""","""CCCC(C(=O)OC[C@@H]1CO1)N3SC2=C(C=CC=C2)C3=O""",21,"""1C47397FD4835845"""
+"""A26DA854F52404F8_9E1DA901C0D8354D_6031_UN""","""CCCC(C(=O)OC[C@H]1CO1)N3SC2=C(C=CC=C2)C3=O""",21,"""1C47397FD4835845"""
+"""E8D077D8FD0B22AA_70242A0981736629_6031_UN""","""CCCC(C(=O)OCC1CO1)N3SC2=C(C=CC=C2)C3=O""",21,"""1C47397FD4835845"""
+"""6B183A62CF8698B7_74644CD5199DB3FA_6031_UN""","""CCCC(C(=O)OCC(Cl)Cl)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
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+"""C3A0837E4CE64540_4477C7DF01B73A3B_6031_UN""","""CCCC(C(=O)OCC(C)F)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
+"""4F0835F6698EC734_FA3BCEC27752ABDC_6031_UN""","""CCCC(C(=O)OCC=CCl)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
+"""B727E5B7F0EF70EC_64B39B804D11B867_6031_UN""","""CCCC(C(=O)OCC(C)Br)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
+"""01FC39FA2D6DAD95_B113FD94600F2F25_6031_UN""","""CCCC(C(=O)OCCCI)N2SC1=C(C=CC=C1)C2=O""",21,"""1C47397FD4835845"""
+"""53398E147FF448C0_C3FABE1E2A4A0B0B_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC=CC(=C4)C""",21,"""1D21A0A76BB822FE"""
+"""CD6F58BE1D64C2A8_E226C5D4E103B598_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC=C(C)C=C4""",21,"""1D21A0A76BB822FE"""
+"""6D320A7391A15EE8_5B8903A26C7CE9C2_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC(=CC=C4)F""",21,"""1D21A0A76BB822FE"""
+"""67FB05F576124654_C199DA400618D709_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC(=CN=C4)F""",21,"""1D21A0A76BB822FE"""
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+"""2148E3F5CB84CEF2_0506B409B9ED40BF_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC=C(C#N)S4""",21,"""1D21A0A76BB822FE"""
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+"""35913319D561A8EC_2C927AC1C41242E9_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC(=CC=C4)O""",21,"""1D21A0A76BB822FE"""
+"""9E11839BDB33BE0A_D31A2945BDD2C497_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(N=CC=C4)F""",21,"""1D21A0A76BB822FE"""
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+"""C45B433913D666BE_68423E6BC213F4F6_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC=CC(=C4)N""",21,"""1D21A0A76BB822FE"""
+"""7E01C24BCAB13643_1297CA71CE85FCE7_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CN=C(N)C=C4""",21,"""1D21A0A76BB822FE"""
+"""8C0019B5DFDCE220_C5749460E33388EF_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(ON=C4C)C""",21,"""1D21A0A76BB822FE"""
+"""1B85B75597FA02D6_9A1A1D4BDC75A865_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CSC(=C4)C#N""",21,"""1D21A0A76BB822FE"""
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+"""9A8B662D3E1AE967_63D3CAB717D34FF4_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC(=C(Cl)S4)Cl""",21,"""1D21A0A76BB822FE"""
+"""CE57F7308E035C2B_48143A3950056BF8_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC(=NS4)OC""",21,"""1D21A0A76BB822FE"""
+"""0ABFA537D6A6F745_3BE3E9C254C77FD2_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC(=CC=C4)Cl""",21,"""1D21A0A76BB822FE"""
+"""C123A3D24E9A1A20_BDEAB0D71AB5B369_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(C=CC=C4)O""",21,"""1D21A0A76BB822FE"""
+"""42134255806EA0A7_81E19BBF277D8CEF_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC=C(C=C4)Cl""",21,"""1D21A0A76BB822FE"""
+"""D2B13F3F8EDE0DF4_69F15610A28E5538_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(C=CC=N4)Cl""",21,"""1D21A0A76BB822FE"""
+"""E202A7A288D16CE3_DABD3B1976CEA59B_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC=C(C=C4)F""",21,"""1D21A0A76BB822FE"""
+"""52BD67BC6619FA3B_0C6451FFD42541D0_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC(=NC=C4)Cl""",21,"""1D21A0A76BB822FE"""
+"""DBF4325A4D4AA2B1_16713549F9D2795A_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(C)C=CC=C4""",21,"""1D21A0A76BB822FE"""
+"""A7A1135E45B5059E_56D0580E31ADE37B_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(SC=C4)C#N""",21,"""1D21A0A76BB822FE"""
+"""0D5E5CCEA0C753E5_A32C07FC20D7E0BC_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(C=NC=C4)F""",21,"""1D21A0A76BB822FE"""
+"""05E6C4B63958681B_A12F5C7B46BDA7BB_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(C)SC(=C4)C""",21,"""1D21A0A76BB822FE"""
+"""DDF9ECEB97505110_16247B73D54FF884_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(OC=C4)C#N""",21,"""1D21A0A76BB822FE"""
+"""01FD5F6C489BB026_E54983630377CE9B_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(N)C=NC=C4""",21,"""1D21A0A76BB822FE"""
+"""5760764E7C1C1253_9E898BC872708894_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(N)N=CC=C4""",21,"""1D21A0A76BB822FE"""
+"""6293D30610874706_92E135A1CB956D0F_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(C=CO4)C#N""",21,"""1D21A0A76BB822FE"""
+"""F8FFE5E7E27E2B9D_BEC96594BDD4D38F_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(C)C=NC=C4""",21,"""1D21A0A76BB822FE"""
+"""D8BA3786901DAA77_576842BA6CDE9A81_6004_DP""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC=C(CN)O4""",21,"""1D21A0A76BB822FE"""
+"""DA7D5238D80518A5_54A7FD9C252EEB47_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=C(SC(=C4)Cl)Cl""",21,"""1D21A0A76BB822FE"""
+"""33C690D26F142608_81D64379C59D96CA_6004_DP""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC=C(CN)S4""",21,"""1D21A0A76BB822FE"""
+"""DADD5BEF0BB7A396_E8B73637D982A0F7_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=N[N](C=C4C)C""",21,"""1D21A0A76BB822FE"""
+"""6D46C4E723F19DB1_010165DDE70B9509_6004_DP""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC=C(O)C=C4""",21,"""1D21A0A76BB822FE"""
+"""9B0BFCDF696429B6_17EDC4F7A85E5949_6004_UN""","""C1(=CC2=C(C=C1)C(=O)NC(=O)C23CC3)C4=CC=C(C#N)O4""",21,"""1D21A0A76BB822FE"""
+"""ECA64C7563D8D957_FE184B8A80D58502_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CC=CC(=C2)C""",21,"""20C35533C127ACF7"""
+"""31D8EB46779BF92A_DFC430404B9C3B91_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CC=C(C)C=C2""",21,"""20C35533C127ACF7"""
+"""6F156A9E9A334574_666BF636C6E367CB_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CC(=CC=C2)F""",21,"""20C35533C127ACF7"""
+"""E90DDD80F8752530_FC7B2FD4AC875900_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CC(=CN=C2)F""",21,"""20C35533C127ACF7"""
+"""29FF74C0E4CB4B4E_8B399DAEB68C1165_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=C(N)C=CN=C2""",21,"""20C35533C127ACF7"""
+"""3D513FBDA1626DF7_9F99318120B85A0A_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CN=C(C=C2)F""",21,"""20C35533C127ACF7"""
+"""419D5D7D85C79B7F_82092112E8FA89E3_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=C(C=CC=C2)Cl""",21,"""20C35533C127ACF7"""
+"""13CF93F68DD243BC_38E4419D1372CEB6_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CC=C(C#N)S2""",21,"""20C35533C127ACF7"""
+"""862A45BDBB8E2A8F_FF072DB84AB2227F_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=C(N=CC=C2)Cl""",21,"""20C35533C127ACF7"""
+"""E1DD4CA82B73B14D_11708F556E8DCCE0_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CC(=CC=C2)O""",21,"""20C35533C127ACF7"""
+"""29E4F2B7BC4FB4F5_EEF8DCD1174D4A9E_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=C(N=CC=C2)F""",21,"""20C35533C127ACF7"""
+"""DE4BAAFF9DDF5436_64A2C561BFACFC9A_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CC=C(C=C2)O""",21,"""20C35533C127ACF7"""
+"""ADE20DF67DABB9DF_7E1D255356B807C2_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CN=C(C=C2)Cl""",21,"""20C35533C127ACF7"""
+"""8ECD7456EDDAD11E_55A0CBFF688C7AFF_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CC=CC(=C2)N""",21,"""20C35533C127ACF7"""
+"""CCE33F46D0FDCA10_2F753FE5641A72EE_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CN=C(N)C=C2""",21,"""20C35533C127ACF7"""
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+"""12FFD8DB3C316F19_A7F8E8DF76EA266C_6004_UN""","""CN(C)CCNC(=O)C1=CN=C(C=C1)C2=CSC(=C2)C#N""",21,"""20C35533C127ACF7"""
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+"""75248504B60283BC_537FCE90FF8BA99E_6031_UN""","""CC(C)(C(=O)OCC(C)S)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
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+"""805B769459586C24_5C2760041DB594E2_6031_UN""","""CC(C)(C(=O)OCCCS)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""E013161676A5374D_23D64056C77E948C_6031_UN""","""CC(C)(C(=O)OCCCC)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""5177E199E40A6DD4_A1B489A005280078_6031_UN""","""CC(C)(C(=O)OCCCN)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""66538BADC460C922_01B50E42F098C1CB_6031_UN""","""CC(C)(C(=O)OCCCBr)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""C8374448EDE44AF8_44693AF5553E6DEB_6031_UN""","""CC(C)(C(=O)OCC(C)C)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""346BCEB0D0340E1D_7623E4345EADF55C_6031_UN""","""CC(C)(C(=O)OCC1CC1)[N]2C=C(N=N2)C3=CN=CC=C3""",21,"""23919C36A51D674A"""
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+"""3F4C6A85BB323673_E9A4F2A1E3A32637_6031_UN""","""CC(C)(C(=O)OCCC#C)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""B901876475EB2CDC_F3CE817D23A63CF8_6031_UN""","""CC(C)(C(=O)OCCCCl)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""CBA091A3DA38290E_5D340FE860C11A57_6031_UN""","""CC(C)(C(=O)OCCC#N)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""FB1D58A768A78758_224252B3196A127F_6031_UN""","""CC(C)(C(=O)OCC(F)Br)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""E52A2BAE04E73562_95A4D2EA0CB6DA4D_6031_DP""","""CC(C)(C(=O)OCCNN)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""1FB5DC2552EDEEC9_6AD74C6D97E1F546_6031_UN""","""CC(C)(C(=O)OCC(=C)F)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
+"""017B06B31D08F088_6E1F0870750801E3_6031_UN""","""CC(C)(C(=O)OCC=CBr)[N]1C=C(N=N1)C2=CN=CC=C2""",21,"""23919C36A51D674A"""
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+"""3BA18676A6DC72E3_0406024DD93FDCD6_6031_UN""","""O(C(=O)CSC1=NC=C[N]1C2=CC(=CC=C2)Cl)CCCBr""",21,"""262290398CBA7A57"""
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+"""E5391CBFF11497E8_9017DEE52511C750_6031_DP""","""O(C(=O)CSC1=NC=C[N]1C2=CC(=CC=C2)Cl)CCNN""",21,"""262290398CBA7A57"""
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+"""E58CFDE5B470CFEE_6BAC047F5CAF1CFE_6031_UN""","""O(C(=O)CSC1=NC=C[N]1C2=CC(=CC=C2)Cl)CC=CBr""",21,"""262290398CBA7A57"""
+"""CA3FEF0280549E24_F968A9762AED63EB_6031_DP""","""O(C(=O)CSC1=NC=C[N]1C2=CC(=CC=C2)Cl)CCCO""",21,"""262290398CBA7A57"""
+"""649E194E4BBFA26A_1773C66E973042CC_6031_UN""","""O(C(=O)CSC1=NC=C[N]1C2=CC(=CC=C2)Cl)CCOC""",21,"""262290398CBA7A57"""
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+"""BB6EF6B9155E23FD_562FE38CC26683A3_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCCC#N""",21,"""288A705207BAFEBE"""
+"""E0274CAC1BEE493E_2959BED7BBCD8B8B_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCC(F)Br""",21,"""288A705207BAFEBE"""
+"""F3FB6A008A6DE16B_9EBF3E8EAE1143B9_6031_DP""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCCNN""",21,"""288A705207BAFEBE"""
+"""A5443D94BF131F32_61CCA00935466CB2_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCC(=C)F""",21,"""288A705207BAFEBE"""
+"""A57940F5F5F0E2EC_6504E414D7AF9817_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCC=CBr""",21,"""288A705207BAFEBE"""
+"""25887DCBD956BC4D_F7C0491DA1EDE702_6031_DP""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCCCO""",21,"""288A705207BAFEBE"""
+"""7046A6959E658346_19DB26051C30C625_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCCOC""",21,"""288A705207BAFEBE"""
+"""DD56DD2188DCBD38_4DDFB1A59D25D891_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OC[C@@H]3CO3""",21,"""288A705207BAFEBE"""
+"""CE0AD91C3C4919D2_AAD0E02C13E193B6_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OC[C@H]3CO3""",21,"""288A705207BAFEBE"""
+"""7EA574F741E776BC_44E96324524AC0D2_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCC3CO3""",21,"""288A705207BAFEBE"""
+"""3B75EBC89B8173F0_40A905F8CAA41501_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCC(Cl)Cl""",21,"""288A705207BAFEBE"""
+"""68C2B03559A10942_175535EA8D4F2178_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCC(=C)Cl""",21,"""288A705207BAFEBE"""
+"""1242294DC9CA0844_70BA8EF2D28E9CC0_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCC(C)F""",21,"""288A705207BAFEBE"""
+"""FC1B4190D3FB4105_CEF687EFA46B0D27_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCC=CCl""",21,"""288A705207BAFEBE"""
+"""DCEF89284C4041A8_507ED2AD9E281E9C_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCC(C)Br""",21,"""288A705207BAFEBE"""
+"""204643604DC11C0C_85DEB4B9B33689DE_6031_UN""","""CC1(CCN(CC1)CC2=CC=CC=C2)C(=O)OCCCI""",21,"""288A705207BAFEBE"""
+"""02F181B27190C604_24BA8C01BEA5B367_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(C)=C)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""4D164381F299747C_38A4FCE2612B63C6_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(F)F)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""AB5A5EB1071BB0DE_8041106335A6589D_6031_DP""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCNC)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""39D4631F3BA7286D_8461DD11D72903F3_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OC[C@H](C)N)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""FAFC4115DDA1C910_5835AC87C3C96B30_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(C)S)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""320A3A235DBCF6FB_251758BF97086E3D_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCSC)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""1ED3B0E67E468311_66CF526A476C974A_6031_DP""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(C)N)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""73C0EB364EBDDBAA_32707DE0309002CB_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC#CC)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""7622A33564ACF828_A7014A4E4A84B114_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCON)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""1AE70F9572F0B122_A07AD8AEAE6D0A14_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(=C)Br)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""939E329674D8EFF5_8A48B827C22CFF0D_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OC[C@@H](C)N)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""AD92CEF92EB7236B_BB1384D70397688F_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OC[CH]=[C]=[CH2])C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""2DB2F4E5A2FD9574_4CCB90FBC983FCC2_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC#CBr)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""08869BA682750677_C28FA9CE1D1B644C_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(C)Cl)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""6F1826DE977112C6_D236C64CAA3D6BF1_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCCF)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""E7C920143A392E1D_56F5DFF55B3F886B_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(N)=S)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""B8DCA4960757F423_576D021321F7564C_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCCS)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""817A77BEAE2E8CC0_289C2241FB3C5622_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCCC)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""FC1F395A1A61FC1F_AAFEEBB7396AC2D6_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCCN)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""344D01C1C3015876_0AFF6C55CCDA0365_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCCBr)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""419AA3EAB1AD371C_4F2358E2697CAF45_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(C)C)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""D80757FEC9AEF24C_7D69862362EF37F2_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC3CC3)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""7B3F2F4C7504F45E_23E63AED19F3E4F5_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCC=C)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""64389E9838524F08_E2EE90B6DFE1E499_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCC#C)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""F2995AD3468FCA77_F884E36A1FE4FE56_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCCCl)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""B8E3E66FC0DB01C2_567E6DFF5C83D8F9_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCC#N)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""77A5D50C0D3E8EFE_290830A42528D0D1_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(F)Br)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""3A1F7BF86725DED2_9EEEB0FD30F418E3_6031_DP""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCNN)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""118920D33DA30A82_619D2E7AABA337E8_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(=C)F)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""32767659E3FFF861_65556A67494AC34D_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC=CBr)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""F5CB8C45127D721C_F791C76E3F08BC58_6031_DP""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCCO)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""73864EAF20304D31_198AA87682D59D7F_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCOC)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""C8CCA1809D742A13_4D8E3FD603C083CB_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OC[C@@H]3CO3)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""4C3AA90C425053C7_AA816E5F8D04C8EC_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OC[C@H]3CO3)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""A584AA94BD761BD9_44B8ED57CCAF9B88_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC3CO3)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""D81F0ECFF43A77A0_40F88B8B54414E5B_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(Cl)Cl)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""35CACEBF20ECF45E_1704BB9913AA7A22_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(=C)Cl)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""700F59DB79426EC1_70EB00814C6BC79A_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(C)F)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""A466D5A96570E261_CEA7099C3A8E567D_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC=CCl)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""5628E71CFA825857_502F5CDE00CD45C6_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCC(C)Br)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""77322639D16F7C83_858F3ACA2DD3D284_6031_UN""","""C[N]1N=C(C2=C1N=CC(=C2)C(=O)OCCCI)C(F)(F)F""",21,"""28DBFE21995FA5E4"""
+"""C2AF39E7FCAC454F_267E5656E5F7BC32_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC(C)=C""",21,"""2A1F2476C20DAAB1"""
+"""DD8E8D9C5416FCD1_3A6026B53A796C93_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC(F)F""",21,"""2A1F2476C20DAAB1"""
+"""8ACA0BFC8B52BC5A_8285CA346EF457C8_6031_DP""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCNC""",21,"""2A1F2476C20DAAB1"""
+"""953537B48C4BDCDA_86A507468C7B0CA6_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)C[C@H](C)N""",21,"""2A1F2476C20DAAB1"""
+"""6A5110A284E5B50C_5AF176D0989B6465_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC(C)S""",21,"""2A1F2476C20DAAB1"""
+"""18BD41874E3315FE_27D382E8CC5A6168_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCSC""",21,"""2A1F2476C20DAAB1"""
+"""8C06101EE16B3C8F_640B883D1C3E981F_6031_DP""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC(C)N""",21,"""2A1F2476C20DAAB1"""
+"""3B08F44A8BF160C6_30B4A7B76BC20D9E_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC#CC""",21,"""2A1F2476C20DAAB1"""
+"""0BBD21DD41A17F75_A5C5901911D6BE41_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCON""",21,"""2A1F2476C20DAAB1"""
+"""14FC77EC2A9E7BBF_A2BE02F9F53F0541_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC(=C)Br""",21,"""2A1F2476C20DAAB1"""
+"""725F21AF0597D1A1_888C6270997EF058_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)C[C@@H](C)N""",21,"""2A1F2476C20DAAB1"""
+"""DDC166936784A666_B9D75E8058C567DA_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)C[CH]=[C]=[CH2]""",21,"""2A1F2476C20DAAB1"""
+"""AB171E203E9A9B6F_4E0F4AAC92D1F397_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC#CBr""",21,"""2A1F2476C20DAAB1"""
+"""AE46978DAC90B97C_C04B739946496B19_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC(C)Cl""",21,"""2A1F2476C20DAAB1"""
+"""6D9B2DB16ABC584F_D0F21C1BF16F64A4_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCCF""",21,"""2A1F2476C20DAAB1"""
+"""E07DDE62FE2A5C62_543105A2006D873E_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC(N)=S""",21,"""2A1F2476C20DAAB1"""
+"""ACB99689D49F7398_55A9D8447AA55919_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCCS""",21,"""2A1F2476C20DAAB1"""
+"""2899346352147F8F_2A58F816A06E5977_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCCC""",21,"""2A1F2476C20DAAB1"""
+"""B75D3FA176730663_A83A31E06238CD83_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCCN""",21,"""2A1F2476C20DAAB1"""
+"""C287403C11B55D1C_083BB60297880C30_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCCBr""",21,"""2A1F2476C20DAAB1"""
+"""D58EAD2ADDAC8CF8_4DE782B5322EA010_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC(C)C""",21,"""2A1F2476C20DAAB1"""
+"""DFE99DF679F5D1BE_7FAD5C7439BD38A7_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC3CC3""",21,"""2A1F2476C20DAAB1"""
+"""69C878DEEC50F306_2122E0BA42A1EBA0_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCC=C""",21,"""2A1F2476C20DAAB1"""
+"""E4AD72F08BFC449A_E02A4AE184B3EBCC_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCC#C""",21,"""2A1F2476C20DAAB1"""
+"""83794D01FD6F2F87_FA40393D44B6F103_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCCCl""",21,"""2A1F2476C20DAAB1"""
+"""5F123684C90A2B87_54BAB7A807D1D7AC_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCC#N""",21,"""2A1F2476C20DAAB1"""
+"""CA78EF50AE0B0444_2BCCEAF37E7ADF84_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC(F)Br""",21,"""2A1F2476C20DAAB1"""
+"""E8661407C59515C5_9C2A6AAA6BA617B6_6031_DP""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCNN""",21,"""2A1F2476C20DAAB1"""
+"""79B07B09B1D9D4B1_6359F42DF0F138BD_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC(=C)F""",21,"""2A1F2476C20DAAB1"""
+"""6D4D7D5F41877162_6791B0301218CC18_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CC=CBr""",21,"""2A1F2476C20DAAB1"""
+"""158E48BB468E9488_F5551D39645AB30D_6031_DP""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCCO""",21,"""2A1F2476C20DAAB1"""
+"""EFC328AFC2002197_1B4E7221D987922A_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)CCOC""",21,"""2A1F2476C20DAAB1"""
+"""8F62B7E42A677D7D_4F4AE58158928C9E_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)C[C@@H]3CO3""",21,"""2A1F2476C20DAAB1"""
+"""8506AD2130330025_A845B408D656C7B9_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=NC(=C2)C(F)(F)F)C[C@H]3CO3""",21,"""2A1F2476C20DAAB1"""
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+"""8368FC3E1F776AD9_359329FE53C8345D_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC=C(C#N)S2)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""DB0A006CF57EE85A_F27045DB0A08D894_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(N=CC=C2)Cl)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""F8354D1E9E0A666B_1C07E7362E37360B_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC(=CC=C2)O)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""1884E92A824AE5D1_E38FB4B257F7B075_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(N=CC=C2)F)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""9CA6F38E0628890D_69D5AD02FF160671_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC=C(C=C2)O)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""9ED46B5D72B82411_736A4D301602FD29_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CN=C(C=C2)Cl)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""5585C57EAF9E754B_58D7A39C28368014_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC=CC(=C2)N)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""B2B1AED5A552F2A4_2202578624A08805_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CN=C(N)C=C2)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""832AFB2A2E48383A_F5E109970916FC0D_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(ON=C2C)C)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""804431CF39B92411_AA8F80BC3650DC87_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CSC(=C2)C#N)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""006A3EB3973A686A_778D9D9CF561F49F_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC=N[N]2CC)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""E4C2F79F96258D77_53465740FDF63B16_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC(=C(Cl)S2)Cl)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""7A644C4403CAB5FE_7881A7CEBA201F1A_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC(=NS2)OC)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""459BC3FEF527BA92_0B767435BEE20B30_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC(=CC=C2)Cl)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""E90E5E9B5963A3A8_8D7F2D20F090C78B_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(C=CC=C2)O)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""986241296B2D55CE_B1740648CD58F80D_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC=C(C=C2)Cl)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""A60CB5D41E8B6911_5964CBE748AB21DA_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(C=CC=N2)Cl)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""485C4A55D895BED7_EA28A6EE9CEBD179_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC=C(C=C2)F)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""43C34F1932576A81_3CF1CC083E003532_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC(=NC=C2)Cl)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""15095E6526889B06_26E4A8BE13F70DB8_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(C)C=CC=C2)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""9EFC651F6BF0F00B_6645C5F9DB889799_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(SC=C2)C#N)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""978024C656019201_93B99A0BCAF2945E_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(C=NC=C2)F)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""A9A5C0C2CE6AE726_91BAC18CAC98D359_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(C)SC(=C2)C)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""2CEEB745FAFA21B9_26B1E6843F6A8C66_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(OC=C2)C#N)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""8E94F94E73671CBB_D5DC1E94E952BA79_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(N)C=NC=C2)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""0DE455749845D019_AE1C163F9855FC76_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(N)N=CC=C2)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""73DCE43F7D29492B_A274A85621B019ED_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(C=CO2)C#N)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""D503798EB7FA4EF5_8E5CF86357F1A76D_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(C)C=NC=C2)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""96C22EB63DE22805_67FDDF4D86FBEE63_6004_DP""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC=C(CN)O2)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""5738BF3E78A8825B_6432606BCF0B9FA5_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=C(SC(=C2)Cl)Cl)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""451DDC0F17E7F848_B143DE8E2FB8E228_6004_DP""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC=C(CN)S2)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""42C172D2FE7EA4BE_D822ABC033A7D415_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=N[N](C=C2C)C)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""9CA6F38E0628890D_3194F82A0D2EE1EB_6004_DP""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC=C(O)C=C2)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""AE3B1C299708653B_27785900427B2DAB_6004_UN""","""NC1=C(C=C(C(=C1)CC(=O)O)C2=CC=C(C#N)O2)[N](=O)=O""",21,"""2DB43D50819D561C"""
+"""F6A12EAFF93071FC_223175FF442A1A27_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(C)=C""",21,"""2E5007DF63D00CA4"""
+"""BBE35E1788BD8304_3E2F051C9BA4CA86_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(F)F""",21,"""2E5007DF63D00CA4"""
+"""C4DEE04E34B86849_86CAE99DCF29F1DD_6031_DP""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCNC""",21,"""2E5007DF63D00CA4"""
+"""B3141A3BE63EAEBA_82EA24EF2DA6AAB3_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OC[C@H](C)N""",21,"""2E5007DF63D00CA4"""
+"""8A6143E454501372_5EBE55793946C270_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(C)S""",21,"""2E5007DF63D00CA4"""
+"""C5E04E3D989ADC6A_239CA1416D87C77D_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCSC""",21,"""2E5007DF63D00CA4"""
+"""330F3036D09842A1_6044AB94BDE33E0A_6031_DP""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(C)N""",21,"""2E5007DF63D00CA4"""
+"""9314A904C5AA64B8_34FB841ECA1FAB8B_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC#CC""",21,"""2E5007DF63D00CA4"""
+"""93D8817DBE17821E_A18AB3B0B00B1854_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCON""",21,"""2E5007DF63D00CA4"""
+"""B2DD055305A2AE4A_A6F1215054E2A354_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(=C)Br""",21,"""2E5007DF63D00CA4"""
+"""D7E96EB1BAD2039E_8CC341D938A3564D_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OC[C@@H](C)N""",21,"""2E5007DF63D00CA4"""
+"""A34D4579E5AAEBF2_BD987D29F918C1CF_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OC[CH]=[C]=[CH2]""",21,"""2E5007DF63D00CA4"""
+"""115F8543A785BD66_4A406905330C5582_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC#CBr""",21,"""2E5007DF63D00CA4"""
+"""463D25EC85DE4EF6_C4045030E794CD0C_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(C)Cl""",21,"""2E5007DF63D00CA4"""
+"""BACDE2FFC46D56C1_D4BD3FB250B2C2B1_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCCF""",21,"""2E5007DF63D00CA4"""
+"""400AAAC53B248550_507E260BA1B0212B_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(N)=S""",21,"""2E5007DF63D00CA4"""
+"""CE28B821BC7ED83E_51E6FBEDDB78FF0C_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCCS""",21,"""2E5007DF63D00CA4"""
+"""5C0C947633F064E0_2E17DBBF01B3FF62_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCCC""",21,"""2E5007DF63D00CA4"""
+"""6124274CC3BA790A_AC751249C3E56B96_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCCN""",21,"""2E5007DF63D00CA4"""
+"""A72A2C22893EE84F_0C7495AB3655AA25_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCCBr""",21,"""2E5007DF63D00CA4"""
+"""3360EAEDEF80FCDD_49A8A11C93F30605_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(C)C""",21,"""2E5007DF63D00CA4"""
+"""33C42E595FE93DA8_7BE27FDD98609EB2_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC3CC3""",21,"""2E5007DF63D00CA4"""
+"""9C03730BF9A4C977_256DC313E37C4DB5_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCC=C""",21,"""2E5007DF63D00CA4"""
+"""94171AF716748E17_E4656948256E4DD9_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCC#C""",21,"""2E5007DF63D00CA4"""
+"""0EA083E985BA87D6_FE0F1A94E56B5716_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCCCl""",21,"""2E5007DF63D00CA4"""
+"""E92A5ECE9956F28C_50F59401A60C71B9_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCC#N""",21,"""2E5007DF63D00CA4"""
+"""AF32734854CBBB28_2F83C95ADFA77991_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(F)Br""",21,"""2E5007DF63D00CA4"""
+"""6CA15A81760B52EE_98654903CA7BB1A3_6031_DP""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCNN""",21,"""2E5007DF63D00CA4"""
+"""D3BF4B5D6021DB89_6716D784512C9EA8_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(=C)F""",21,"""2E5007DF63D00CA4"""
+"""96AB991FA2525D47_63DE9399B3C56A0D_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC=CBr""",21,"""2E5007DF63D00CA4"""
+"""1322A3BD7C20366F_F11A3E90C5871518_6031_DP""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCCO""",21,"""2E5007DF63D00CA4"""
+"""83227E4DA4D1D18A_1F015188785A343F_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCOC""",21,"""2E5007DF63D00CA4"""
+"""1F0B772633BE2058_4B05C628F94F2A8B_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OC[C@@H]3CO3""",21,"""2E5007DF63D00CA4"""
+"""0DC1D74647A0FAB6_AC0A97A1778B61AC_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OC[C@H]3CO3""",21,"""2E5007DF63D00CA4"""
+"""C0C5377FD4EDE0E8_423314A9362032C8_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC3CO3""",21,"""2E5007DF63D00CA4"""
+"""88ABDE8613E9FF25_46737275AECEE71B_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(Cl)Cl""",21,"""2E5007DF63D00CA4"""
+"""7F344C06C911721E_118F4267E925D362_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(=C)Cl""",21,"""2E5007DF63D00CA4"""
+"""50FEC8F7BFA67B6A_7660F97FB6E46EDA_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(C)F""",21,"""2E5007DF63D00CA4"""
+"""6E1D4C6E5C43FF15_C82CF062C001FF3D_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC=CCl""",21,"""2E5007DF63D00CA4"""
+"""DDF39E1EB25CCBA4_56A4A520FA42EC86_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCC(C)Br""",21,"""2E5007DF63D00CA4"""
+"""7FB531B7D9989B56_8304C334D75C7BC4_6031_UN""","""CC1(CC(=NO1)C2=CC(=CC(=C2)Cl)Cl)C(=O)OCCCI""",21,"""2E5007DF63D00CA4"""
+"""530FAD28BD637774_22D46456BB49F211_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CC(C)=C""",21,"""2EB516769CB3E492"""
+"""89D2C0DD75CE0CAE_3ECA14B564C722B0_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CC(F)F""",21,"""2EB516769CB3E492"""
+"""00450434D5E6D354_862FF834304A19EB_6031_DP""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CCNC""",21,"""2EB516769CB3E492"""
+"""A048112373AF2DEF_820F3546D2C54285_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)C[C@H](C)N""",21,"""2EB516769CB3E492"""
+"""38A217E51A403924_5E5B44D0C6252A46_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CC(C)S""",21,"""2EB516769CB3E492"""
+"""C039E8FC3FF4756B_2379B0E892E42F4B_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CCSC""",21,"""2EB516769CB3E492"""
+"""C2C295AE618EB81E_60A1BA3D4280D63C_6031_DP""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CC(C)N""",21,"""2EB516769CB3E492"""
+"""97EC9E432A877AEF_341E95B7357C43BD_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CC#CC""",21,"""2EB516769CB3E492"""
+"""23904EF3F1F7343C_A16FA2194F68F062_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CCON""",21,"""2EB516769CB3E492"""
+"""F3D7187259DAF605_A61430F9AB814B62_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CC(=C)Br""",21,"""2EB516769CB3E492"""
+"""C89FA1C279084F95_8C265070C7C0BE7B_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)C[C@@H](C)N""",21,"""2EB516769CB3E492"""
+"""ACB6D24D803EFA60_BD7D6C80067B29F9_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)C[CH]=[C]=[CH2]""",21,"""2EB516769CB3E492"""
+"""F7207D61F89866E2_4AA578ACCC6FBDB4_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CC#CBr""",21,"""2EB516769CB3E492"""
+"""CF7DB265C8DE8FCF_C4E1419918F7253A_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CC(C)Cl""",21,"""2EB516769CB3E492"""
+"""3AE7C80D7FD5D26C_D4582E1BAFD12A87_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CCCF""",21,"""2EB516769CB3E492"""
+"""505136A7C58D43EC_509B37A25ED3C91D_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CC(N)=S""",21,"""2EB516769CB3E492"""
+"""32EF1FEE0E6AFDA3_5103EA44241B173A_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CCCS""",21,"""2EB516769CB3E492"""
+"""36C882BD6E14443C_2EF2CA16FED01754_6031_UN""","""O(C(=O)C2(CCCOCC1=CC=CC=C1)CC2)CCCC""",21,"""2EB516769CB3E492"""
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+"""D8FF7D9159CEC5FD_3142B3377A2D0A27_6031_UN""","""CC1=CC(=CC=C1)C(=O)N2CCC[C@@H]2C(=O)OCCCC""",21,"""31056F57184EF9E1"""
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+"""0EE78CFFA5A56CC9_1321FD234DCB5F60_6031_UN""","""CC1=CC(=CC=C1)C(=O)N2CCC[C@@H]2C(=O)OCCCBr""",21,"""31056F57184EF9E1"""
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+"""C78DEDAB3C569B96_FB3001C05EF0B89C_6031_UN""","""CC1=CC(=CC=C1)C(=O)N2CCC[C@@H]2C(=O)OCCC#C""",21,"""31056F57184EF9E1"""
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+"""3642B4ACED2154F2_4FA0FC89DD9284FC_6031_UN""","""CC1=CC(=CC=C1)C(=O)N2CCC[C@@H]2C(=O)OCCC#N""",21,"""31056F57184EF9E1"""
+"""C8FB975E47A9BF58_30D6A1D2A4398CD4_6031_UN""","""CC1=CC(=CC=C1)C(=O)N2CCC[C@@H]2C(=O)OCC(F)Br""",21,"""31056F57184EF9E1"""
+"""BC23CA8682CBCB11_8730218BB1E544E6_6031_DP""","""CC1=CC(=CC=C1)C(=O)N2CCC[C@@H]2C(=O)OCCNN""",21,"""31056F57184EF9E1"""
+"""77B162F992928C1B_7843BF0C2AB26BED_6031_UN""","""CC1=CC(=CC=C1)C(=O)N2CCC[C@@H]2C(=O)OCC(=C)F""",21,"""31056F57184EF9E1"""
+"""91D88C80A2213938_7C8BFB11C85B9F48_6031_UN""","""CC1=CC(=CC=C1)C(=O)N2CCC[C@@H]2C(=O)OCC=CBr""",21,"""31056F57184EF9E1"""
+"""648BC2E3F3FAB70A_EE4F5618BE19E05D_6031_DP""","""CC1=CC(=CC=C1)C(=O)N2CCC[C@@H]2C(=O)OCCCO""",21,"""31056F57184EF9E1"""
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+"""23CF093850F4FAA3_A0E74105C46AB6A5_6031_UN""","""CC2=NC1=CC(=N[N]1C(=C2)C(=O)OC[CH]=[C]=[CH2])C(F)(F)F""",21,"""332F3BF35EA27BCE"""
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+"""14B7D5F649591282_027E6DA445284355_6031_UN""","""CC2=NC1=CC(=N[N]1C(=C2)C(=O)OCCOC)C(F)(F)F""",21,"""332F3BF35EA27BCE"""
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+"""3F2DDE467E5F44B7_B175AB8D4AF916C6_6031_UN""","""CC2=NC1=CC(=N[N]1C(=C2)C(=O)OC[C@H]3CO3)C(F)(F)F""",21,"""332F3BF35EA27BCE"""
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+"""B621DCD6ADE721F9_6B1FC5538B9619B0_6031_UN""","""CC2=NC1=CC(=N[N]1C(=C2)C(=O)OCC(C)F)C(F)(F)F""",21,"""332F3BF35EA27BCE"""
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+"""92C1DE2992872D9A_43BCBE753395C91F_6031_UN""","""O(C(=O)CCNCC1=CC=C(C=C1)C(F)(F)F)CC(C)S""",21,"""3352ECD3690307CB"""
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+"""55F36F40158ED16C_BC8858BCBAD8133B_6031_UN""","""O(C(=O)CCNCC1=CC=C(C=C1)C(F)(F)F)CCON""",21,"""3352ECD3690307CB"""
+"""D9614600A44EEC08_BBF3CA5C5E31A83B_6031_UN""","""O(C(=O)CCNCC1=CC=C(C=C1)C(F)(F)F)CC(=C)Br""",21,"""3352ECD3690307CB"""
+"""CC3DAA96777B7225_91C1AAD532705D22_6031_UN""","""O(C(=O)CCNCC1=CC=C(C=C1)C(F)(F)F)C[C@@H](C)N""",21,"""3352ECD3690307CB"""
+"""8ACADD9948979565_A09A9625F3CBCAA0_6031_UN""","""O(C(=O)CCNCC1=CC=C(C=C1)C(F)(F)F)C[CH]=[C]=[CH2]""",21,"""3352ECD3690307CB"""
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+"""253BED814AB42009_76D613F883B987C6_6031_DP""","""CC2=N[N](CC1=CC=CC=C1)C(=C2C(=O)OCC(C)N)N""",21,"""38C2BFB35D8AB568"""
+"""178642BEB5348DBB_22693C72F4451247_6031_UN""","""CC2=N[N](CC1=CC=CC=C1)C(=C2C(=O)OCC#CC)N""",21,"""38C2BFB35D8AB568"""
+"""CBA63B7770CE2AF4_B7180BDC8E51A198_6031_UN""","""CC2=N[N](CC1=CC=CC=C1)C(=C2C(=O)OCCON)N""",21,"""38C2BFB35D8AB568"""
+"""7D2624414EA805FA_B063993C6AB81A98_6031_UN""","""CC2=N[N](CC1=CC=CC=C1)C(=C2C(=O)OCC(=C)Br)N""",21,"""38C2BFB35D8AB568"""
+"""5798A8132B6F8ABA_9A51F9B506F9EF81_6031_UN""","""CC2=N[N](CC1=CC=CC=C1)C(=C2C(=O)OC[C@@H](C)N)N""",21,"""38C2BFB35D8AB568"""
+"""69F4BFA5C34E28B6_AB0AC545C7427803_6031_UN""","""CC2=N[N](CC1=CC=CC=C1)C(=C2C(=O)OC[CH]=[C]=[CH2])N""",21,"""38C2BFB35D8AB568"""
+"""F7EC6F8D509C8B9B_5CD2D1690D56EC4E_6031_UN""","""CC2=N[N](CC1=CC=CC=C1)C(=C2C(=O)OCC#CBr)N""",21,"""38C2BFB35D8AB568"""
+"""3816DAA31A03D27B_D296E85CD9CE74C0_6031_UN""","""CC2=N[N](CC1=CC=CC=C1)C(=C2C(=O)OCC(C)Cl)N""",21,"""38C2BFB35D8AB568"""
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+"""3EFBA14B29DB4B95_590C8C61BD878240_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)OC(=N2)CC(F)(F)F)C[C@@H]3CO3""",21,"""3C594D962718A46F"""
+"""6C52069C15FAEA6E_BE03DDE83343C967_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)OC(=N2)CC(F)(F)F)C[C@H]3CO3""",21,"""3C594D962718A46F"""
+"""A73F3C12E257285F_503A5EE072E89A03_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)OC(=N2)CC(F)(F)F)CC3CO3""",21,"""3C594D962718A46F"""
+"""FFE0CAEDA5F9B2A8_547A383CEA064FD0_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)OC(=N2)CC(F)(F)F)CC(Cl)Cl""",21,"""3C594D962718A46F"""
+"""C22511383542C658_0386082EADED7BA9_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)OC(=N2)CC(F)(F)F)CC(=C)Cl""",21,"""3C594D962718A46F"""
+"""B0DD8ACA27FECFFE_6469B336F22CC611_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)OC(=N2)CC(F)(F)F)CC(C)F""",21,"""3C594D962718A46F"""
+"""A4D1F6E3EF85A04B_DA25BA2B84C957F6_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)OC(=N2)CC(F)(F)F)CC=CCl""",21,"""3C594D962718A46F"""
+"""FE395B2C935234BC_44ADEF69BE8A444D_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)OC(=N2)CC(F)(F)F)CC(C)Br""",21,"""3C594D962718A46F"""
+"""FD875916AB39DD2D_910D897D9394D30F_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)OC(=N2)CC(F)(F)F)CCCI""",21,"""3C594D962718A46F"""
+"""7D3A7A181C366B55_31B7CA720C2D452E_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(C)=C)OC""",21,"""3DD6B8522BD753AD"""
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+"""412FB622280FF13D_954C5610872EAED4_6031_DP""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCNC)OC""",21,"""3DD6B8522BD753AD"""
+"""943B4DB8FDB72A42_916C9B6265A1F5BA_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OC[C@H](C)N)OC""",21,"""3DD6B8522BD753AD"""
+"""416D1D111CB9D6EB_4D38EAF471419D79_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(C)S)OC""",21,"""3DD6B8522BD753AD"""
+"""C0260C701E0873EF_301A1ECC25809874_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCSC)OC""",21,"""3DD6B8522BD753AD"""
+"""FBBF2F24CF80E063_73C21419F5E46103_6031_DP""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(C)N)OC""",21,"""3DD6B8522BD753AD"""
+"""4814C56BE4C39C6B_277D3B938218F482_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC#CC)OC""",21,"""3DD6B8522BD753AD"""
+"""C5D0A6D5A7D2CB8B_B20C0C3DF80C475D_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCON)OC""",21,"""3DD6B8522BD753AD"""
+"""78845F24A6AD3262_B5779EDD1CE5FC5D_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(=C)Br)OC""",21,"""3DD6B8522BD753AD"""
+"""FBA4B8A4A33E2773_9F45FE5470A40944_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OC[C@@H](C)N)OC""",21,"""3DD6B8522BD753AD"""
+"""761BAEBCBD22AF7F_AE1EC2A4B11F9EC6_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OC[CH]=[C]=[CH2])OC""",21,"""3DD6B8522BD753AD"""
+"""8C6B4C258DBFCDC0_59C6D6887B0B0A8B_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC#CBr)OC""",21,"""3DD6B8522BD753AD"""
+"""DE37A20E68AF5C9C_D782EFBDAF939205_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(C)Cl)OC""",21,"""3DD6B8522BD753AD"""
+"""98B6156976BA2F6D_C73B803F18B59DB8_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCCF)OC""",21,"""3DD6B8522BD753AD"""
+"""8346F6443E30F7A5_43F89986E9B77E22_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(N)=S)OC""",21,"""3DD6B8522BD753AD"""
+"""D3C3F08B4E2885D7_42604460937FA005_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCCS)OC""",21,"""3DD6B8522BD753AD"""
+"""F4064ADDA5152F3A_3D91643249B4A06B_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCCC)OC""",21,"""3DD6B8522BD753AD"""
+"""F3C320B86AA46797_BFF3ADC48BE2349F_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCCN)OC""",21,"""3DD6B8522BD753AD"""
+"""A2A98BB794B22616_1FF22A267E52F52C_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCCBr)OC""",21,"""3DD6B8522BD753AD"""
+"""456F8FB21FF74072_5A2E1E91DBF4590C_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(C)C)OC""",21,"""3DD6B8522BD753AD"""
+"""CCD6130CDB093B80_6864C050D067C1BB_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC2CC2)OC""",21,"""3DD6B8522BD753AD"""
+"""415A54290605F9FB_36EB7C9EAB7B12BC_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCC=C)OC""",21,"""3DD6B8522BD753AD"""
+"""1F89EC084EBF02DD_F7E3D6C56D6912D0_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCC#C)OC""",21,"""3DD6B8522BD753AD"""
+"""35CF4930AFDACFE7_ED89A519AD6C081F_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCCCl)OC""",21,"""3DD6B8522BD753AD"""
+"""597B910256239B33_43732B8CEE0B2EB0_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCC#N)OC""",21,"""3DD6B8522BD753AD"""
+"""5A81B315A45AE505_3C0576D797A02698_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(F)Br)OC""",21,"""3DD6B8522BD753AD"""
+"""FEEE93944F908C0A_8BE3F68E827CEEAA_6031_DP""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCNN)OC""",21,"""3DD6B8522BD753AD"""
+"""5EEC4D41B0E54624_74906809192BC1A1_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(=C)F)OC""",21,"""3DD6B8522BD753AD"""
+"""DDFE87E443751396_70582C14FBC23504_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC=CBr)OC""",21,"""3DD6B8522BD753AD"""
+"""0DD8C246A5BAE959_E29C811D8D804A11_6031_DP""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCCO)OC""",21,"""3DD6B8522BD753AD"""
+"""AFB80B539DFA47A8_0C87EE05305D6B36_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCOC)OC""",21,"""3DD6B8522BD753AD"""
+"""ED9BBE012E04A336_588379A5B1487582_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OC[C@@H]2CO2)OC""",21,"""3DD6B8522BD753AD"""
+"""B731642A6889E51D_BF8C282C3F8C3EA5_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OC[C@H]2CO2)OC""",21,"""3DD6B8522BD753AD"""
+"""8500BFC6D7022D55_51B5AB247E276DC1_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC2CO2)OC""",21,"""3DD6B8522BD753AD"""
+"""9054AD033F480AA4_55F5CDF8E6C9B812_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(Cl)Cl)OC""",21,"""3DD6B8522BD753AD"""
+"""2F611118EB96640D_0209FDEAA1228C6B_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(=C)Cl)OC""",21,"""3DD6B8522BD753AD"""
+"""49FE21F5B043AA7C_65E646F2FEE331D3_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(C)F)OC""",21,"""3DD6B8522BD753AD"""
+"""6240D5C1BDA3341F_DBAA4FEF8806A034_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC=CCl)OC""",21,"""3DD6B8522BD753AD"""
+"""64A8CC124318CC54_45221AADB245B38F_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(C)Br)OC""",21,"""3DD6B8522BD753AD"""
+"""D024E6D6079B726B_90827CB99F5B24CD_6031_UN""","""CCOC1=C(C=C(C=C1Cl)C=CC(=O)OCCCI)OC""",21,"""3DD6B8522BD753AD"""
+"""FFA34FFBE030AA00_326C4CA61B09B814_6031_UN""","""C[C@H](OC2=C1C=CC=CC1=C(C=C2)Cl)C(=O)OCC(C)=C""",21,"""3E0D3E863CF3AE97"""
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+"""5D62DDA873D9219B_605A3A8469ABACDE_6031_UN""","""COC1=C(C=C(C=C1)C=CC(=O)C(=O)OCCCBr)OC""",21,"""427EA8F03C2E0A5F"""
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+"""A7D308ECDCB2C058_49436C3CBC824B4E_6031_UN""","""COC1=C(C=C(C=C1)C=CC(=O)C(=O)OCCC=C)OC""",21,"""427EA8F03C2E0A5F"""
+"""38B500543C7835D8_884BC6677A904B22_6031_UN""","""COC1=C(C=C(C=C1)C=CC(=O)C(=O)OCCC#C)OC""",21,"""427EA8F03C2E0A5F"""
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+"""3CBC3AF179E51855_C0A359D3CE3427A4_6031_UN""","""CN1NC(=O)C2=C1N=C(C=C2C(=O)OC[C@H]3CO3)C4CC4""",21,"""42F9C9ADDA6F4AAC"""
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+"""67D7A4DE0B0F0F1C_E623ACA937F9CB00_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OC[C@@H](C)N)F""",21,"""44B0EAAF6C8A91E9"""
+"""FCAC7DE764885998_D7789059F6425C82_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OC[CH]=[C]=[CH2])F""",21,"""44B0EAAF6C8A91E9"""
+"""6710C61DEBC88DE3_20A084753C56C8CF_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC#CBr)F""",21,"""44B0EAAF6C8A91E9"""
+"""D093DBEBC0B4C3FD_AEE4BD40E8CE5041_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC(C)Cl)F""",21,"""44B0EAAF6C8A91E9"""
+"""A68B8776B677DA79_BE5DD2C25FE85FFC_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCCF)F""",21,"""44B0EAAF6C8A91E9"""
+"""5106794FC8233362_3A9ECB7BAEEABC66_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC(N)=S)F""",21,"""44B0EAAF6C8A91E9"""
+"""E78DA276118DCE51_3B06169DD4226241_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCCS)F""",21,"""44B0EAAF6C8A91E9"""
+"""D9FAE76E2EB9B589_44F736CF0EE9622F_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCCC)F""",21,"""44B0EAAF6C8A91E9"""
+"""58901C0EE1AE48C9_C695FF39CCBFF6DB_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCCN)F""",21,"""44B0EAAF6C8A91E9"""
+"""9FF23202C9BF6C1D_669478DB390F3768_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCCBr)F""",21,"""44B0EAAF6C8A91E9"""
+"""6BA05FF57B3C58A7_23484C6C9CA99B48_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC(C)C)F""",21,"""44B0EAAF6C8A91E9"""
+"""BB80EA669000256A_110292AD973A03FF_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC3CC3)F""",21,"""44B0EAAF6C8A91E9"""
+"""20CA6BDE87E07F9A_4F8D2E63EC26D0F8_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCC=C)F""",21,"""44B0EAAF6C8A91E9"""
+"""2440973E23C3CB65_8E8584382A34D094_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCC#C)F""",21,"""44B0EAAF6C8A91E9"""
+"""8D69B25ACA7ECFFF_94EFF7E4EA31CA5B_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCCCl)F""",21,"""44B0EAAF6C8A91E9"""
+"""F05FDDD4A08E6B84_3A157971A956ECF4_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCC#N)F""",21,"""44B0EAAF6C8A91E9"""
+"""907F2D842F1868BB_4563242AD0FDE4DC_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC(F)Br)F""",21,"""44B0EAAF6C8A91E9"""
+"""F9FD19A52D08A7A2_F285A473C5212CEE_6031_DP""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCNN)F""",21,"""44B0EAAF6C8A91E9"""
+"""3E4BE8DDC7AEB852_0DF63AF45E7603E5_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC(=C)F)F""",21,"""44B0EAAF6C8A91E9"""
+"""F07920AAD1C40834_093E7EE9BC9FF740_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC=CBr)F""",21,"""44B0EAAF6C8A91E9"""
+"""A1F65D63FFBACF4B_9BFAD3E0CADD8855_6031_DP""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCCO)F""",21,"""44B0EAAF6C8A91E9"""
+"""8C3B20066D1EFB12_75E1BCF87700A972_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCOC)F""",21,"""44B0EAAF6C8A91E9"""
+"""4DAF223FE48C982A_21E52B58F615B7C6_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OC[C@@H]3CO3)F""",21,"""44B0EAAF6C8A91E9"""
+"""1809EFE9395653AF_C6EA7AD178D1FCE1_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OC[C@H]3CO3)F""",21,"""44B0EAAF6C8A91E9"""
+"""D1EA4FE3A1AD6E4E_28D3F9D9397AAF85_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC3CO3)F""",21,"""44B0EAAF6C8A91E9"""
+"""007A5317ABD64472_2C939F05A1947A56_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC(Cl)Cl)F""",21,"""44B0EAAF6C8A91E9"""
+"""DBDEA25B6A981075_7B6FAF17E67F4E2F_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC(=C)Cl)F""",21,"""44B0EAAF6C8A91E9"""
+"""C44430229024B325_1C80140FB9BEF397_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC(C)F)F""",21,"""44B0EAAF6C8A91E9"""
+"""51E84A10BAB372DF_A2CC1D12CF5B6270_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC=CCl)F""",21,"""44B0EAAF6C8A91E9"""
+"""787D379FFA98980D_3C444850F51871CB_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCC(C)Br)F""",21,"""44B0EAAF6C8A91E9"""
+"""A8943B6889C7B7FF_E9E42E44D806E689_6031_UN""","""COC(=O)C2=C[N]1C(=C(N=C1C=C2)C(=O)OCCCI)F""",21,"""44B0EAAF6C8A91E9"""
+"""C711C94F8761AE79_49658CF6DF8D8564_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)=C)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""B82318AD328BA1C2_557BFC15000355C5_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(F)F)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""BF90AF5A80C20D19_ED9E1094548E6E9E_6031_DP""","""COC1=CC(=C(C=C1)C(=O)OCCNC)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""44B5CCDBD1C06917_E9BEDDE6B60135F0_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OC[C@H](C)N)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""44633DCCA92D436E_35EAAC70A2E15D33_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)S)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""F422BF4682209466_48C85848F620583E_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCSC)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""5D1FD716F3C4F9EC_0B10529D2644A149_6031_DP""","""COC1=CC(=C(C=C1)C(=O)OCC(C)N)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""3B37E47E702B94B7_5FAF7D1751B834C8_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC#CC)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""D53804AF15E4265C_CADE4AB92BAC8717_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCON)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""A89578B1A6B2B182_CDA5D859CF453C17_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(=C)Br)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""F4E83BE15062AB53_E797B8D0A304C90E_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OC[C@@H](C)N)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""7D2ECC51A6438362_D6CC842062BF5E8C_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OC[CH]=[C]=[CH2])OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""347809840235E342_2114900CA8ABCAC1_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC#CBr)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""3B08E67DE36E2BC6_AF50A9397C33524F_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)Cl)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""DC1E310AA9FDE6F8_BFE9C6BBCB155DF2_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCF)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""E042B6B052D6D932_3B2ADF023A17BE68_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(N)=S)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""C01D1745B75CA15D_3AB202E440DF604F_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCS)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""AC2CB4D7326BF47A_454322B69A146021_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCC)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""3DEFF8E4E3F62D55_C721EB405842F4D5_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCN)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""EBE31B4288D19EFD_67206CA2ADF23566_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCBr)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""7834410174BB3C85_22FC581508549946_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)C)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""6360CF4E752DE0E5_10B686D403C701F1_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC2CC2)OC3CCCC3""",21,"""4504FED6F87793E7"""
+"""9F745D9288B9A9F0_4E393A1A78DBD2F6_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCC=C)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""1E25CE7B8C750345_8F319041BEC9D29A_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCC#C)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""DC84B7CF3E77C49C_955BE39D7ECCC855_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCCl)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""39CD93B652A0BF14_3BA16D083DABEEFA_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCC#N)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""BB5B1D376D1BD54E_44D730534400E6D2_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(F)Br)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""39DB4F4E8A4B845A_F331B00A51DC2EE0_6031_DP""","""COC1=CC(=C(C=C1)C(=O)OCCNN)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""0D5DD4E9FCF17292_0C422E8DCA8B01EB_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(=C)F)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""39773799B2BAB329_088A6A902862F54E_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC=CBr)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""AF360FE56DD60875_9A4EC7995E208A5B_6031_DP""","""COC1=CC(=C(C=C1)C(=O)OCCCO)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""635D8DE1753023E7_7455A881E3FDAB7C_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCOC)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""5CF9B37198E58EB2_20513F2162E8B5C8_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OC[C@@H]2CO2)OC3CCCC3""",21,"""4504FED6F87793E7"""
+"""8DF02543375BA2FC_C75E6EA8EC2CFEEF_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OC[C@H]2CO2)OC3CCCC3""",21,"""4504FED6F87793E7"""
+"""00FE5DAE6FAF0C56_2967EDA0AD87AD8B_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC2CO2)OC3CCCC3""",21,"""4504FED6F87793E7"""
+"""3F11FD62FD770D3E_2D278B7C35697858_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(Cl)Cl)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""691E0C4A67DF1D4A_7ADBBB6E72824C21_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(=C)Cl)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""988FD9E7CEE48203_1D3400762D43F199_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)F)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""BE181F137912C07C_A378096B5BA6607E_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC=CCl)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""05BEC5F7833ECB81_3DF05C2961E573C5_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)Br)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""F13EC53B4F701D45_E8503A3D4CFBE487_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCI)OC2CCCC2""",21,"""4504FED6F87793E7"""
+"""3DF8F03B88BA5BE8_98547E7580D00E34_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC=CC(=C2)C)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""6748CAF36BDA8163_B98805BF4B99B0A7_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC=C(C)C=C2)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""3D90009B7AD68A3B_0027C3C9C6E6ECFD_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC(=CC=C2)F)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""364EAFA05062A54D_9A371A2BAC82D236_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC(=CN=C2)F)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""3DA604EE913F8213_ED75A851B6899A53_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=C(N)C=CN=C2)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""969B24D0D539E5E3_F9D5047E20BDD13C_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CN=C(C=C2)F)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""42ED82EDFEBB1963_E44514EDE8FF02D5_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=C(C=CC=C2)Cl)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""E2AB267C1E476FA9_5EA8746213774580_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC=C(C#N)S2)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""3377A90A278FAE39_994B18474AB7A949_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=C(N=CC=C2)Cl)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""16412C2C765CD0AD_773CBAAA6E8847D6_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC(=CC=C2)O)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""DF354B52F88FA6D6_88B4E92E1748C1A8_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=C(N=CC=C2)F)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""6577F6E14062D228_02EEF09EBFA977AC_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC=C(C=C2)O)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""C9AE4F625B4D31C1_185110AC56BD8CF4_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CN=C(C=C2)Cl)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""AA90A0B5D3A907BF_33ECFE006889F1C9_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC=CC(=C2)N)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""8E843B1DFAEB3555_49390A1A641FF9D8_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CN=C(N)C=C2)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""8C454A49A5EAB5CC_9EDA540B49A98DD0_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=C(ON=C2C)C)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""7687044206251AD0_C1B4DD2076EFAD5A_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CSC(=C2)C#N)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""82707578C349136A_1CB6C000B5DE8542_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC=N[N]2CC)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""77E1EC1B0CDBB358_387D0ADCBD494ACB_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC(=C(Cl)S2)Cl)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""E8B2CCA720594F6E_13BAFA52FA9F6EC7_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC(=NS2)OC)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""3F22E21A71B49947_604D29A9FE5D7AED_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC(=CC=C2)Cl)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""D85A373632A48D20_E64470BCB02FB656_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=C(C=CC=C2)O)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""F5FCDEF6212B5A97_DA4F5BD48DE789D0_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=CC=C(C=C2)Cl)F)C(=O)O""",21,"""468F60CCC12227C1"""
+"""9FBEA878C6D0EE4B_325F967B08145007_6004_UN""","""NC(CC1=C(C(=NC=C1F)C2=C(C=CC=N2)Cl)F)C(=O)O""",21,"""468F60CCC12227C1"""
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+"""E793B2EB8B5C1886_3646CAC2DFA44293_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC(C)S""",21,"""46A8986485328C47"""
+"""1288D60CFBFDF2B6_4B643EFA8B65479E_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCSC""",21,"""46A8986485328C47"""
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+"""0BEB9AB3E947D020_E43BDE62DE41D6AE_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OC[C@@H](C)N""",21,"""46A8986485328C47"""
+"""FFE3A5B0FD3E258D_D560E2921FFA412C_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OC[CH]=[C]=[CH2]""",21,"""46A8986485328C47"""
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+"""05E2487037B95C78_ACFCCF8B01764DEF_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC(C)Cl""",21,"""46A8986485328C47"""
+"""417D1620757411D0_BC45A009B6504252_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCCF""",21,"""46A8986485328C47"""
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+"""53BB7E2CDC12C822_391E64563D9A7FEF_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCCS""",21,"""46A8986485328C47"""
+"""DC62ECE91896888A_46EF4404E7517F81_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCCC""",21,"""46A8986485328C47"""
+"""E5BE38F88A801422_C48D8DF22507EB75_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCCN""",21,"""46A8986485328C47"""
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+"""9BCCD74C8B69C155_21503EA7751186E6_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC(C)C""",21,"""46A8986485328C47"""
+"""0C1326770F6AA5D8_131AE0667E821E51_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC3CC3""",21,"""46A8986485328C47"""
+"""CDF2730F40B6224C_4D955CA8059ECD56_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCC=C""",21,"""46A8986485328C47"""
+"""04D142CD464AEFE9_8C9DF6F3C38CCD3A_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCC#C""",21,"""46A8986485328C47"""
+"""3476B9320F839398_96F7852F0389D7F5_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCCCl""",21,"""46A8986485328C47"""
+"""311633ABFB6AC477_380D0BBA40EEF15A_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCC#N""",21,"""46A8986485328C47"""
+"""F6E16FF1946DCC50_477B56E13945F972_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC(F)Br""",21,"""46A8986485328C47"""
+"""F5CD0108FD464D4F_F09DD6B82C993140_6031_DP""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCNN""",21,"""46A8986485328C47"""
+"""AE9FF22090157AFD_0FEE483FB7CE1E4B_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC(=C)F""",21,"""46A8986485328C47"""
+"""EC6431CDA406F1E6_0B260C225527EAEE_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC=CBr""",21,"""46A8986485328C47"""
+"""96FE1357CF6ED470_99E2A12B236595FB_6031_DP""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCCO""",21,"""46A8986485328C47"""
+"""BF3FADD4A8B006B0_77F9CE339EB8B4DC_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCOC""",21,"""46A8986485328C47"""
+"""321336D5D0009820_23FD59931FADAA68_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OC[C@@H]3CO3""",21,"""46A8986485328C47"""
+"""F1F779A075CB6C84_C4F2081A9169E14F_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OC[C@H]3CO3""",21,"""46A8986485328C47"""
+"""F6623D66EF39B59F_2ACB8B12D0C2B22B_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC3CO3""",21,"""46A8986485328C47"""
+"""96F5812D36BCE583_2E8BEDCE482C67F8_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC(Cl)Cl""",21,"""46A8986485328C47"""
+"""BC03DE265FBAE1B5_7977DDDC0FC75381_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC(=C)Cl""",21,"""46A8986485328C47"""
+"""43F3F39512150536_1E9866C45006EE39_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC(C)F""",21,"""46A8986485328C47"""
+"""2EE54D0612FE12BE_A0D46FD926E37FDE_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC=CCl""",21,"""46A8986485328C47"""
+"""B1BA046849BF237C_3E5C3A9B1CA06C65_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCC(C)Br""",21,"""46A8986485328C47"""
+"""9C48D80AF816E0F6_EBFC5C8F31BEFB27_6031_UN""","""COCC[N]1C=C(C=N1)[C@@H]2OCC[C@H]2C(=O)OCCCI""",21,"""46A8986485328C47"""
+"""E5B3722A495DDAFB_4B3F33942940E72E_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC(C)=C""",21,"""475E41B40EBAF1AD"""
+"""399BA11C6B3F1919_57214377F6CE378F_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC(F)F""",21,"""475E41B40EBAF1AD"""
+"""6EAB012D970CA39F_EFC4AFF6A2430CD4_6031_DP""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCNC""",21,"""475E41B40EBAF1AD"""
+"""C309D33357A0E3DD_EBE4628440CC57BA_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OC[C@H](C)N""",21,"""475E41B40EBAF1AD"""
+"""1F9477224236224F_37B01312542C3F79_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC(C)S""",21,"""475E41B40EBAF1AD"""
+"""41C479928C8453F6_4A92E72A00ED3A74_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCSC""",21,"""475E41B40EBAF1AD"""
+"""324A0BAD50C3D874_094AEDFFD089C303_6031_DP""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC(C)N""",21,"""475E41B40EBAF1AD"""
+"""F1C314968B948041_5DF5C275A7755682_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC#CC""",21,"""475E41B40EBAF1AD"""
+"""6EB38AA09DF691EA_C884F5DBDD61E55D_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCON""",21,"""475E41B40EBAF1AD"""
+"""DDDF259D0FA41F94_CFFF673B39885E5D_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC(=C)Br""",21,"""475E41B40EBAF1AD"""
+"""83249144154D3B6F_E5CD07B255C9AB44_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OC[C@@H](C)N""",21,"""475E41B40EBAF1AD"""
+"""340464F53C2AF793_D4963B4294723CC6_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OC[CH]=[C]=[CH2]""",21,"""475E41B40EBAF1AD"""
+"""EA663A5C47755610_234E2F6E5E66A88B_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC#CBr""",21,"""475E41B40EBAF1AD"""
+"""A5188362097D6A27_AD0A165B8AFE3005_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC(C)Cl""",21,"""475E41B40EBAF1AD"""
+"""96152C89D73C9E1E_BDB379D93DD83FB8_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCCF""",21,"""475E41B40EBAF1AD"""
+"""3DA7187B3D9D4E29_39706060CCDADC22_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC(N)=S""",21,"""475E41B40EBAF1AD"""
+"""402961139B8A571A_38E8BD86B6120205_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCCS""",21,"""475E41B40EBAF1AD"""
+"""4566EAF75665E25F_47199DD46CD9026B_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCCC""",21,"""475E41B40EBAF1AD"""
+"""91F57DC6C2EA0BB3_C57B5422AE8F969F_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCCN""",21,"""475E41B40EBAF1AD"""
+"""A2F47507B627F680_657AD3C05B3F572C_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCCBr""",21,"""475E41B40EBAF1AD"""
+"""A72A6416511CCAEF_20A6E777FE99FB0C_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC(C)C""",21,"""475E41B40EBAF1AD"""
+"""B81A69C0D5386E84_12EC39B6F50A63BB_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC3CC3""",21,"""475E41B40EBAF1AD"""
+"""DD97B90D81A69462_4C6385788E16B0BC_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCC=C""",21,"""475E41B40EBAF1AD"""
+"""008A5571CC6F05FA_8D6B2F234804B0D0_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCC#C""",21,"""475E41B40EBAF1AD"""
+"""DBCC75AA3FD12CB1_97015CFF8801AA1F_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCCCl""",21,"""475E41B40EBAF1AD"""
+"""840FC010CE4E24BE_39FBD26ACB668CB0_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCC#N""",21,"""475E41B40EBAF1AD"""
+"""D12A62CB8AF23ADA_468D8F31B2CD8498_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC(F)Br""",21,"""475E41B40EBAF1AD"""
+"""37CAA20FC985C977_F16B0F68A7114CAA_6031_DP""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCNN""",21,"""475E41B40EBAF1AD"""
+"""A25B986E90C30A17_0E1891EF3C4663A1_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC(=C)F""",21,"""475E41B40EBAF1AD"""
+"""2163FC739F434B8B_0AD0D5F2DEAF9704_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC=CBr""",21,"""475E41B40EBAF1AD"""
+"""A454F300DFC2654B_981478FBA8EDE811_6031_DP""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCCO""",21,"""475E41B40EBAF1AD"""
+"""FCEBBBC42B48C5B6_760F17E31530C936_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCCOC""",21,"""475E41B40EBAF1AD"""
+"""89657CF94FC06D5A_220B80439425D782_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OC[C@@H]3CO3""",21,"""475E41B40EBAF1AD"""
+"""C1C8148A82C3668A_C504D1CA1AE19CA5_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OC[C@H]3CO3""",21,"""475E41B40EBAF1AD"""
+"""ED76A7099A95B106_2B3D52C25B4ACFC1_6031_UN""","""CC1=C(C(=NO1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC3CO3""",21,"""475E41B40EBAF1AD"""
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+"""CE38CB1BE80B25D1_12A4CE7D036506B6_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=CC(=NS3)OC""",21,"""479154E338D84FB0"""
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+"""36E6A9641083B96B_DB516FFB741DE1A1_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=CC=C(C=C3)Cl""",21,"""479154E338D84FB0"""
+"""39850ADBF2A19A64_3341A254F1EE3876_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(C=CC=N3)Cl""",21,"""479154E338D84FB0"""
+"""B0F854262B64BC8E_800DCF5D25AEC8D5_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=CC=C(C=C3)F""",21,"""479154E338D84FB0"""
+"""046C66FC0C72E9D8_56D4A5BB87452C9E_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=CC(=NC=C3)Cl""",21,"""479154E338D84FB0"""
+"""CF6372BB155F1875_4CC1C10DAAB21414_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(C)C=CC=C3""",21,"""479154E338D84FB0"""
+"""CDEC287027EBD989_0C60AC4A62CD8E35_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(SC=C3)C#N""",21,"""479154E338D84FB0"""
+"""A29D0F7DDE18B8C0_F99CF3B873B78DF2_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(C=NC=C3)F""",21,"""479154E338D84FB0"""
+"""B07363C98A5BF247_FB9FA83F15DDCAF5_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(C)SC(=C3)C""",21,"""479154E338D84FB0"""
+"""7F44C2D855D651B3_4C948F37862F95CA_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(OC=C3)C#N""",21,"""479154E338D84FB0"""
+"""412E61640085E51F_BFF977275017A3D5_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(N)C=NC=C3""",21,"""479154E338D84FB0"""
+"""0A6BFC78D3364EC6_C4397F8C2110E5DA_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(N)N=CC=C3""",21,"""479154E338D84FB0"""
+"""E51669761313CD6B_C851C1E598F50041_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(C=CO3)C#N""",21,"""479154E338D84FB0"""
+"""4FC567A5045E2824_E47991D0EEB4BEC1_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(C)C=NC=C3""",21,"""479154E338D84FB0"""
+"""7DD12A1533F50BDC_0DD8B6FE3FBEF7CF_6004_DP""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=CC=C(CN)O3""",21,"""479154E338D84FB0"""
+"""8E42C608D34034D1_0E1709D8764E8609_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=C(SC(=C3)Cl)Cl""",21,"""479154E338D84FB0"""
+"""A17B704BCF5DAFAE_DB66B73D96FDFB84_6004_DP""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=CC=C(CN)S3""",21,"""479154E338D84FB0"""
+"""9BEC7312BAAF07BE_B207C2738AE2CDB9_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=N[N](C=C3C)C""",21,"""479154E338D84FB0"""
+"""B7C1349DC5992718_5BB19199B46BF847_6004_DP""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=CC=C(O)C=C3""",21,"""479154E338D84FB0"""
+"""DAFB0EEB15507811_4D5D30B3FB3E3407_6004_UN""","""O=[N](=O)C2=C(C=C1CCNC(C1=C2)=O)C3=CC=C(C#N)O3""",21,"""479154E338D84FB0"""
+"""6D32AF200D2073B5_4BFBD89FFC22B8F3_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(C)=C""",21,"""479AAABFDBD8AE70"""
+"""489FDB1CD2F49A54_57E5A87C23AC6852_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(F)F""",21,"""479AAABFDBD8AE70"""
+"""D88D22190C2D7919_EF0044FD77215309_6031_DP""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCNC""",21,"""479AAABFDBD8AE70"""
+"""F1E4D0E2357DABF5_EB20898F95AE0867_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OC[C@H](C)N""",21,"""479AAABFDBD8AE70"""
+"""C110D436D9B9DBB0_3774F819814E60A4_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(C)S""",21,"""479AAABFDBD8AE70"""
+"""9750E5A85C078F40_4A560C21D58F65A9_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCSC""",21,"""479AAABFDBD8AE70"""
+"""AA7B49F8B399AA76_098E06F405EB9CDE_6031_DP""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(C)N""",21,"""479AAABFDBD8AE70"""
+"""245FDF573C2D4D35_5D31297E7217095F_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC#CC""",21,"""479AAABFDBD8AE70"""
+"""AC08CA29ECFCAD4C_C8401ED00803BA80_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCON""",21,"""479AAABFDBD8AE70"""
+"""76777136A27F8206_CF3B8C30ECEA0180_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(=C)Br""",21,"""479AAABFDBD8AE70"""
+"""CF1BA73C2DA0C07E_E509ECB980ABF499_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OC[C@@H](C)N""",21,"""479AAABFDBD8AE70"""
+"""0D910DA70EF5C8D1_D452D0494110631B_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OC[CH]=[C]=[CH2]""",21,"""479AAABFDBD8AE70"""
+"""0F382A1AD6BF0910_238AC4658B04F756_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC#CBr""",21,"""479AAABFDBD8AE70"""
+"""062BCCCAE96BA528_ADCEFD505F9C6FD8_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(C)Cl""",21,"""479AAABFDBD8AE70"""
+"""3B4B1EF7068B8BA3_BD7792D2E8BA6065_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCCF""",21,"""479AAABFDBD8AE70"""
+"""87AACE4124C9C229_39B48B6B19B883FF_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(N)=S""",21,"""479AAABFDBD8AE70"""
+"""35EDB43C26A40519_382C568D63705DD8_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCCS""",21,"""479AAABFDBD8AE70"""
+"""5F2F344BFCBF1F1C_47DD76DFB9BB5DB6_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCCC""",21,"""479AAABFDBD8AE70"""
+"""C796A9296EDE1842_C5BFBF297BEDC942_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCCN""",21,"""479AAABFDBD8AE70"""
+"""A15B0FB14F1E32DB_65BE38CB8E5D08F1_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCCBr""",21,"""479AAABFDBD8AE70"""
+"""9CC558EA9FEC592F_20620C7C2BFBA4D1_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(C)C""",21,"""479AAABFDBD8AE70"""
+"""2923C8B7B78B2F0D_1228D2BD20683C66_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC3CC3""",21,"""479AAABFDBD8AE70"""
+"""FAEFD0BEE3F4AEAC_4CA76E735B74EF61_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCC=C""",21,"""479AAABFDBD8AE70"""
+"""CFC7E53845C3107E_8DAFC4289D66EF0D_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCC#C""",21,"""479AAABFDBD8AE70"""
+"""C188C7FA37826D18_97C5B7F45D63F5C2_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCCCl""",21,"""479AAABFDBD8AE70"""
+"""D878F894B5C08A33_393F39611E04D36D_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCC#N""",21,"""479AAABFDBD8AE70"""
+"""A498E0B4C00B1ED4_4649643A67AFDB45_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(F)Br""",21,"""479AAABFDBD8AE70"""
+"""3FF193DB1F5C29D2_F1AFE46372731377_6031_DP""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCNN""",21,"""479AAABFDBD8AE70"""
+"""2D5BD57D863EBCB1_0EDC7AE4E9243C7C_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(=C)F""",21,"""479AAABFDBD8AE70"""
+"""26CE121A3530C557_0A143EF90BCDC8D9_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC=CBr""",21,"""479AAABFDBD8AE70"""
+"""02CF8E1D10785402_98D093F07D8FB7CC_6031_DP""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCCO""",21,"""479AAABFDBD8AE70"""
+"""F1C7153A6E32942B_76CBFCE8C05296EB_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCOC""",21,"""479AAABFDBD8AE70"""
+"""B01C9DA0500C870D_22CF6B484147885F_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OC[C@@H]3CO3""",21,"""479AAABFDBD8AE70"""
+"""4BCBF1ECD1F2C5A3_C5C03AC1CF83C378_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OC[C@H]3CO3""",21,"""479AAABFDBD8AE70"""
+"""A076F4EA44682672_2BF9B9C98E28901C_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC3CO3""",21,"""479AAABFDBD8AE70"""
+"""6AEDA8B65CB65557_2FB9DF1516C645CF_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(Cl)Cl""",21,"""479AAABFDBD8AE70"""
+"""2FF1FEE849E20BB6_7845EF07512D71B6_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(=C)Cl""",21,"""479AAABFDBD8AE70"""
+"""4B8F6588C3806D68_1FAA541F0EECCC0E_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(C)F""",21,"""479AAABFDBD8AE70"""
+"""85B9783B7E7106E4_A1E65D0278095DE9_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC=CCl""",21,"""479AAABFDBD8AE70"""
+"""DA3C66F384E4E9BC_3F6E0840424A4E52_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC(C)Br""",21,"""479AAABFDBD8AE70"""
+"""3E49B07BEEDEF271_EACE6E546F54D910_6031_UN""","""CC1=C(C(=NO1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCCCI""",21,"""479AAABFDBD8AE70"""
+"""5BED28E605E2DA27_440BC1204EAA2560_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=CC3=C2C=CC=C3)CC(C)=C""",21,"""486AB300695033E3"""
+"""B7946A51F98A968C_5815B1C39124F5C1_6031_UN""","""O(C(=O)C2=C1C=CC=CC1=CC3=C2C=CC=C3)CC(F)F""",21,"""486AB300695033E3"""
+"""FFD277931C8D6CD8_E0F05D42C5A9CE9A_6031_DP""","""O(C(=O)C2=C1C=CC=CC1=CC3=C2C=CC=C3)CCNC""",21,"""486AB300695033E3"""
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+"""CCD06A053F0225D0_C277ED8467565D32_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)C[CH]=[C]=[CH2]""",21,"""51BF9772FD9E9059"""
+"""ABD0002BBA2062DF_35AFF9A8AD42C97F_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC#CBr""",21,"""51BF9772FD9E9059"""
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+"""8AA39037F0471597_51F84B129FFD639F_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CCCC""",21,"""51BF9772FD9E9059"""
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+"""913A0A53DA3A8F3E_739B0506A81B36D8_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CCCBr""",21,"""51BF9772FD9E9059"""
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+"""9C314C6D14264EE3_040DEF70062E024F_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC3CC3""",21,"""51BF9772FD9E9059"""
+"""C6BFCB08EEB5B53C_5A8253BE7D32D148_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CCC=C""",21,"""51BF9772FD9E9059"""
+"""B8D828B57956F281_9B8AF9E5BB20D124_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CCC#C""",21,"""51BF9772FD9E9059"""
+"""C7E3F69000ABA269_81E08A397B25CBEB_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CCCCl""",21,"""51BF9772FD9E9059"""
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+"""889FA43AA9B0D5A8_506C59F741E9E56C_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC(F)Br""",21,"""51BF9772FD9E9059"""
+"""0910A2C734A48DAD_E78AD9AE54352D5E_6031_DP""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CCNN""",21,"""51BF9772FD9E9059"""
+"""71C5FC4F0B29A1B9_18F94729CF620255_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC(=C)F""",21,"""51BF9772FD9E9059"""
+"""2EE2927C5C31C3F1_1C3103342D8BF6F0_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC=CBr""",21,"""51BF9772FD9E9059"""
+"""6CFC800D1188EC70_8EF5AE3D5BC989E5_6031_DP""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CCCO""",21,"""51BF9772FD9E9059"""
+"""4BCA1253FEF0F097_60EEC125E614A8C2_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CCOC""",21,"""51BF9772FD9E9059"""
+"""8F1F975039FE9D2E_34EA56856701B676_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)C[C@@H]3CO3""",21,"""51BF9772FD9E9059"""
+"""CF72DA889E5F6057_D3E5070CE9C5FD51_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)C[C@H]3CO3""",21,"""51BF9772FD9E9059"""
+"""DFFDE1A50108403A_3DDC8404A86EAE35_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC3CO3""",21,"""51BF9772FD9E9059"""
+"""59DF239172F85200_399CE2D830807BE6_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC(Cl)Cl""",21,"""51BF9772FD9E9059"""
+"""7E5177CB676796EE_6E60D2CA776B4F9F_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC(=C)Cl""",21,"""51BF9772FD9E9059"""
+"""EAA971CD2DEEFBE4_098F69D228AAF227_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC(C)F""",21,"""51BF9772FD9E9059"""
+"""4670F0318B3FC806_B7C360CF5E4F63C0_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC=CCl""",21,"""51BF9772FD9E9059"""
+"""0FE906676B4F0537_294B358D640C707B_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CC(C)Br""",21,"""51BF9772FD9E9059"""
+"""7B0CBE809D70F76C_FCEB53994912E739_6031_UN""","""O(C(=O)C1=C(N=CC=C1)SCC2CCCCC2)CCCI""",21,"""51BF9772FD9E9059"""
+"""01A426A796432842_5DA022BA63ED9997_6031_UN""","""CN(C(C(=O)OCC(C)=C)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""7A5F4EAB4D9DC1F6_41BE5259BC634936_6031_UN""","""CN(C(C(=O)OCC(F)F)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""FE4FA378C76C361C_F95BBED8E8EE726D_6031_DP""","""CN(C(C(=O)OCCNC)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""5A2D097B43E79979_FD7B73AA0A612903_6031_UN""","""CN(C(C(=O)OC[C@H](C)N)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""9FCEE04F1E21AB56_212F023C1E8141C0_6031_UN""","""CN(C(C(=O)OCC(C)S)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""9A648B37BE9B1387_5C0DF6044A4044CD_6031_UN""","""CN(C(C(=O)OCCSC)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""DB5A9E4E56F48FA8_1FD5FCD19A24BDBA_6031_DP""","""CN(C(C(=O)OCC(C)N)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""4DD21352ED37D6C5_4B6AD35BEDD8283B_6031_UN""","""CN(C(C(=O)OCC#CC)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""0CE3CC34923A85B2_DE1BE4F597CC9BE4_6031_UN""","""CN(C(C(=O)OCCON)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""A12C134C01EBB61F_D9607615732520E4_6031_UN""","""CN(C(C(=O)OCC(=C)Br)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""65F6ACF3AD3EB238_F352169C1F64D5FD_6031_UN""","""CN(C(C(=O)OC[C@@H](C)N)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""4237BF46F329C9EC_C2092A6CDEDF427F_6031_UN""","""CN(C(C(=O)OC[CH]=[C]=[CH2])C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""BEE4B7FA1E2AEF3B_35D13E4014CBD632_6031_UN""","""CN(C(C(=O)OCC#CBr)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""EBB6601D3069865F_BB950775C0534EBC_6031_UN""","""CN(C(C(=O)OCC(C)Cl)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""234A25C3E1DC88F0_AB2C68F777754101_6031_UN""","""CN(C(C(=O)OCCCF)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""4BE3E1EB0684E6F9_2FEF714E8677A29B_6031_UN""","""CN(C(C(=O)OCC(N)=S)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""40A6953806B3E3C8_2E77ACA8FCBF7CBC_6031_UN""","""CN(C(C(=O)OCCCS)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""7115B26DCFD5E823_51868CFA26747CD2_6031_UN""","""CN(C(C(=O)OCCCC)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""818840CE191BC28D_D3E4450CE422E826_6031_UN""","""CN(C(C(=O)OCCCN)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""5AB98C2F0F60F84B_73E5C2EE11922995_6031_UN""","""CN(C(C(=O)OCCCBr)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""68990656EBCCB6C8_3639F659B43485B5_6031_UN""","""CN(C(C(=O)OCC(C)C)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""6441DDE266BB85DC_04732898BFA71D02_6031_UN""","""CN(C(C(=O)OCC1CC1)C2=C(C=CC=C2F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""16ECA363224FA390_5AFC9456C4BBCE05_6031_UN""","""CN(C(C(=O)OCCC=C)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""6E7A2E7FA1AA7C79_9BF43E0D02A9CE69_6031_UN""","""CN(C(C(=O)OCCC#C)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""59CE6A861F3CA26F_819E4DD1C2ACD4A6_6031_UN""","""CN(C(C(=O)OCCCCl)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""37C75CCEB958DABD_2F64C34481CBF209_6031_UN""","""CN(C(C(=O)OCCC#N)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""09C32359F651CE36_50129E1FF860FA21_6031_UN""","""CN(C(C(=O)OCC(F)Br)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""1120636133B8F904_E7F41E46EDBC3213_6031_DP""","""CN(C(C(=O)OCCNN)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""09BFCC00C8FF9053_188780C176EB1D18_6031_UN""","""CN(C(C(=O)OCC(=C)F)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""B1FA687F7361CFF3_1C4FC4DC9402E9BD_6031_UN""","""CN(C(C(=O)OCC=CBr)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""EC3FDB850842CA88_8E8B69D5E24096A8_6031_DP""","""CN(C(C(=O)OCCCO)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""5D8510D4F6A29296_609006CD5F9DB78F_6031_UN""","""CN(C(C(=O)OCCOC)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""A281E37695BA0F00_3494916DDE88A93B_6031_UN""","""CN(C(C(=O)OC[C@@H]1CO1)C2=C(C=CC=C2F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""B22FFE25C78339B8_D39BC0E4504CE21C_6031_UN""","""CN(C(C(=O)OC[C@H]1CO1)C2=C(C=CC=C2F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""DDC21A6AA9164850_3DA243EC11E7B178_6031_UN""","""CN(C(C(=O)OCC1CO1)C2=C(C=CC=C2F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""F1DAD151EEC4A528_39E22530890964AB_6031_UN""","""CN(C(C(=O)OCC(Cl)Cl)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""B530BCE786CC45D5_6E1E1522CEE250D2_6031_UN""","""CN(C(C(=O)OCC(=C)Cl)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""B09D2255CA9998ED_09F1AE3A9123ED6A_6031_UN""","""CN(C(C(=O)OCC(C)F)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""51FD9C56BBEDDBB4_B7BDA727E7C67C8D_6031_UN""","""CN(C(C(=O)OCC=CCl)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
+"""1C173BA2CB6EE395_2935F265DD856F36_6031_UN""","""CN(C(C(=O)OCC(C)Br)C1=C(C=CC=C1F)Cl)C(=O)C""",21,"""51C1509A44178F14"""
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+"""FDFC04B8AD361589_746CAB01067CEE71_6004_UN""","""COC(=O)C2=C1SC(=NC1=C(C=C2)C3=CC(=CC=C3)Cl)N""",21,"""52AEE2643903B35D"""
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+"""0B36CD65E6352D3D_D106C90B20CB1937_6004_UN""","""COC(=O)C2=C1SC(=NC1=C(C=C2)C3=C(N)N=CC=C3)N""",21,"""52AEE2643903B35D"""
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+"""F4D2F36CA0EFFC8A_4E8E271EB5B004AA_6004_DP""","""COC(=O)C2=C1SC(=NC1=C(C=C2)C3=CC=C(O)C=C3)N""",21,"""52AEE2643903B35D"""
+"""9F873BE1401BCA63_58628634FAE5C8EA_6004_UN""","""COC(=O)C2=C1SC(=NC1=C(C=C2)C3=CC=C(C#N)O3)N""",21,"""52AEE2643903B35D"""
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+"""D917828EA1C0E94B_DB6360BA23D336A0_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC(=C)Br)Cl)OC""",21,"""53C2463514E19950"""
+"""1109D89326759F79_F15100334F92C3B9_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OC[C@@H](C)N)Cl)OC""",21,"""53C2463514E19950"""
+"""CFEB601CBA499FB9_C00A3CC38E29543B_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OC[CH]=[C]=[CH2])Cl)OC""",21,"""53C2463514E19950"""
+"""71FD785BEC660BE4_37D228EF443DC076_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC#CBr)Cl)OC""",21,"""53C2463514E19950"""
+"""814872F01A7EF946_B99611DA90A558F8_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC(C)Cl)Cl)OC""",21,"""53C2463514E19950"""
+"""54457F4EA900A256_A92F7E5827835745_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCCF)Cl)OC""",21,"""53C2463514E19950"""
+"""E9DB63CE060C3979_2DEC67E1D681B4DF_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC(N)=S)Cl)OC""",21,"""53C2463514E19950"""
+"""D526C2C75658C388_2C74BA07AC496AF8_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCCS)Cl)OC""",21,"""53C2463514E19950"""
+"""AD966427EFDBBE59_53859A5576826A96_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCCC)Cl)OC""",21,"""53C2463514E19950"""
+"""C956D4CE563C6370_D1E753A3B4D4FE62_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCCN)Cl)OC""",21,"""53C2463514E19950"""
+"""036C39513F4BBA02_71E6D44141643FD1_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCCBr)Cl)OC""",21,"""53C2463514E19950"""
+"""CBA50C744BF2EAAE_343AE0F6E4C293F1_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC(C)C)Cl)OC""",21,"""53C2463514E19950"""
+"""5147EC15255A2755_06703E37EF510B46_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC2CC2)Cl)OC""",21,"""53C2463514E19950"""
+"""0218C9B5B550BFBC_58FF82F9944DD841_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCC=C)Cl)OC""",21,"""53C2463514E19950"""
+"""ED3B2922D7134683_99F728A2525FD82D_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCC#C)Cl)OC""",21,"""53C2463514E19950"""
+"""DF99C7497AAAF310_839D5B7E925AC2E2_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCCCl)Cl)OC""",21,"""53C2463514E19950"""
+"""0B0A9DBE19162F1F_2D67D5EBD13DE44D_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCC#N)Cl)OC""",21,"""53C2463514E19950"""
+"""6D3D28BDC5C4405A_521188B0A896EC65_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC(F)Br)Cl)OC""",21,"""53C2463514E19950"""
+"""721E3489FDA4289F_E5F708E9BD4A2457_6031_DP""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCNN)Cl)OC""",21,"""53C2463514E19950"""
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+"""994BECFFDF0395E4_1E4CD273C4F4FFF9_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC=CBr)Cl)OC""",21,"""53C2463514E19950"""
+"""DF6E2A8A419272B4_8C887F7AB2B680EC_6031_DP""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCCO)Cl)OC""",21,"""53C2463514E19950"""
+"""9C308254992631C1_629310620F6BA1CB_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCOC)Cl)OC""",21,"""53C2463514E19950"""
+"""27645363480502C6_369787C28E7EBF7F_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OC[C@@H]2CO2)Cl)OC""",21,"""53C2463514E19950"""
+"""0BC74FBC16EFD041_D198D64B00BAF458_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OC[C@H]2CO2)Cl)OC""",21,"""53C2463514E19950"""
+"""04BD1B4FF102357E_3FA155434111A73C_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC2CO2)Cl)OC""",21,"""53C2463514E19950"""
+"""280EFA6D15F20A05_3BE1339FD9FF72EF_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC(Cl)Cl)Cl)OC""",21,"""53C2463514E19950"""
+"""7DA026935939B91E_6C1D038D9E144696_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC(=C)Cl)Cl)OC""",21,"""53C2463514E19950"""
+"""87D75B49183E6D92_0BF2B895C1D5FB2E_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC(C)F)Cl)OC""",21,"""53C2463514E19950"""
+"""60879B351221B1D8_B5BEB188B7306AC9_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC=CCl)Cl)OC""",21,"""53C2463514E19950"""
+"""3EE7ADD2EF617136_2B36E4CA8D737972_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCC(C)Br)Cl)OC""",21,"""53C2463514E19950"""
+"""BE21533B21ED773B_FE9682DEA06DEE30_6031_UN""","""CCOC1=C(C(=CC(=C1)C=CC(=O)OCCCI)Cl)OC""",21,"""53C2463514E19950"""
+"""A7DDD08DBF31855B_592BC6B17B20B859_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCC(C)=C""",21,"""554AB4915CDAAEDA"""
+"""C1D943733ADA6DD5_4535B652A4AE68F8_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCC(F)F""",21,"""554AB4915CDAAEDA"""
+"""21E6DDBC3DEA025C_FDD05AD3F02353A3_6031_DP""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCCNC""",21,"""554AB4915CDAAEDA"""
+"""9ADC9FDBF2C77B31_F9F097A112AC08CD_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OC[C@H](C)N""",21,"""554AB4915CDAAEDA"""
+"""D61FCD32745954EE_25A4E637064C600E_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCC(C)S""",21,"""554AB4915CDAAEDA"""
+"""76D624F0D19E6A87_5886120F528D6503_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCCSC""",21,"""554AB4915CDAAEDA"""
+"""0B4EBC82926009B5_1B5E18DA82E99C74_6031_DP""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCC(C)N""",21,"""554AB4915CDAAEDA"""
+"""A1EB320ECC56F75B_4FE13750F51509F5_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCC#CC""",21,"""554AB4915CDAAEDA"""
+"""BE1F028236F1A609_DA9000FE8F01BA2A_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCCON""",21,"""554AB4915CDAAEDA"""
+"""F01C30916B638DD2_DDEB921E6BE8012A_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCC(=C)Br""",21,"""554AB4915CDAAEDA"""
+"""F9BAAEFBE4BF1A59_F7D9F29707A9F433_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OC[C@@H](C)N""",21,"""554AB4915CDAAEDA"""
+"""7AC37B4A49AC075D_C682CE67C61263B1_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OC[CH]=[C]=[CH2]""",21,"""554AB4915CDAAEDA"""
+"""4FCC767C1BD14E17_315ADA4B0C06F7FC_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCC#CBr""",21,"""554AB4915CDAAEDA"""
+"""DB381670CBA51639_BF1EE37ED89E6F72_6031_UN""","""CC(C)[N]1N=CC=C1C23CC(CC2)C3C(=O)OCC(C)Cl""",21,"""554AB4915CDAAEDA"""
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+"""1937C074F20E97CB_55A79AC5A3163825_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC(C)=C""",21,"""59C6E8E584EC2EA6"""
+"""F91591B5D2CBDC36_49B9EA267C98E884_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC(F)F""",21,"""59C6E8E584EC2EA6"""
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+"""AE4797C51CEEFD5B_2928BA43DE7AE072_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC(C)S""",21,"""59C6E8E584EC2EA6"""
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+"""6D70FA11AD98BFDE_436D6B242D238989_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC#CC""",21,"""59C6E8E584EC2EA6"""
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+"""2B3CEDDF26523327_FB55AEE3DF9F744F_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OC[C@@H](C)N""",21,"""59C6E8E584EC2EA6"""
+"""C8B06743614726E5_CA0E92131E24E3CD_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OC[CH]=[C]=[CH2]""",21,"""59C6E8E584EC2EA6"""
+"""352CAE03707FE13E_3DD6863FD4307780_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC#CBr""",21,"""59C6E8E584EC2EA6"""
+"""46AA4D90E29F84D3_B392BF0A00A8EF0E_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC(C)Cl""",21,"""59C6E8E584EC2EA6"""
+"""248130A309A78691_A32BD088B78EE0B3_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCCF""",21,"""59C6E8E584EC2EA6"""
+"""9297CA1ED48F7AB6_27E8C931468C0329_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC(N)=S""",21,"""59C6E8E584EC2EA6"""
+"""7EF0573656204D79_267014D73C44DD0E_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCCS""",21,"""59C6E8E584EC2EA6"""
+"""4D78A6E5FBF88495_59813485E68FDD60_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCCC""",21,"""59C6E8E584EC2EA6"""
+"""EB5A4F686E0B15E2_DBE3FD7324D94994_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCCN""",21,"""59C6E8E584EC2EA6"""
+"""8788078ECEFBB1A0_7BE27A91D1698827_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCCBr""",21,"""59C6E8E584EC2EA6"""
+"""EDA0BB3A78649314_3E3E4E2674CF2407_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC(C)C""",21,"""59C6E8E584EC2EA6"""
+"""CBF6DD796B10264D_0C7490E77F5CBCB0_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC3CC3""",21,"""59C6E8E584EC2EA6"""
+"""B4B7B18843D5EF6F_52FB2C2904406FB7_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCC=C""",21,"""59C6E8E584EC2EA6"""
+"""C5BC57ADB397BC7A_93F38672C2526FDB_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCC#C""",21,"""59C6E8E584EC2EA6"""
+"""51811C1FF6EEDF46_8999F5AE02577514_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCCCl""",21,"""59C6E8E584EC2EA6"""
+"""0D6AFE9BE13CF45F_27637B3B413053BB_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCC#N""",21,"""59C6E8E584EC2EA6"""
+"""EEFCFED101FAD399_58152660389B5B93_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC(F)Br""",21,"""59C6E8E584EC2EA6"""
+"""3B0303668FA89913_EFF3A6392D4793A1_6031_DP""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCNN""",21,"""59C6E8E584EC2EA6"""
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+"""95641986929D7340_3C9329121E730889_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OC[C@@H]3CO3""",21,"""59C6E8E584EC2EA6"""
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+"""B4A409B164F92D13_6619AD5D0E19F160_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC(=C)Cl""",21,"""59C6E8E584EC2EA6"""
+"""C025C09AF88A0F95_01F6164551D84CD8_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCC(C)F""",21,"""59C6E8E584EC2EA6"""
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+"""F0B0936150A9B0E0_F4922C0E306059C6_6031_UN""","""NC(CC1=C[N](N=N1)C2=CC=CC=C2)C(=O)OCCCI""",21,"""59C6E8E584EC2EA6"""
+"""B93D87A4F9D92CDD_573151FF35DBC887_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(C)=C""",21,"""5B5023DF1221DE04"""
+"""EE4A4DEF48AC005A_4B2F211CEA551826_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(F)F""",21,"""5B5023DF1221DE04"""
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+"""28C6982577B9065B_2BBE717948B710D0_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(C)S""",21,"""5B5023DF1221DE04"""
+"""3EEF73371D35B166_569C85411C7615DD_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCSC""",21,"""5B5023DF1221DE04"""
+"""DE4244800E90F12E_15448F94CC12ECAA_6031_DP""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(C)N""",21,"""5B5023DF1221DE04"""
+"""F3245F0DE516A95F_41FBA01EBBEE792B_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC#CC""",21,"""5B5023DF1221DE04"""
+"""B15DD85F062FEB0C_D48A97B0C1FACAF4_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCON""",21,"""5B5023DF1221DE04"""
+"""AA00BD7526505033_D3F10550251371F4_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(=C)Br""",21,"""5B5023DF1221DE04"""
+"""7124A2ED54A5B0E4_F9C365D9495284ED_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OC[C@@H](C)N""",21,"""5B5023DF1221DE04"""
+"""1D6F3E16F8397919_C898592988E9136F_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OC[CH]=[C]=[CH2]""",21,"""5B5023DF1221DE04"""
+"""DC262791DEE6667D_3F404D0542FD8722_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC#CBr""",21,"""5B5023DF1221DE04"""
+"""D3A945642DB744F8_B104743096651FAC_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(C)Cl""",21,"""5B5023DF1221DE04"""
+"""A829FE8174FA4337_A1BD1BB221431011_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCCF""",21,"""5B5023DF1221DE04"""
+"""7AE756171D1135E2_257E020BD041F38B_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(N)=S""",21,"""5B5023DF1221DE04"""
+"""8540B92C00A0B3E2_24E6DFEDAA892DAC_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCCS""",21,"""5B5023DF1221DE04"""
+"""10081273A5CD3BAF_5B17FFBF70422DC2_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCCC""",21,"""5B5023DF1221DE04"""
+"""DAD69F6149E14453_D9753649B214B936_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCCN""",21,"""5B5023DF1221DE04"""
+"""F904D23792885E04_7974B1AB47A47885_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCCBr""",21,"""5B5023DF1221DE04"""
+"""082493728AE7D825_3CA8851CE202D4A5_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(C)C""",21,"""5B5023DF1221DE04"""
+"""E0E5D950BE71F734_0EE25BDDE9914C12_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC3CC3""",21,"""5B5023DF1221DE04"""
+"""E809820842A21BC3_506DE713928D9F15_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCC=C""",21,"""5B5023DF1221DE04"""
+"""A61DB424DA74F840_91654D48549F9F79_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCC#C""",21,"""5B5023DF1221DE04"""
+"""87A5F882E859CD2D_8B0F3E94949A85B6_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCCCl""",21,"""5B5023DF1221DE04"""
+"""8FB05EA0EB62790A_25F5B001D7FDA319_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCC#N""",21,"""5B5023DF1221DE04"""
+"""9A2BDA363091C350_5A83ED5AAE56AB31_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(F)Br""",21,"""5B5023DF1221DE04"""
+"""6C4FED874A3D854D_ED656D03BB8A6303_6031_DP""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCNN""",21,"""5B5023DF1221DE04"""
+"""A6D385C9B8407C1F_1216F38420DD4C08_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(=C)F""",21,"""5B5023DF1221DE04"""
+"""8323A5ECDD656AC9_16DEB799C234B8AD_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC=CBr""",21,"""5B5023DF1221DE04"""
+"""3D7B3997BD914554_841A1A90B476C7B8_6031_DP""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCCO""",21,"""5B5023DF1221DE04"""
+"""CD61A0978A478E0E_6A01758809ABE69F_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCOC""",21,"""5B5023DF1221DE04"""
+"""1C3B317931B94574_3E05E22888BEF82B_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OC[C@@H]3CO3""",21,"""5B5023DF1221DE04"""
+"""50EFC51F04A5EFF5_D90AB3A1067AB30C_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OC[C@H]3CO3""",21,"""5B5023DF1221DE04"""
+"""DDBED6A76B59F6CB_373330A947D1E068_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC3CO3""",21,"""5B5023DF1221DE04"""
+"""45EA155A8D6DD8B4_33735675DF3F35BB_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(Cl)Cl""",21,"""5B5023DF1221DE04"""
+"""264EC646278D8BE4_648F666798D401C2_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(=C)Cl""",21,"""5B5023DF1221DE04"""
+"""01063D0D398D078C_0360DD7FC715BC7A_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(C)F""",21,"""5B5023DF1221DE04"""
+"""395D009518EA9711_BD2CD462B1F02D9D_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC=CCl""",21,"""5B5023DF1221DE04"""
+"""4175F344B6742C97_23A481208BB33E26_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCC(C)Br""",21,"""5B5023DF1221DE04"""
+"""0116A3D65921CD76_F604E734A6ADA964_6031_UN""","""COC1=CC(=CC=C1)C2=CN=C(N=C2)C(=O)OCCCI""",21,"""5B5023DF1221DE04"""
+"""B0357AC2954C8EA5_500C36B92C7318D7_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(C)=C)F""",21,"""5C6D44990B890E54"""
+"""E2829A76645282BA_4C12465AF3FDC876_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(F)F)F""",21,"""5C6D44990B890E54"""
+"""A8521A7F8357E5DD_F4F7AADBA770F32D_6031_DP""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCNC)F""",21,"""5C6D44990B890E54"""
+"""D983795096EF3E87_F0D767A945FFA843_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OC[C@H](C)N)F""",21,"""5C6D44990B890E54"""
+"""C2B5D9E90A9DE9C8_2C83163F511FC080_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(C)S)F""",21,"""5C6D44990B890E54"""
+"""95A61725CA0A3A1D_51A1E20705DEC58D_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCSC)F""",21,"""5C6D44990B890E54"""
+"""D9E2BF3D8EF4C146_1279E8D2D5BA3CFA_6031_DP""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(C)N)F""",21,"""5C6D44990B890E54"""
+"""2489A71073783C78_46C6C758A246A97B_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC#CC)F""",21,"""5C6D44990B890E54"""
+"""0449E6BCDF404694_D3B7F0F6D8521AA4_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCON)F""",21,"""5C6D44990B890E54"""
+"""FDFAFEFE9E33DFEC_D4CC62163CBBA1A4_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(=C)Br)F""",21,"""5C6D44990B890E54"""
+"""668E007057406783_FEFE029F50FA54BD_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OC[C@@H](C)N)F""",21,"""5C6D44990B890E54"""
+"""E42A1C466E416383_CFA53E6F9141C33F_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OC[CH]=[C]=[CH2])F""",21,"""5C6D44990B890E54"""
+"""85AC73339F79A920_387D2A435B555772_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC#CBr)F""",21,"""5C6D44990B890E54"""
+"""9994DA3C9130ED84_B63913768FCDCFFC_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(C)Cl)F""",21,"""5C6D44990B890E54"""
+"""F3638D5663F3DBEA_A6807CF438EBC041_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCCF)F""",21,"""5C6D44990B890E54"""
+"""6F6DE10A0950E9BD_2243654DC9E923DB_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(N)=S)F""",21,"""5C6D44990B890E54"""
+"""0B7E9E8C488BDD9D_23DBB8ABB321FDFC_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCCS)F""",21,"""5C6D44990B890E54"""
+"""41CB4593D1E62714_5C2A98F969EAFD92_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCCC)F""",21,"""5C6D44990B890E54"""
+"""DD6DB4D795D1B8FC_DE48510FABBC6966_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCCN)F""",21,"""5C6D44990B890E54"""
+"""60BEB02576586370_7E49D6ED5E0CA8D5_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCCBr)F""",21,"""5C6D44990B890E54"""
+"""E732A528157EBEC7_3B95E25AFBAA04F5_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(C)C)F""",21,"""5C6D44990B890E54"""
+"""5BB66389BE628F12_09DF3C9BF0399C42_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC2CC2)F""",21,"""5C6D44990B890E54"""
+"""A81E02533400804F_575080558B254F45_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCC=C)F""",21,"""5C6D44990B890E54"""
+"""7004F41AD4B5E7D0_96582A0E4D374F29_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCC#C)F""",21,"""5C6D44990B890E54"""
+"""E9C047F23F40331F_8C3259D28D3255E6_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCCCl)F""",21,"""5C6D44990B890E54"""
+"""5157360EBDA53DF6_22C8D747CE557349_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCC#N)F""",21,"""5C6D44990B890E54"""
+"""649F04499BD11DA7_5DBE8A1CB7FE7B61_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(F)Br)F""",21,"""5C6D44990B890E54"""
+"""D81644483C734922_EA580A45A222B353_6031_DP""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCNN)F""",21,"""5C6D44990B890E54"""
+"""8F87B52FAA9F8548_152B94C239759C58_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(=C)F)F""",21,"""5C6D44990B890E54"""
+"""19F1F7CDC8C2A352_11E3D0DFDB9C68FD_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC=CBr)F""",21,"""5C6D44990B890E54"""
+"""D8040AB08F494978_83277DD6ADDE17E8_6031_DP""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCCO)F""",21,"""5C6D44990B890E54"""
+"""C4983DC0CE0F803D_6D3C12CE100336CF_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCOC)F""",21,"""5C6D44990B890E54"""
+"""92C35201A4253233_3938856E9116287B_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OC[C@@H]2CO2)F""",21,"""5C6D44990B890E54"""
+"""394F22BFA3DA02DF_DE37D4E71FD2635C_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OC[C@H]2CO2)F""",21,"""5C6D44990B890E54"""
+"""DA425FB72EF03524_300E57EF5E793038_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC2CO2)F""",21,"""5C6D44990B890E54"""
+"""EF98E9D307044401_344E3133C697E5EB_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(Cl)Cl)F""",21,"""5C6D44990B890E54"""
+"""82C852D1D7BE001D_63B20121817CD192_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(=C)Cl)F""",21,"""5C6D44990B890E54"""
+"""E6B8A12F4898D46C_045DBA39DEBD6C2A_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(C)F)F""",21,"""5C6D44990B890E54"""
+"""6133ADF963F67E72_BA11B324A858FDCD_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC=CCl)F""",21,"""5C6D44990B890E54"""
+"""985CA0AD2BD97878_2499E666921BEE76_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCC(C)Br)F""",21,"""5C6D44990B890E54"""
+"""B854CD024734D4EE_F1398072BF057934_6031_UN""","""COC1=C(C=C(C=C1)C(=O)CCCC(=O)OCCCI)F""",21,"""5C6D44990B890E54"""
+"""F86768F7EF40C21D_523019DB7C80CE9D_6031_UN""","""CC[N]1C=C(C(=C1C)C(=O)OCC(C)=C)C2=CC=CC=C2""",21,"""5E516BFB5B7AD81E"""
+"""6354438B7BDD51F2_4E2E6938A30E1E3C_6031_UN""","""CC[N]1C=C(C(=C1C)C(=O)OCC(F)F)C2=CC=CC=C2""",21,"""5E516BFB5B7AD81E"""
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+"""2B00143A73FD9822_4E0C4BAA61852007_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(F)F)OC(C)C""",21,"""5E73496999F1E625"""
+"""F03902B7ADFC5A1E_F6E9A72B35081B5C_6031_DP""","""COC1=C(C=CC(=C1)C=CC(=O)OCCNC)OC(C)C""",21,"""5E73496999F1E625"""
+"""B042A7CA0C219743_F2C96A59D7874032_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OC[C@H](C)N)OC(C)C""",21,"""5E73496999F1E625"""
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+"""E08A0801CE5E3983_53BFEFF797A62DFC_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCSC)OC(C)C""",21,"""5E73496999F1E625"""
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+"""8DEBDF9EC21C21B4_44D8CAA8303E410A_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC#CC)OC(C)C""",21,"""5E73496999F1E625"""
+"""7E1585730BE67DE9_D1A9FD064A2AF2D5_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCON)OC(C)C""",21,"""5E73496999F1E625"""
+"""BC4142CFA95A1751_D6D26FE6AEC349D5_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(=C)Br)OC(C)C""",21,"""5E73496999F1E625"""
+"""24B447F75F14250A_FCE00F6FC282BCCC_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OC[C@@H](C)N)OC(C)C""",21,"""5E73496999F1E625"""
+"""F058062E838281A8_CDBB339F03392B4E_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OC[CH]=[C]=[CH2])OC(C)C""",21,"""5E73496999F1E625"""
+"""B54BC8E6C7E80890_3A6327B3C92DBF03_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC#CBr)OC(C)C""",21,"""5E73496999F1E625"""
+"""B16E3DDE5885445E_B4271E861DB5278D_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(C)Cl)OC(C)C""",21,"""5E73496999F1E625"""
+"""B2D1E94B850CF1EF_A49E7104AA932830_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCF)OC(C)C""",21,"""5E73496999F1E625"""
+"""49491185658652F0_205D68BD5B91CBAA_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(N)=S)OC(C)C""",21,"""5E73496999F1E625"""
+"""F0F952F6BEBD484A_21C5B55B2159158D_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCS)OC(C)C""",21,"""5E73496999F1E625"""
+"""98655023CA87A5A0_5E349509FB9215E3_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCC)OC(C)C""",21,"""5E73496999F1E625"""
+"""2E105CF1DFE04926_DC565CFF39C48117_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCN)OC(C)C""",21,"""5E73496999F1E625"""
+"""B00A620928AC4572_7C57DB1DCC7440A4_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCBr)OC(C)C""",21,"""5E73496999F1E625"""
+"""91F5C80C944BAF15_398BEFAA69D2EC84_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(C)C)OC(C)C""",21,"""5E73496999F1E625"""
+"""3E1B89CA6B2C9F8A_0BC1316B62417433_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC2CC2)OC(C)C""",21,"""5E73496999F1E625"""
+"""0C2640AD2048402F_554E8DA5195DA734_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCC=C)OC(C)C""",21,"""5E73496999F1E625"""
+"""2D53DA5237D18A6E_944627FEDF4FA758_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCC#C)OC(C)C""",21,"""5E73496999F1E625"""
+"""6FB1A870118B7817_8E2C54221F4ABD97_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCCl)OC(C)C""",21,"""5E73496999F1E625"""
+"""B6DD22520C599B38_20D6DAB75C2D9B38_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCC#N)OC(C)C""",21,"""5E73496999F1E625"""
+"""48347036631DAD97_5FA087EC25869310_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(F)Br)OC(C)C""",21,"""5E73496999F1E625"""
+"""78BE2FC9B0B34CF7_E84607B5305A5B22_6031_DP""","""COC1=C(C=CC(=C1)C=CC(=O)OCCNN)OC(C)C""",21,"""5E73496999F1E625"""
+"""D11C794BB4EC23BF_17359932AB0D7429_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(=C)F)OC(C)C""",21,"""5E73496999F1E625"""
+"""6ECA9C21061F5AAA_13FDDD2F49E4808C_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC=CBr)OC(C)C""",21,"""5E73496999F1E625"""
+"""D8BD1650EAB101E7_813970263FA6FF99_6031_DP""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCO)OC(C)C""",21,"""5E73496999F1E625"""
+"""792AED5ACC44C383_6F221F3E827BDEBE_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCOC)OC(C)C""",21,"""5E73496999F1E625"""
+"""D574E4BF694FD48D_3B26889E036EC00A_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OC[C@@H]2CO2)OC(C)C""",21,"""5E73496999F1E625"""
+"""0859BEE9FAF09F9B_DC29D9178DAA8B2D_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OC[C@H]2CO2)OC(C)C""",21,"""5E73496999F1E625"""
+"""68767128872B9F43_32105A1FCC01D849_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC2CO2)OC(C)C""",21,"""5E73496999F1E625"""
+"""DE464490FA155B1F_36503CC354EF0D9A_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(Cl)Cl)OC(C)C""",21,"""5E73496999F1E625"""
+"""815F725FF54FEF6B_61AC0CD1130439E3_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(=C)Cl)OC(C)C""",21,"""5E73496999F1E625"""
+"""13381E9CCA7884CB_0643B7C94CC5845B_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(C)F)OC(C)C""",21,"""5E73496999F1E625"""
+"""86A7BFF3A20075D8_B80FBED43A2015BC_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC=CCl)OC(C)C""",21,"""5E73496999F1E625"""
+"""D356586BA0A08143_2687EB9600630607_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(C)Br)OC(C)C""",21,"""5E73496999F1E625"""
+"""D9DDCA1756FD7565_F3278D822D7D9145_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCI)OC(C)C""",21,"""5E73496999F1E625"""
+"""4D8AF28C30BB3821_53344FEE6FDCD39D_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(C)=C""",21,"""5F553DCE4826C51E"""
+"""8015B5EE04DE3731_4F2A3F0DB052033C_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(F)F""",21,"""5F553DCE4826C51E"""
+"""DD69965F73AEDF6B_F7CFD38CE4DF3867_6031_DP""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCNC""",21,"""5F553DCE4826C51E"""
+"""8F577B81D98584BD_F3EF1EFE06506309_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OC[C@H](C)N""",21,"""5F553DCE4826C51E"""
+"""63259D2A649952FA_2FBB6F6812B00BCA_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(C)S""",21,"""5F553DCE4826C51E"""
+"""6A9C5FFC313925BC_52999B5046710EC7_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCSC""",21,"""5F553DCE4826C51E"""
+"""51DA5E9D842164BE_114191859615F7B0_6031_DP""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(C)N""",21,"""5F553DCE4826C51E"""
+"""B6362852015D2D7B_45FEBE0FE1E96231_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC#CC""",21,"""5F553DCE4826C51E"""
+"""60D42B06D66B5DCA_D08F89A19BFDD1EE_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCON""",21,"""5F553DCE4826C51E"""
+"""85925591CEEDBBA7_D7F41B417F146AEE_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(=C)Br""",21,"""5F553DCE4826C51E"""
+"""0831D335463EB1C3_FDC67BC813559FF7_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OC[C@@H](C)N""",21,"""5F553DCE4826C51E"""
+"""B5EA3C6794E444DB_CC9D4738D2EE0875_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OC[CH]=[C]=[CH2]""",21,"""5F553DCE4826C51E"""
+"""48F18294B6CA6880_3B45531418FA9C38_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC#CBr""",21,"""5F553DCE4826C51E"""
+"""87C4E3C2EFA8EC7D_B5016A21CC6204B6_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(C)Cl""",21,"""5F553DCE4826C51E"""
+"""4DAB8C703FC82310_A5B805A37B440B0B_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCCF""",21,"""5F553DCE4826C51E"""
+"""72B62E597360CD00_217B1C1A8A46E891_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(N)=S""",21,"""5F553DCE4826C51E"""
+"""945A7EB54F361A4C_20E3C1FCF08E36B6_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCCS""",21,"""5F553DCE4826C51E"""
+"""59E0D420C1EB4F8A_5F12E1AE2A4536D8_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCCC""",21,"""5F553DCE4826C51E"""
+"""F5C8B90DF558BF56_DD702858E813A22C_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCCN""",21,"""5F553DCE4826C51E"""
+"""4A94E2A67B483170_7D71AFBA1DA3639F_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCCBr""",21,"""5F553DCE4826C51E"""
+"""47AC9CD1D899FA63_38AD9B0DB805CFBF_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(C)C""",21,"""5F553DCE4826C51E"""
+"""4493CF957BDAC453_0AE745CCB3965708_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC3CC3""",21,"""5F553DCE4826C51E"""
+"""30C360C6AF088711_5468F902C88A840F_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCC=C""",21,"""5F553DCE4826C51E"""
+"""A70D623624405CFE_956053590E988463_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCC#C""",21,"""5F553DCE4826C51E"""
+"""ECF53A4B0529AE55_8F0A2085CE9D9EAC_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCCCl""",21,"""5F553DCE4826C51E"""
+"""39EF69CAF5979E86_21F0AE108DFAB803_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCC#N""",21,"""5F553DCE4826C51E"""
+"""1C9F45F1D0607F22_5E86F34BF451B02B_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(F)Br""",21,"""5F553DCE4826C51E"""
+"""A4A374CCD814071C_E9607312E18D7819_6031_DP""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCNN""",21,"""5F553DCE4826C51E"""
+"""971E923CC04013D6_1613ED957ADA5712_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(=C)F""",21,"""5F553DCE4826C51E"""
+"""9A26143FE713C9B3_12DBA9889833A3B7_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC=CBr""",21,"""5F553DCE4826C51E"""
+"""3B000762FAB5FC13_801F0481EE71DCA2_6031_DP""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCCO""",21,"""5F553DCE4826C51E"""
+"""7E93812A7ACD90B3_6E046B9953ACFD85_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCOC""",21,"""5F553DCE4826C51E"""
+"""3E087477A4476828_3A00FC39D2B9E331_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OC[C@@H]3CO3""",21,"""5F553DCE4826C51E"""
+"""6CC675EC4212EDD8_DD0FADB05C7DA816_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OC[C@H]3CO3""",21,"""5F553DCE4826C51E"""
+"""E6CC4963D60A68A6_33362EB81DD6FB72_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC3CO3""",21,"""5F553DCE4826C51E"""
+"""7667D2594A14CFE9_3776486485382EA1_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(Cl)Cl""",21,"""5F553DCE4826C51E"""
+"""5DBB4A1EFF54ADA1_608A7876C2D31AD8_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(=C)Cl""",21,"""5F553DCE4826C51E"""
+"""8C46B4654A711DFD_0765C36E9D12A760_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(C)F""",21,"""5F553DCE4826C51E"""
+"""6DD6E4AE222F8D2A_B929CA73EBF73687_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC=CCl""",21,"""5F553DCE4826C51E"""
+"""88D91A2C2C18A506_27A19F31D1B4253C_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCC(C)Br""",21,"""5F553DCE4826C51E"""
+"""1326A9329A5FB190_F201F925FCAAB27E_6031_UN""","""CCC1=C(N=C([NH]1)C2=CC=C(C=C2)Cl)C(=O)OCCCI""",21,"""5F553DCE4826C51E"""
+"""7BFAEFE0893873F9_6C686B0632483B98_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(C)=C""",21,"""6009192615B22D1B"""
+"""96FDB20B12EE5135_70761BE5EDC6EB39_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(F)F""",21,"""6009192615B22D1B"""
+"""947AE13350373B04_C893F764B94BD062_6031_DP""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCNC""",21,"""6009192615B22D1B"""
+"""8E7EB886C9034045_CCB33A165BC48B0C_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C[C@H](C)N""",21,"""6009192615B22D1B"""
+"""0BC6E631356C8462_10E74B804F24E3CF_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(C)S""",21,"""6009192615B22D1B"""
+"""1528EBE8B33E5275_6DC5BFB81BE5E6C2_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCSC""",21,"""6009192615B22D1B"""
+"""DD3C80ECA1F39B58_2E1DB56DCB811FB5_6031_DP""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(C)N""",21,"""6009192615B22D1B"""
+"""48BF50E990BFE750_7AA29AE7BC7D8A34_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC#CC""",21,"""6009192615B22D1B"""
+"""1CF289B885A07B0E_EFD3AD49C66939EB_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCON""",21,"""6009192615B22D1B"""
+"""7FF353BD8A26D26D_E8A83FA9228082EB_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(=C)Br""",21,"""6009192615B22D1B"""
+"""6657C667DEF244D1_C29A5F204EC177F2_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C[C@@H](C)N""",21,"""6009192615B22D1B"""
+"""0D8A2F67E764CE61_F3C163D08F7AE070_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C[CH]=[C]=[CH2]""",21,"""6009192615B22D1B"""
+"""8F009CA5F4F70EC3_041977FC456E743D_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC#CBr""",21,"""6009192615B22D1B"""
+"""0A8C4B3EB9D78E05_8A5D4EC991F6ECB3_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(C)Cl""",21,"""6009192615B22D1B"""
+"""469CE429FF311C50_9AE4214B26D0E30E_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCCF""",21,"""6009192615B22D1B"""
+"""3447E005335A8349_1E2738F2D7D20094_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(N)=S""",21,"""6009192615B22D1B"""
+"""0C1F67DD3F8DB5B2_1FBFE514AD1ADEB3_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCCS""",21,"""6009192615B22D1B"""
+"""F51FA7219644C1F3_604EC54677D1DEDD_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCCC""",21,"""6009192615B22D1B"""
+"""10D6779FAE0E0D22_E22C0CB0B5874A29_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCCN""",21,"""6009192615B22D1B"""
+"""561DC609A467D6B8_422D8B5240378B9A_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCCBr""",21,"""6009192615B22D1B"""
+"""938BC51C4EBBB5F8_07F1BFE5E59127BA_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(C)C""",21,"""6009192615B22D1B"""
+"""2A4AFB2A8C6E0B2D_35BB6124EE02BF0D_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC2CC2""",21,"""6009192615B22D1B"""
+"""0EA17DC56CD3C871_6B34DDEA951E6C0A_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCC=C""",21,"""6009192615B22D1B"""
+"""294DC4228BE7380E_AA3C77B1530C6C66_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCC#C""",21,"""6009192615B22D1B"""
+"""8A6A61749BE242DE_B056046D930976A9_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCCCl""",21,"""6009192615B22D1B"""
+"""C1521811BBB28C49_1EAC8AF8D06E5006_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCC#N""",21,"""6009192615B22D1B"""
+"""F67B99D6CF96D8B4_61DAD7A3A9C5582E_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(F)Br""",21,"""6009192615B22D1B"""
+"""A29C2DF15052FEF1_D63C57FABC19901C_6031_DP""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCNN""",21,"""6009192615B22D1B"""
+"""426380273AA2AE27_294FC97D274EBF17_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(=C)F""",21,"""6009192615B22D1B"""
+"""0DED296475E317ED_2D878D60C5A74BB2_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC=CBr""",21,"""6009192615B22D1B"""
+"""38DEE12039A38BD1_BF432069B3E534A7_6031_DP""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCCO""",21,"""6009192615B22D1B"""
+"""A137D9166FC0162B_51584F710E381580_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCOC""",21,"""6009192615B22D1B"""
+"""6E94054E72D8F86C_055CD8D18F2D0B34_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C[C@@H]2CO2""",21,"""6009192615B22D1B"""
+"""9C54B23FCC2144BC_E253895801E94013_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C[C@H]2CO2""",21,"""6009192615B22D1B"""
+"""7247C598605219E1_0C6A0A5040421377_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC2CO2""",21,"""6009192615B22D1B"""
+"""28A4EA20F5026E10_082A6C8CD8ACC6A4_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(Cl)Cl""",21,"""6009192615B22D1B"""
+"""420E36A11849DB41_5FD65C9E9F47F2DD_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(=C)Cl""",21,"""6009192615B22D1B"""
+"""0AF8C9AE2ED92474_3839E786C0864F65_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(C)F""",21,"""6009192615B22D1B"""
+"""13CA1D60742A73B7_8675EE9BB663DE82_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC=CCl""",21,"""6009192615B22D1B"""
+"""7F3AEB3D2CA9F0EF_18FDBBD98C20CD39_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(C)Br""",21,"""6009192615B22D1B"""
+"""FECA49D4B0C8C8A2_CD5DDDCDA13E5A7B_6031_UN""","""O(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CCCI""",21,"""6009192615B22D1B"""
+"""A8FB419119C4938B_6C382391F3156D0C_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC(C)=C)OCC""",21,"""605951B1D4EF7B8F"""
+"""EF21AC490EED00AA_702653722C9BBDAD_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC(F)F)OCC""",21,"""605951B1D4EF7B8F"""
+"""B0078B646687F29F_C8C3BFF3781686F6_6031_DP""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCNC)OCC""",21,"""605951B1D4EF7B8F"""
+"""3FB34D7895E85D09_CCE372819A99DD98_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OC[C@H](C)N)OCC""",21,"""605951B1D4EF7B8F"""
+"""CAEE7FA262BD369F_10B703178E79B55B_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC(C)S)OCC""",21,"""605951B1D4EF7B8F"""
+"""394721BC9F7AE02B_6D95F72FDAB8B056_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCSC)OCC""",21,"""605951B1D4EF7B8F"""
+"""8B81A1D6AAD4F6D0_2E4DFDFA0ADC4921_6031_DP""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC(C)N)OCC""",21,"""605951B1D4EF7B8F"""
+"""50ACA354BBA0A5A1_7AF2D2707D20DCA0_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC#CC)OCC""",21,"""605951B1D4EF7B8F"""
+"""8026F3CF6394FB2A_EF83E5DE07346F7F_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCON)OCC""",21,"""605951B1D4EF7B8F"""
+"""860FB0116F64EF6E_E8F8773EE3DDD47F_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC(=C)Br)OCC""",21,"""605951B1D4EF7B8F"""
+"""9E24DBD568BAFB53_C2CA17B78F9C2166_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OC[C@@H](C)N)OCC""",21,"""605951B1D4EF7B8F"""
+"""C06C1E734A4AF3AD_F3912B474E27B6E4_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OC[CH]=[C]=[CH2])OCC""",21,"""605951B1D4EF7B8F"""
+"""A2A056C4D5B434D2_04493F6B843322A9_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC#CBr)OCC""",21,"""605951B1D4EF7B8F"""
+"""8133ECDD0A00A0BA_8A0D065E50ABBA27_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC(C)Cl)OCC""",21,"""605951B1D4EF7B8F"""
+"""5E9BAE68C8776397_9AB469DCE78DB59A_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCCF)OCC""",21,"""605951B1D4EF7B8F"""
+"""7B2E2794E408E365_1E777065168F5600_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC(N)=S)OCC""",21,"""605951B1D4EF7B8F"""
+"""A8DC37547F2EC3EE_1FEFAD836C478827_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCCS)OCC""",21,"""605951B1D4EF7B8F"""
+"""7C4B38E4237DE9B2_601E8DD1B68C8849_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCCC)OCC""",21,"""605951B1D4EF7B8F"""
+"""87088F3C304E98DB_E27C442774DA1CBD_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCCN)OCC""",21,"""605951B1D4EF7B8F"""
+"""8F47084690F5AE02_427DC3C5816ADD0E_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCCBr)OCC""",21,"""605951B1D4EF7B8F"""
+"""55D8E6255D909D3B_07A1F77224CC712E_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC(C)C)OCC""",21,"""605951B1D4EF7B8F"""
+"""31211337F78B0118_35EB29B32F5FE999_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC2CC2)OCC""",21,"""605951B1D4EF7B8F"""
+"""2DD29610DBFEB267_6B64957D54433A9E_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCC=C)OCC""",21,"""605951B1D4EF7B8F"""
+"""ECF3E9CA300F0CE0_AA6C3F2692513AF2_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCC#C)OCC""",21,"""605951B1D4EF7B8F"""
+"""FFA7C7BD9AB24421_B0064CFA5254203D_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCCCl)OCC""",21,"""605951B1D4EF7B8F"""
+"""25AB6134F678647B_1EFCC26F11330692_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCCC#N)OCC""",21,"""605951B1D4EF7B8F"""
+"""ABCF4AAD0FEA85D7_618A9F3468980EBA_6031_UN""","""CCOC(C[N]1N=CC(=C1N)C(=O)OCC(F)Br)OCC""",21,"""605951B1D4EF7B8F"""
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+"""FBBB9A7B168CCD4E_E36274B9D5D924AB_6031_UN""","""COC1=C(C=C(C(=C1)OC)C=CC(=O)OC[C@H]2CO2)OC""",21,"""6138E4C7C18249A3"""
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+"""994F6ABA343C86F4_C32F02D593ABB574_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OC[C@@H](C)N)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
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+"""3280280FAD1AAEB0_9B517CBEFBBA2188_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCCCF)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
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+"""ED29835281DB6B1F_1E0AB8E170701C35_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCCCS)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""633A37556F1CB9A5_61FB98B3AABB1C5B_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCCCC)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
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+"""816D6FF73B0FBF2F_1F19D70D0D049280_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCCC#N)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""B38132B791F8E335_606F8A5674AF9AA8_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCC(F)Br)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
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+"""56BB3298D376BF82_2C32D09518CD8934_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCC=CBr)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""2378C323F6644C00_BEF67D9C6E8FF621_6031_DP""","""CCC1=NC2=C(C(=C1)C(=O)OCCCO)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""311CA48CDC5DE962_50ED1284D352D706_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCCOC)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""E857A0C6029A5E1C_04E985245247C9B2_6031_UN""","""CCC1=NC3=C(C(=C1)C(=O)OC[C@@H]2CO2)C(=NO3)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""DC96D62EA1057AF5_E3E6D4ADDC838295_6031_UN""","""CCC1=NC3=C(C(=C1)C(=O)OC[C@H]2CO2)C(=NO3)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""B11A712C00638E47_0DDF57A59D28D1F1_6031_UN""","""CCC1=NC3=C(C(=C1)C(=O)OCC2CO2)C(=NO3)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""EB39709B16921EBD_099F317905C60422_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCC(Cl)Cl)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""5FEF87FBCEEE8878_5E63016B422D305B_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCC(=C)Cl)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""E83A917352790810_398CBA731DEC8DE3_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCC(C)F)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
+"""0B4DB412A4C6F4F7_87C0B36E6B091C04_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCC=CCl)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
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+"""3F8D12BF8B8A2F3D_CCE880387C5498FD_6031_UN""","""CCC1=NC2=C(C(=C1)C(=O)OCCCI)C(=NO2)C(C)C""",21,"""61BC44D3C8D8EF9D"""
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+"""B440E675C5B9DD67_1E6BC1F3FDB2606B_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCCCS""",21,"""61DD3DC1451A93C3"""
+"""515FEF2665399763_619AE1A127796005_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCCCC""",21,"""61DD3DC1451A93C3"""
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+"""841AB65A05E27E36_43F9AFB5109F3542_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCCCBr""",21,"""61DD3DC1451A93C3"""
+"""096B1DAB6B762AE4_06259B02B5399962_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCC(C)C""",21,"""61DD3DC1451A93C3"""
+"""4A8D9A5FA495D89C_346F45C3BEAA01D5_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCC3CC3""",21,"""61DD3DC1451A93C3"""
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+"""C6E6666B6F20CC61_B182208AC3A1C871_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCCCCl""",21,"""61DD3DC1451A93C3"""
+"""455B06C92DDD4888_1F78AE1F80C6EEDE_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCCC#N""",21,"""61DD3DC1451A93C3"""
+"""022D6D286F946960_600EF344F96DE6F6_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCC(F)Br""",21,"""61DD3DC1451A93C3"""
+"""701DD9A1BCD3CAE9_D7E8731DECB12EC4_6031_DP""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCCNN""",21,"""61DD3DC1451A93C3"""
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+"""C886406BDEEC1BE0_2C53A987950FF56A_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCC=CBr""",21,"""61DD3DC1451A93C3"""
+"""4D9EB7D0C34F5601_BE97048EE34D8A7F_6031_DP""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCCCO""",21,"""61DD3DC1451A93C3"""
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+"""D8C620C0C6C8C5D3_0488FC36DF85B5EC_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OC[C@@H]3CO3""",21,"""61DD3DC1451A93C3"""
+"""AA410DB37B9F90CE_E387ADBF5141FECB_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OC[C@H]3CO3""",21,"""61DD3DC1451A93C3"""
+"""1635D9B1DF91DF6A_0DBE2EB710EAADAF_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCC3CO3""",21,"""61DD3DC1451A93C3"""
+"""591246A405A00F19_09FE486B8804787C_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCC(Cl)Cl""",21,"""61DD3DC1451A93C3"""
+"""4B12C4D2D2A776FA_5E027879CFEF4C05_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCC(=C)Cl""",21,"""61DD3DC1451A93C3"""
+"""7B944F6FF2287424_39EDC361902EF1BD_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCC(C)F""",21,"""61DD3DC1451A93C3"""
+"""E7D37E0638AA9567_87A1CA7CE6CB605A_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCC=CCl""",21,"""61DD3DC1451A93C3"""
+"""6406F4B3674211C2_19299F3EDC8873E1_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCC(C)Br""",21,"""61DD3DC1451A93C3"""
+"""E0D0B783A32E92EA_CC89F92AF196E4A3_6031_UN""","""CC(N2C(=O)C1=C(C=C(C=C1)Br)C2=O)C(=O)OCCCI""",21,"""61DD3DC1451A93C3"""
+"""F921D02E01ED8874_6E5CFE5DDA1E54B1_6031_UN""","""CCC2(CC(=O)OCC(C)=C)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""AD138C3886441470_72428EBE05908410_6031_UN""","""CCC2(CC(=O)OCC(F)F)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""3C7F2C03093AC90E_CAA7623F511DBF4B_6031_DP""","""CCC2(CC(=O)OCCNC)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""43DC797C073165D7_CE87AF4DB392E425_6031_UN""","""CCC2(CC(=O)OC[C@H](C)N)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""7D3DBA3B8953FDA7_12D3DEDBA7728CE6_6031_UN""","""CCC2(CC(=O)OCC(C)S)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""EF96DF1B486C2436_6FF12AE3F3B389EB_6031_UN""","""CCC2(CC(=O)OCCSC)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""71B3940D8F947E15_2C29203623D7709C_6031_DP""","""CCC2(CC(=O)OCC(C)N)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""F924DB4EB4B93181_78960FBC542BE51D_6031_UN""","""CCC2(CC(=O)OCC#CC)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""C67BDFA9588C0E48_EDE738122E3F56C2_6031_UN""","""CCC2(CC(=O)OCCON)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""D2E0C2190AC5E0AF_EA9CAAF2CAD6EDC2_6031_UN""","""CCC2(CC(=O)OCC(=C)Br)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""66C68D7430D204CE_C0AECA7BA69718DB_6031_UN""","""CCC2(CC(=O)OC[C@@H](C)N)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""52AFBE910D2BEFF6_F1F5F68B672C8F59_6031_UN""","""CCC2(CC(=O)OC[CH]=[C]=[CH2])CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""469EA19630F90143_062DE2A7AD381B14_6031_UN""","""CCC2(CC(=O)OCC#CBr)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""031FDCF33EBC228F_8869DB9279A0839A_6031_UN""","""CCC2(CC(=O)OCC(C)Cl)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""3BD8DE92968EA343_98D0B410CE868C27_6031_UN""","""CCC2(CC(=O)OCCCF)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""806151B49DB366BB_1C13ADA93F846FBD_6031_UN""","""CCC2(CC(=O)OCC(N)=S)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""7E183E2CD05BD9FB_1D8B704F454CB19A_6031_UN""","""CCC2(CC(=O)OCCCS)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""081BF797BB67AE6C_627A501D9F87B1F4_6031_UN""","""CCC2(CC(=O)OCCCC)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""52FC6F00AD0ABA84_E01899EB5DD12500_6031_UN""","""CCC2(CC(=O)OCCCN)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""573F65B8A4B79B84_40191E09A861E4B3_6031_UN""","""CCC2(CC(=O)OCCCBr)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""2E4BEA2940E694D0_05C52ABE0DC74893_6031_UN""","""CCC2(CC(=O)OCC(C)C)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""D3CAE6F2D65385BE_378FF47F0654D024_6031_UN""","""CCC3(CC(=O)OCC1CC1)CC(=O)C2=C(C=CC=C2)C3""",21,"""623D8C7DFDE44232"""
+"""21DA0E054745FEE6_690048B17D480323_6031_UN""","""CCC2(CC(=O)OCCC=C)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""3DB5763CDD79AC9C_A808E2EABB5A034F_6031_UN""","""CCC2(CC(=O)OCCC#C)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""34908AF94B90A246_B26291367B5F1980_6031_UN""","""CCC2(CC(=O)OCCCCl)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""C2B8C69CFF8C3683_1C981FA338383F2F_6031_UN""","""CCC2(CC(=O)OCCC#N)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""690E0F2EC45C4D39_63EE42F841933707_6031_UN""","""CCC2(CC(=O)OCC(F)Br)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""E7D3CE4F366B5721_D408C2A1544FFF35_6031_DP""","""CCC2(CC(=O)OCCNN)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""64FCCE288EE70CD4_2B7B5C26CF18D03E_6031_UN""","""CCC2(CC(=O)OCC(=C)F)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""612E9E9155D06AF6_2FB3183B2DF1249B_6031_UN""","""CCC2(CC(=O)OCC=CBr)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""C3EF1A1E472EE433_BD77B5325BB35B8E_6031_DP""","""CCC2(CC(=O)OCCCO)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""8601251BE9BBBF0B_536CDA2AE66E7AA9_6031_UN""","""CCC2(CC(=O)OCCOC)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""BAFE8E1BC406D995_07684D8A677B641D_6031_UN""","""CCC3(CC(=O)OC[C@@H]1CO1)CC(=O)C2=C(C=CC=C2)C3""",21,"""623D8C7DFDE44232"""
+"""E04434C0CBBAAC89_E0671C03E9BF2F3A_6031_UN""","""CCC3(CC(=O)OC[C@H]1CO1)CC(=O)C2=C(C=CC=C2)C3""",21,"""623D8C7DFDE44232"""
+"""AB1AEC00DDBAAEB6_0E5E9F0BA8147C5E_6031_UN""","""CCC3(CC(=O)OCC1CO1)CC(=O)C2=C(C=CC=C2)C3""",21,"""623D8C7DFDE44232"""
+"""866DFDD2CC8B0719_0A1EF9D730FAA98D_6031_UN""","""CCC2(CC(=O)OCC(Cl)Cl)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""2758C6D0266962FF_5DE2C9C577119DF4_6031_UN""","""CCC2(CC(=O)OCC(=C)Cl)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""E2A1D42F1BC2C9A9_3A0D72DD28D0204C_6031_UN""","""CCC2(CC(=O)OCC(C)F)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""4DF5C835DD84894E_84417BC05E35B1AB_6031_UN""","""CCC2(CC(=O)OCC=CCl)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""E26BFBDEE08B807B_1AC92E826476A210_6031_UN""","""CCC2(CC(=O)OCC(C)Br)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""D4EF9DC34138F5A4_CF69489649683552_6031_UN""","""CCC2(CC(=O)OCCCI)CC(=O)C1=C(C=CC=C1)C2""",21,"""623D8C7DFDE44232"""
+"""A3224C08B894EC9C_682E83AB9FD0D08E_6031_UN""","""CC(=O)N2C=CC1=C(C=CC=C1)C2CC(=O)OCC(C)=C""",21,"""644FF18BB82AC60D"""
+"""C5CF600E594D5AD9_7430F348405E002F_6031_UN""","""CC(=O)N2C=CC1=C(C=CC=C1)C2CC(=O)OCC(F)F""",21,"""644FF18BB82AC60D"""
+"""86B468A8AFFDFC43_CCD51FC914D33B74_6031_DP""","""CC(=O)N2C=CC1=C(C=CC=C1)C2CC(=O)OCCNC""",21,"""644FF18BB82AC60D"""
+"""94BFA0574CA92F1D_C8F5D2BBF65C601A_6031_UN""","""CC(=O)N2C=CC1=C(C=CC=C1)C2CC(=O)OC[C@H](C)N""",21,"""644FF18BB82AC60D"""
+"""7494DA51A1ADD360_14A1A32DE2BC08D9_6031_UN""","""CC(=O)N2C=CC1=C(C=CC=C1)C2CC(=O)OCC(C)S""",21,"""644FF18BB82AC60D"""
+"""200C84BD37DA23E7_69835715B67D0DD4_6031_UN""","""CC(=O)N2C=CC1=C(C=CC=C1)C2CC(=O)OCCSC""",21,"""644FF18BB82AC60D"""
+"""72100D8FDC82D481_2A5B5DC06619F4A3_6031_DP""","""CC(=O)N2C=CC1=C(C=CC=C1)C2CC(=O)OCC(C)N""",21,"""644FF18BB82AC60D"""
+"""E007C216B222EB82_7EE4724A11E56122_6031_UN""","""CC(=O)N2C=CC1=C(C=CC=C1)C2CC(=O)OCC#CC""",21,"""644FF18BB82AC60D"""
+"""90CCD7E78F89BD81_EB9545E46BF1D2FD_6031_UN""","""CC(=O)N2C=CC1=C(C=CC=C1)C2CC(=O)OCCON""",21,"""644FF18BB82AC60D"""
+"""A9E8E8DD5DF1EFE1_ECEED7048F1869FD_6031_UN""","""CC(=O)N2C=CC1=C(C=CC=C1)C2CC(=O)OCC(=C)Br""",21,"""644FF18BB82AC60D"""
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+"""B7855F0822FAD98E_6567C0027C22813E_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCCC""",21,"""65201C621E4172F8"""
+"""EBD0C94574BDB4C8_E70509F4BE7415CA_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCCN""",21,"""65201C621E4172F8"""
+"""19284D161E934C74_47048E164BC4D479_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCCBr""",21,"""65201C621E4172F8"""
+"""8C42EAE7C08362C1_02D8BAA1EE627859_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC(C)C""",21,"""65201C621E4172F8"""
+"""2561B50F8BC84806_30926460E5F1E0EE_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC3CC3""",21,"""65201C621E4172F8"""
+"""B5C18A0AD3E88DB6_6E1DD8AE9EED33E9_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCC=C""",21,"""65201C621E4172F8"""
+"""79B7096E9457B15A_AF1572F558FF3385_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCC#C""",21,"""65201C621E4172F8"""
+"""2A3C0034319F288C_B57F012998FA294A_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCCCl""",21,"""65201C621E4172F8"""
+"""068BD33C31B55592_1B858FBCDB9D0FE5_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCC#N""",21,"""65201C621E4172F8"""
+"""4371E299A5EE32F5_64F3D2E7A23607CD_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC(F)Br""",21,"""65201C621E4172F8"""
+"""AC95A9C3A548A19D_D31552BEB7EACFFF_6031_DP""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCNN""",21,"""65201C621E4172F8"""
+"""BE71A8388377CE0E_2C66CC392CBDE0F4_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC(=C)F""",21,"""65201C621E4172F8"""
+"""09C4009F1E308928_28AE8824CE541451_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC=CBr""",21,"""65201C621E4172F8"""
+"""619A4D0C7211A5A2_BA6A252DB8166B44_6031_DP""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCCO""",21,"""65201C621E4172F8"""
+"""8A3AC1EEF732ACDA_54714A3505CB4A63_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCOC""",21,"""65201C621E4172F8"""
+"""45CF7CC3DAE680F3_0075DD9584DE54D7_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)C[C@@H]3CO3""",21,"""65201C621E4172F8"""
+"""8AB06D64567E7C3A_E77A8C1C0A1A1FF0_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)C[C@H]3CO3""",21,"""65201C621E4172F8"""
+"""34949F98E16C7BE5_09430F144BB14C94_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC3CO3""",21,"""65201C621E4172F8"""
+"""006E82CB25A2C7E6_0D0369C8D35F9947_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC(Cl)Cl""",21,"""65201C621E4172F8"""
+"""DD66C8808DEE3C29_5AFF59DA94B4AD3E_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC(=C)Cl""",21,"""65201C621E4172F8"""
+"""7D343EEC0321C4C8_3D10E2C2CB751086_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC(C)F""",21,"""65201C621E4172F8"""
+"""4D39416940B25E2C_835CEBDFBD908161_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC=CCl""",21,"""65201C621E4172F8"""
+"""B5D9437AFD83E1C5_1DD4BE9D87D392DA_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CC(C)Br""",21,"""65201C621E4172F8"""
+"""7EA23C1C3CDBB0CC_C874D889AACD0598_6031_UN""","""O(C(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Br)CCCI""",21,"""65201C621E4172F8"""
+"""45DB1FF6C16A8131_698C0659F61887B7_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(C)=C""",21,"""65ED7479D1E29134"""
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+"""687569B3D757C939_CD779A3B7D1B6C4D_6031_DP""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCNC""",21,"""65ED7479D1E29134"""
+"""68E31E33BADF497E_C95757499F943723_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OC[C@H](C)N""",21,"""65ED7479D1E29134"""
+"""DD5296BDA8B75AE6_150326DF8B745FE0_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(C)S""",21,"""65ED7479D1E29134"""
+"""3D1BBB26D8D046A4_6821D2E7DFB55AED_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCSC""",21,"""65ED7479D1E29134"""
+"""813ED278F9431364_2BF9D8320FD1A39A_6031_DP""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(C)N""",21,"""65ED7479D1E29134"""
+"""C008B31430531D4E_7F46F7B8782D361B_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC#CC""",21,"""65ED7479D1E29134"""
+"""AD392941FD293D06_EA37C016023985C4_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCON""",21,"""65ED7479D1E29134"""
+"""4E3F2316CDE5C85F_ED4C52F6E6D03EC4_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(=C)Br""",21,"""65ED7479D1E29134"""
+"""D17B37792CC6B81F_C77E327F8A91CBDD_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OC[C@@H](C)N""",21,"""65ED7479D1E29134"""
+"""8F8BA33A57E96299_F6250E8F4B2A5C5F_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OC[CH]=[C]=[CH2]""",21,"""65ED7479D1E29134"""
+"""9E82C4DCC22329B8_01FD1AA3813EC812_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC#CBr""",21,"""65ED7479D1E29134"""
+"""4F1E73CFD87D3DBB_8FB9239655A6509C_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(C)Cl""",21,"""65ED7479D1E29134"""
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+"""A30172803F138D78_1BC355AD1382BCBB_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(N)=S""",21,"""65ED7479D1E29134"""
+"""B448F62619E27F49_1A5B884B694A629C_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCCS""",21,"""65ED7479D1E29134"""
+"""C5E5BFB4586093D0_65AAA819B38162F2_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCCC""",21,"""65ED7479D1E29134"""
+"""F58481C8EC92E6CB_E7C861EF71D7F606_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCCN""",21,"""65ED7479D1E29134"""
+"""67257E9667BDCA3D_47C9E60D846737B5_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCCBr""",21,"""65ED7479D1E29134"""
+"""5B6F8C1F2290034B_0215D2BA21C19B95_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(C)C""",21,"""65ED7479D1E29134"""
+"""650F83A010C69C11_305F0C7B2A520322_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC3CC3""",21,"""65ED7479D1E29134"""
+"""D7CDB24000B7D590_6ED0B0B5514ED025_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCC=C""",21,"""65ED7479D1E29134"""
+"""A4657FD338B7FC1B_AFD81AEE975CD049_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCC#C""",21,"""65ED7479D1E29134"""
+"""EAAC0D7F67CEB8DF_B5B269325759CA86_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCCCl""",21,"""65ED7479D1E29134"""
+"""12E39DED017C9F02_1B48E7A7143EEC29_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCC#N""",21,"""65ED7479D1E29134"""
+"""57FFDAFB1A6AABA5_643EBAFC6D95E401_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(F)Br""",21,"""65ED7479D1E29134"""
+"""8E30BBDBB002D54A_D3D83AA578492C33_6031_DP""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCNN""",21,"""65ED7479D1E29134"""
+"""69C8043DEB18A681_2CABA422E31E0338_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(=C)F""",21,"""65ED7479D1E29134"""
+"""8924817D0DBDB703_2863E03F01F7F79D_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC=CBr""",21,"""65ED7479D1E29134"""
+"""A7E1BA1AAF253A96_BAA74D3677B58888_6031_DP""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCCO""",21,"""65ED7479D1E29134"""
+"""0955573AC147BE83_54BC222ECA68A9AF_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCOC""",21,"""65ED7479D1E29134"""
+"""DB83FD1D1EBFB4BC_00B8B58E4B7DB71B_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OC[C@@H]3CO3""",21,"""65ED7479D1E29134"""
+"""648836D0DE70924F_E7B7E407C5B9FC3C_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OC[C@H]3CO3""",21,"""65ED7479D1E29134"""
+"""3623982291D5F483_098E670F8412AF58_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC3CO3""",21,"""65ED7479D1E29134"""
+"""2AC2B9076843BF1D_0DCE01D31CFC7A8B_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(Cl)Cl""",21,"""65ED7479D1E29134"""
+"""028352B1AB8D0F67_5A3231C15B174EF2_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(=C)Cl""",21,"""65ED7479D1E29134"""
+"""29BD6E9B861712A4_3DDD8AD904D6F34A_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(C)F""",21,"""65ED7479D1E29134"""
+"""E57A130E372C9A9A_839183C4723362AD_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC=CCl""",21,"""65ED7479D1E29134"""
+"""5406F8B68F733647_1D19D68648707116_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCC(C)Br""",21,"""65ED7479D1E29134"""
+"""DFBF7998B5F253D1_C8B9B092656EE654_6031_UN""","""CCOC1=C(C=N[N]1C2=CC=CC=C2)C(=O)OCCCI""",21,"""65ED7479D1E29134"""
+"""EA9946DB5AE18B9E_6A0D23F0FB60E6D4_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(C)=C""",21,"""666C51D0DC9AF057"""
+"""38329C6F47620D66_7613531324EE3675_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(F)F""",21,"""666C51D0DC9AF057"""
+"""87FBCCB75CEED3FF_CEF6BF9270630D2E_6031_DP""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCNC""",21,"""666C51D0DC9AF057"""
+"""39927246381CCA17_CAD672E092EC5640_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)C[C@H](C)N""",21,"""666C51D0DC9AF057"""
+"""7E1208DADE562AFB_16820376860C3E83_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(C)S""",21,"""666C51D0DC9AF057"""
+"""303D9B340623487D_6BA0F74ED2CD3B8E_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCSC""",21,"""666C51D0DC9AF057"""
+"""9305D6CB58773095_2878FD9B02A9C2F9_6031_DP""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(C)N""",21,"""666C51D0DC9AF057"""
+"""73CF001B2D673C1B_7CC7D21175555778_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC#CC""",21,"""666C51D0DC9AF057"""
+"""063CEC3E56C2B481_E9B6E5BF0F41E4A7_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCON""",21,"""666C51D0DC9AF057"""
+"""A607919A93AF89CA_EECD775FEBA85FA7_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(=C)Br""",21,"""666C51D0DC9AF057"""
+"""AD17BEBA0133EC3A_C4FF17D687E9AABE_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)C[C@@H](C)N""",21,"""666C51D0DC9AF057"""
+"""BFBDB98986041014_F5A42B2646523D3C_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)C[CH]=[C]=[CH2]""",21,"""666C51D0DC9AF057"""
+"""952EA3D87B58760E_027C3F0A8C46A971_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC#CBr""",21,"""666C51D0DC9AF057"""
+"""E1989D8C1FFA4766_8C38063F58DE31FF_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(C)Cl""",21,"""666C51D0DC9AF057"""
+"""47FD7349D4F7B695_9C8169BDEFF83E42_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCCF""",21,"""666C51D0DC9AF057"""
+"""62EDD8B92ED08F6F_184270041EFADDD8_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(N)=S""",21,"""666C51D0DC9AF057"""
+"""9E6D08AB49389649_19DAADE2643203FF_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCCS""",21,"""666C51D0DC9AF057"""
+"""6DBEBF200C06DBC3_662B8DB0BEF90391_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCCC""",21,"""666C51D0DC9AF057"""
+"""5E6DEC423C1AA208_E44944467CAF9765_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCCN""",21,"""666C51D0DC9AF057"""
+"""A7ADFC9A815B73AF_4448C3A4891F56D6_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCCBr""",21,"""666C51D0DC9AF057"""
+"""F036AF8ADFADCC5A_0194F7132CB9FAF6_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(C)C""",21,"""666C51D0DC9AF057"""
+"""403615DBE4BB31D8_33DE29D2272A6241_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC3CC3""",21,"""666C51D0DC9AF057"""
+"""B1CB7685F89371AB_6D51951C5C36B146_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCC=C""",21,"""666C51D0DC9AF057"""
+"""3129C16FA15E09AB_AC593F479A24B12A_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCC#C""",21,"""666C51D0DC9AF057"""
+"""F7D624939E1D9E5B_B6334C9B5A21ABE5_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCCCl""",21,"""666C51D0DC9AF057"""
+"""599081C5821F0237_18C9C20E19468D4A_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCC#N""",21,"""666C51D0DC9AF057"""
+"""9C4FB1E911B809FB_67BF9F5560ED8562_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(F)Br""",21,"""666C51D0DC9AF057"""
+"""CF45453678825FD6_D0591F0C75314D50_6031_DP""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCNN""",21,"""666C51D0DC9AF057"""
+"""030564C84F57997E_2F2A818BEE66625B_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(=C)F""",21,"""666C51D0DC9AF057"""
+"""4C2DE8E4713ECAC9_2BE2C5960C8F96FE_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC=CBr""",21,"""666C51D0DC9AF057"""
+"""DAD1B2821A49D0E4_B926689F7ACDE9EB_6031_DP""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCCO""",21,"""666C51D0DC9AF057"""
+"""C656E9101B1D19A4_573D0787C710C8CC_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CCOC""",21,"""666C51D0DC9AF057"""
+"""0BBDADE0B327CCBC_033990274605D678_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)C[C@@H]3CO3""",21,"""666C51D0DC9AF057"""
+"""844328EC22015705_E436C1AEC8C19D5F_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)C[C@H]3CO3""",21,"""666C51D0DC9AF057"""
+"""A586E5A20CD13574_0A0F42A6896ACE3B_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC3CO3""",21,"""666C51D0DC9AF057"""
+"""3A37EA1AB317D3D6_0E4F247A11841BE8_6031_UN""","""O(C(=O)[C@@H]1CCCO[C@H]1C2=C(C=C(C=C2)Cl)Cl)CC(Cl)Cl""",21,"""666C51D0DC9AF057"""
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+"""1E3374312C7A437E_24E1BB88D44ED12E_6031_DP""","""NC(CC1=C(C(=CC=C1)C(F)(F)F)F)C(=O)OCC=CBr""",21,"""696F2FCE045BB787"""
+"""EB2ACAD410CCF7EF_B6251681A20CAE3B_6031_DP""","""NC(CC1=C(C(=CC=C1)C(F)(F)F)F)C(=O)OCCCO""",21,"""696F2FCE045BB787"""
+"""334213043FDF1DA5_583E79991FD18F1C_6031_DP""","""NC(CC1=C(C(=CC=C1)C(F)(F)F)F)C(=O)OCCOC""",21,"""696F2FCE045BB787"""
+"""26910070769C1CD3_0C3AEE399EC491A8_6031_DP""","""NC(CC1=C(C(=CC=C1)C(F)(F)F)F)C(=O)OC[C@@H]2CO2""",21,"""696F2FCE045BB787"""
+"""1B0A2939AF7D3934_EB35BFB01000DA8F_6031_DP""","""NC(CC1=C(C(=CC=C1)C(F)(F)F)F)C(=O)OC[C@H]2CO2""",21,"""696F2FCE045BB787"""
+"""5D5F01A6A4B700D7_050C3CB851AB89EB_6031_DP""","""NC(CC1=C(C(=CC=C1)C(F)(F)F)F)C(=O)OCC2CO2""",21,"""696F2FCE045BB787"""
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+"""7CB1222A65B45792_119B8D319DC957A5_6031_DP""","""NC(CC1=C(C(=CC=C1)C(F)(F)F)F)C(=O)OCC(C)Br""",21,"""696F2FCE045BB787"""
+"""A639E8385E486B1E_C43BEB25B0D7C0E7_6031_DP""","""NC(CC1=C(C(=CC=C1)C(F)(F)F)F)C(=O)OCCCI""",21,"""696F2FCE045BB787"""
+"""FF50532FC699BBA8_B698F105EA95693E_6016_UN""","""COC1=C(N=CC(=C1)C(=O)C2=CC3=C(C=C2)OCO3)SC""",21,"""6A9CFE80A661A1B1"""
+"""13AE7CD6D3791DA6_6B6CAFD457FA586D_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=CC=C2)OC3CCCC3""",21,"""6A9CFE80A661A1B1"""
+"""461321C26EF78C98_C41B57F8ACEAF491_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=C(OCC)C=C2)OCC""",21,"""6A9CFE80A661A1B1"""
+"""ACD329C5C1409F56_381B203F330103BB_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=CC(=C2)OCCC(C)C""",21,"""6A9CFE80A661A1B1"""
+"""104CFDE01844C58C_6421D869A02D35BF_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""6A9CFE80A661A1B1"""
+"""5730A9792A50D413_5709B7A82743C317_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=C(C=C2)OC3CCOC3""",21,"""6A9CFE80A661A1B1"""
+"""F56282443986826D_9CE853DCFF3437E4_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""6A9CFE80A661A1B1"""
+"""B0D211466B61418F_448777D0ABF0266C_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=CC(=C2)COCCOC""",21,"""6A9CFE80A661A1B1"""
+"""58630AA9DF1975C8_CDEAFAD1A54C2D00_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""6A9CFE80A661A1B1"""
+"""7A36AEE11C5C78C0_D2F1EE329206CA65_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=CC(=C2)OC(COC)C""",21,"""6A9CFE80A661A1B1"""
+"""AAAE10196A199F44_80B0160619B36A49_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""6A9CFE80A661A1B1"""
+"""E02B81194F44C345_9549F03282CECB0B_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""6A9CFE80A661A1B1"""
+"""83F980E571CD67A5_ECF29F1E75F4F776_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=CC=C2)CN3CCCC3""",21,"""6A9CFE80A661A1B1"""
+"""D63E8A4FB64F7CF0_F5D6BB1C1D9818F6_6025_UN""","""COC1=C(N=CC(=C1)Br)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""6A9CFE80A661A1B1"""
+"""379AFC739494EB40_8822E4FE9A8EA99F_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=CC(=C2)OCCN(C)C""",21,"""6A9CFE80A661A1B1"""
+"""993362DFD3B78AE0_7FFF283C0BEC0AA4_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""6A9CFE80A661A1B1"""
+"""7A0C8EC3B82F00B4_48D810B8FC860910_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""6A9CFE80A661A1B1"""
+"""5A6CAF5172469FA8_9A14EE3CD68923A3_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""6A9CFE80A661A1B1"""
+"""A1944C39A4B353A4_4AC120B423D317B0_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""6A9CFE80A661A1B1"""
+"""E975AE6D8D8B3D99_F14E90A4F95CFF1E_6025_UN""","""COC1=C(N=CC(=C1)Br)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""6A9CFE80A661A1B1"""
+"""6A3CBC8E77E45428_655414FB30F47575_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""6A9CFE80A661A1B1"""
+"""58180C3B941A18EA_606FEA5EECC4A75C_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""6A9CFE80A661A1B1"""
+"""D1CCDDF8F1D044C7_A5944CA98C443B68_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""6A9CFE80A661A1B1"""
+"""F7A4D8D746A3E832_B5B8DCF853AA8F9C_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""6A9CFE80A661A1B1"""
+"""2E8E5F14054B266B_68AB85C1FD097BE6_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""6A9CFE80A661A1B1"""
+"""2AC4E94BA1A416D6_F8D861BB64F4F133_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""6A9CFE80A661A1B1"""
+"""CB973F0B03919D40_DDF9D10884FB3FE8_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""6A9CFE80A661A1B1"""
+"""032963D8C172A03D_BB046149AD728E88_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=C(OCCC(C)C)C=C2""",21,"""6A9CFE80A661A1B1"""
+"""CEBE434F7E5E3252_4669025F53381ED8_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=C(C=C2)OC3CCCC3""",21,"""6A9CFE80A661A1B1"""
+"""4480222C57BB9F7D_C75FDBA1E4C3760C_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""6A9CFE80A661A1B1"""
+"""A19F59C5324E02CB_B220B9939EEFD2BB_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""6A9CFE80A661A1B1"""
+"""4842C8C3CFE70866_4DC77E1F49EE2C56_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""6A9CFE80A661A1B1"""
+"""668B6909F1112AB4_BA4097EA62970148_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""6A9CFE80A661A1B1"""
+"""8BDEA694A387451A_CC4BB9F6AAFB0623_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""6A9CFE80A661A1B1"""
+"""073D7114F9E3FE78_097B28CC331F6F5C_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""6A9CFE80A661A1B1"""
+"""D6D632C3D5E99841_631F1DEACC29643C_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""6A9CFE80A661A1B1"""
+"""65651D29F124A9D8_1224AF9FDD22EACF_6025_UN""","""COC1=C(N=CC(=C1)Br)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""6A9CFE80A661A1B1"""
+"""8D7EF0C9E47FC349_A0EF43EA1F6BE38D_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""6A9CFE80A661A1B1"""
+"""4751B1F3A7CFBD09_D521D16225C773BF_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""6A9CFE80A661A1B1"""
+"""566AA4A6A63DC35F_86DD893B1BB5D2AE_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(C=CC=C2)CN3CCCC3""",21,"""6A9CFE80A661A1B1"""
+"""73C7A033366013A7_140EF3B9FE7AD5E9_6025_UN""","""COC1=C(N=CC(=C1)Br)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""6A9CFE80A661A1B1"""
+"""06CC476E0E926F3A_B2368B9335FE0760_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=CC(=C2)C)S3""",21,"""6CED952A740C2E95"""
+"""52C8C927C2CE97D6_93EAF059FEB7B9F3_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=C(C)C=C2)S3""",21,"""6CED952A740C2E95"""
+"""622A917F234A3FCB_2A45362F73C8E5A9_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC(=CC=C2)F)S3""",21,"""6CED952A740C2E95"""
+"""4D3F917F7B90A3BB_B055EFCD19ACDB62_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC(=CN=C2)F)S3""",21,"""6CED952A740C2E95"""
+"""537634E8BF431666_C7175DB703A79307_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(N)C=CN=C2)S3""",21,"""6CED952A740C2E95"""
+"""6C7D1CFF1E959F8B_D3B7F1989593D868_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CN=C(C=C2)F)S3""",21,"""6CED952A740C2E95"""
+"""BE98BFE9FA3E0390_CE27E10B5DD10B81_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(C=CC=C2)Cl)S3""",21,"""6CED952A740C2E95"""
+"""B0297B627399413E_74CA8184A6594CD4_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=C(C#N)S2)S3""",21,"""6CED952A740C2E95"""
+"""AA0A7CFE9C760C77_B329EDA1FF99A01D_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(N=CC=C2)Cl)S3""",21,"""6CED952A740C2E95"""
+"""EE543EF04B5BF768_5D5E4F4CDBA64E82_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC(=CC=C2)O)S3""",21,"""6CED952A740C2E95"""
+"""4E285CEC7C3C2B92_A2D61CC8A266C8FC_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(N=CC=C2)F)S3""",21,"""6CED952A740C2E95"""
+"""8C8D75097861C18B_288C05780A877EF8_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=C(C=C2)O)S3""",21,"""6CED952A740C2E95"""
+"""7BC6C4F3BE20CE29_3233E54AE39385A0_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CN=C(C=C2)Cl)S3""",21,"""6CED952A740C2E95"""
+"""99591D0A39E5594E_198E0BE6DDA7F89D_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=CC(=C2)N)S3""",21,"""6CED952A740C2E95"""
+"""79656BCDC52E73EF_635BFFFCD131F08C_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CN=C(N)C=C2)S3""",21,"""6CED952A740C2E95"""
+"""BB5DEA46CA25A4AD_B4B8A1EDFC878484_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(ON=C2C)C)S3""",21,"""6CED952A740C2E95"""
+"""F0BA3525A240577D_EBD628C6C3C1A40E_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CSC(=C2)C#N)S3""",21,"""6CED952A740C2E95"""
+"""925D5B63918FA3C3_36D435E600F08C16_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=N[N]2CC)S3""",21,"""6CED952A740C2E95"""
+"""6EBB057E9A74EC05_121FFF3A0867439F_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC(=C(Cl)S2)Cl)S3""",21,"""6CED952A740C2E95"""
+"""E7E34C72A5716358_39D80FB44FB16793_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC(=NS2)OC)S3""",21,"""6CED952A740C2E95"""
+"""B5A2979D412030D9_4A2FDC4F4B7373B9_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC(=CC=C2)Cl)S3""",21,"""6CED952A740C2E95"""
+"""C40471B00385BF23_CC26855A0501BF02_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(C=CC=C2)O)S3""",21,"""6CED952A740C2E95"""
+"""1D7D17836DA298E4_F02DAE3238C98084_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=C(C=C2)Cl)S3""",21,"""6CED952A740C2E95"""
+"""3C7AB77D43B95590_183D639DBD3A5953_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(C=CC=N2)Cl)S3""",21,"""6CED952A740C2E95"""
+"""191079A72974BAF6_AB710E94697AA9F0_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=C(C=C2)F)S3""",21,"""6CED952A740C2E95"""
+"""D814760F07D27FA9_7DA86472CB914DBB_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC(=NC=C2)Cl)S3""",21,"""6CED952A740C2E95"""
+"""86935BA8CBDD1ADE_67BD00C4E6667531_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(C)C=CC=C2)S3""",21,"""6CED952A740C2E95"""
+"""FE1EF0190055B411_271C6D832E19EF10_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(SC=C2)C#N)S3""",21,"""6CED952A740C2E95"""
+"""D8300999524543F5_D2E032713F63ECD7_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(C=NC=C2)F)S3""",21,"""6CED952A740C2E95"""
+"""82D6968155D9B679_D0E369F65909ABD0_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(C)SC(=C2)C)S3""",21,"""6CED952A740C2E95"""
+"""A0DB46B0BE29B45F_67E84EFECAFBF4EF_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(OC=C2)C#N)S3""",21,"""6CED952A740C2E95"""
+"""751D6F30758B63E1_9485B6EE1CC3C2F0_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(N)C=NC=C2)S3""",21,"""6CED952A740C2E95"""
+"""9E23367E9526FA9A_EF45BE456DC484FF_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(N)N=CC=C2)S3""",21,"""6CED952A740C2E95"""
+"""3A35FAC81E8405D4_E32D002CD4216164_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(C=CO2)C#N)S3""",21,"""6CED952A740C2E95"""
+"""7E9DFEBAD42C4DDD_CF055019A260DFE4_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(C)C=NC=C2)S3""",21,"""6CED952A740C2E95"""
+"""8FA160B2D8902AFA_26A47737736A96EA_6004_DP""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=C(CN)O2)S3""",21,"""6CED952A740C2E95"""
+"""0FDF6BBFFEE85BF0_256BC8113A9AE72C_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=C(SC(=C2)Cl)Cl)S3""",21,"""6CED952A740C2E95"""
+"""267941249C0C5CFC_F01A76F4DA299AA1_6004_DP""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=C(CN)S2)S3""",21,"""6CED952A740C2E95"""
+"""0E11D600CA278B74_997B03BAC636AC9C_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=N[N](C=C2C)C)S3""",21,"""6CED952A740C2E95"""
+"""8C8D75097861C18B_70CD5050F8BF9962_6004_DP""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=C(O)C=C2)S3""",21,"""6CED952A740C2E95"""
+"""3F0474AD97055D18_6621F17AB7EA5522_6004_UN""","""CC3=CN=C(NC(=O)C1=CC=C(O1)C2=CC=C(C#N)O2)S3""",21,"""6CED952A740C2E95"""
+"""C3A60899F48EBCAD_61F9B4C108C99A9A_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CC(C)=C""",21,"""6D98C6E12F338C19"""
+"""B923904155F76EBE_7DE7C422D7474A3B_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CC(F)F""",21,"""6D98C6E12F338C19"""
+"""050B9EF189FCBDA6_C50228A383CA7160_6031_DP""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CCNC""",21,"""6D98C6E12F338C19"""
+"""7EEA04C70BE77B97_C122E5D161452A0E_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)C[C@H](C)N""",21,"""6D98C6E12F338C19"""
+"""3F0C19DC6BB2F243_1D76944775A542CD_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CC(C)S""",21,"""6D98C6E12F338C19"""
+"""D5969C1B941EE168_6054607F216447C0_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CCSC""",21,"""6D98C6E12F338C19"""
+"""24FF5CC8A2DFA4EF_238C6AAAF100BEB7_6031_DP""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CC(C)N""",21,"""6D98C6E12F338C19"""
+"""9B434529047F948B_7733452086FC2B36_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CC#CC""",21,"""6D98C6E12F338C19"""
+"""DC086C1CD6A0B6F4_E242728EFCE898E9_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CCON""",21,"""6D98C6E12F338C19"""
+"""8A75E2B52244D17F_E539E06E180123E9_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CC(=C)Br""",21,"""6D98C6E12F338C19"""
+"""CB0502C482DD8D74_CF0B80E77440D6F0_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)C[C@@H](C)N""",21,"""6D98C6E12F338C19"""
+"""70D2D1A5E843A6EF_FE50BC17B5FB4172_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)C[CH]=[C]=[CH2]""",21,"""6D98C6E12F338C19"""
+"""A498FDFFFB2E46B6_0988A83B7FEFD53F_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CC#CBr""",21,"""6D98C6E12F338C19"""
+"""B9B9CA60EB3C5C07_87CC910EAB774DB1_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CC(C)Cl""",21,"""6D98C6E12F338C19"""
+"""41B8239D90575A42_9775FE8C1C51420C_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CCCF""",21,"""6D98C6E12F338C19"""
+"""95D82ED89D3EE03B_13B6E735ED53A196_6031_UN""","""O(C(=O)C1=C[NH]N=C1C3=CC2=C(C=CC=C2)O3)CC(N)=S""",21,"""6D98C6E12F338C19"""
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+"""5CB02EB61628D603_119935470282218A_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CCCS""",21,"""6E2FC975BA2AD222"""
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+"""E5D7A7837E19662B_EC0ADCE31A1FB510_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CCCN""",21,"""6E2FC975BA2AD222"""
+"""D91AC5E23ED24244_4C0B5B01EFAF74A3_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CCCBr""",21,"""6E2FC975BA2AD222"""
+"""9DD3CB04465B1EE0_09D76FB64A09D883_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CC(C)C""",21,"""6E2FC975BA2AD222"""
+"""1FFA1F0A42E6F4CE_3B9DB177419A4034_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CC3CC3""",21,"""6E2FC975BA2AD222"""
+"""AF253F98E9CD5FE2_65120DB93A869333_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CCC=C""",21,"""6E2FC975BA2AD222"""
+"""5F05C323D77689C2_A41AA7E2FC94935F_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CCC#C""",21,"""6E2FC975BA2AD222"""
+"""E9B3AC36F638821B_BE70D43E3C918990_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CCCCl""",21,"""6E2FC975BA2AD222"""
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+"""5FA3A2BDC1FBB45F_6FFC07F0065DA717_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CC(F)Br""",21,"""6E2FC975BA2AD222"""
+"""8A2D92EFBF44E8A9_D81A87A913816F25_6031_DP""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CCNN""",21,"""6E2FC975BA2AD222"""
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+"""2AE8C675523A35A6_23A15D336A3FB48B_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CC=CBr""",21,"""6E2FC975BA2AD222"""
+"""CC77EB9A56EA3DA4_B165F03A1C7DCB9E_6031_DP""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CCCO""",21,"""6E2FC975BA2AD222"""
+"""C5A5AE5763BA1956_5F7E9F22A1A0EAB9_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CCOC""",21,"""6E2FC975BA2AD222"""
+"""B45583557D632D23_0B7A088220B5F40D_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)C[C@@H]3CO3""",21,"""6E2FC975BA2AD222"""
+"""5F62F74E84FEDDC1_EC75590BAE71BF2A_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)C[C@H]3CO3""",21,"""6E2FC975BA2AD222"""
+"""A8B0D63EB8CCB081_024CDA03EFDAEC4E_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CC3CO3""",21,"""6E2FC975BA2AD222"""
+"""8F38926DEFE3A27E_060CBCDF7734399D_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CC(Cl)Cl""",21,"""6E2FC975BA2AD222"""
+"""02A3B5D3B49022B8_51F08CCD30DF0DE4_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CC(=C)Cl""",21,"""6E2FC975BA2AD222"""
+"""39B4AFAFAA5FFC64_361F37D56F1EB05C_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CC(C)F""",21,"""6E2FC975BA2AD222"""
+"""10BB9C0ADA2D274B_88533EC819FB21BB_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CC=CCl""",21,"""6E2FC975BA2AD222"""
+"""2149A082C260C015_16DB6B8A23B83200_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CC(C)Br""",21,"""6E2FC975BA2AD222"""
+"""9893457456FD702C_C37B0D9E0EA6A542_6031_UN""","""O(C(=O)C1=NOC(=C1)COC2=C(C=CC=C2)F)CCCI""",21,"""6E2FC975BA2AD222"""
+"""6A613075DB73FDCD_620871C76380248B_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC(C)=C""",21,"""6E6903E7447A3208"""
+"""ED2813BA32D5CCBA_7E160124BC0EF42A_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC(F)F""",21,"""6E6903E7447A3208"""
+"""B48E61C55FEC5D59_C6F3EDA5E883CF71_6031_DP""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCNC""",21,"""6E6903E7447A3208"""
+"""84FB70F42C516CC2_C2D320D70A0C941F_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OC[C@H](C)N""",21,"""6E6903E7447A3208"""
+"""BAFC13DE97611B76_1E8751411EECFCDC_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC(C)S""",21,"""6E6903E7447A3208"""
+"""2F1DAC160F4BC2A5_63A5A5794A2DF9D1_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCSC""",21,"""6E6903E7447A3208"""
+"""A4BFBB955D2B5360_207DAFAC9A4900A6_6031_DP""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC(C)N""",21,"""6E6903E7447A3208"""
+"""FBEC073EE930B097_74C28026EDB59527_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC#CC""",21,"""6E6903E7447A3208"""
+"""7EAE8B3F32387FA3_E1B3B78897A126F8_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCON""",21,"""6E6903E7447A3208"""
+"""77E6DFCE4C0E2D3B_E6C8256873489DF8_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC(=C)Br""",21,"""6E6903E7447A3208"""
+"""D2278733B5E41490_CCFA45E11F0968E1_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OC[C@@H](C)N""",21,"""6E6903E7447A3208"""
+"""22B5C1EBF9B28DBE_FDA17911DEB2FF63_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OC[CH]=[C]=[CH2]""",21,"""6E6903E7447A3208"""
+"""3CF6F8D545D5D48C_0A796D3D14A66B2E_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC#CBr""",21,"""6E6903E7447A3208"""
+"""C6564A07D8092634_843D5408C03EF3A0_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC(C)Cl""",21,"""6E6903E7447A3208"""
+"""7CE32093AC1C15E0_94843B8A7718FC1D_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCCF""",21,"""6E6903E7447A3208"""
+"""7370793D3F8433BF_10472233861A1F87_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC(N)=S""",21,"""6E6903E7447A3208"""
+"""2B961E9B040748B0_11DFFFD5FCD2C1A0_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCCS""",21,"""6E6903E7447A3208"""
+"""FF508A4FCDE3D0C9_6E2EDF872619C1CE_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCCC""",21,"""6E6903E7447A3208"""
+"""179CE48859D8C621_EC4C1671E44F553A_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCCN""",21,"""6E6903E7447A3208"""
+"""BCD2CDEE252D2BE9_4C4D919311FF9489_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCCBr""",21,"""6E6903E7447A3208"""
+"""C962F6994ADC2921_0991A524B45938A9_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC(C)C""",21,"""6E6903E7447A3208"""
+"""9036109A64583E95_3BDB7BE5BFCAA01E_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCC3CC3""",21,"""6E6903E7447A3208"""
+"""A3F1FA9C25392BAC_6554C72BC4D67319_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCC=C""",21,"""6E6903E7447A3208"""
+"""D62BD0CC9D19E939_A45C6D7002C47375_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCC#C""",21,"""6E6903E7447A3208"""
+"""6FC610A550970B42_BE361EACC2C169BA_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCCCl""",21,"""6E6903E7447A3208"""
+"""341D94E8DF3AC1CA_10CC903981A64F15_6031_UN""","""CC1=CN=C(C=C1)N[C@@H]2CCC[C@@H](C2)C(=O)OCCC#N""",21,"""6E6903E7447A3208"""
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+"""A4CA3F8D7931941C_6F540B2E4E1ECC65_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCCCC""",21,"""6F13D74E2C7D3FA3"""
+"""C3503D49509ACEAA_ED36C2D88C485891_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCCCN""",21,"""6F13D74E2C7D3FA3"""
+"""EE12A969171BCCEB_4D37453A79F89922_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCCCBr""",21,"""6F13D74E2C7D3FA3"""
+"""F67723927F665AB8_08EB718DDC5E3502_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCC(C)C""",21,"""6F13D74E2C7D3FA3"""
+"""021633B7CBC68244_3AA1AF4CD7CDADB5_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCC2CC2""",21,"""6F13D74E2C7D3FA3"""
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+"""FD11C38676D0ACBB_6EC019CB900A4A96_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCC(F)Br""",21,"""6F13D74E2C7D3FA3"""
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+"""33252DABB2D0C0B7_229D4308FC68590A_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCC=CBr""",21,"""6F13D74E2C7D3FA3"""
+"""9704A2CF5DBC8B4C_B059EE018A2A261F_6031_DP""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCCCO""",21,"""6F13D74E2C7D3FA3"""
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+"""2C5A3B1641CA5356_ED494730382652AB_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OC[C@H]2CO2""",21,"""6F13D74E2C7D3FA3"""
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+"""73F4746C738DC7CF_50CC92F6A688E065_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCC(=C)Cl""",21,"""6F13D74E2C7D3FA3"""
+"""F2A77D647B4594B5_372329EEF9495DDD_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCC(C)F""",21,"""6F13D74E2C7D3FA3"""
+"""348935176E9D5981_896F20F38FACCC3A_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCC=CCl""",21,"""6F13D74E2C7D3FA3"""
+"""5DF309D271387152_17E775B1B5EFDF81_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCC(C)Br""",21,"""6F13D74E2C7D3FA3"""
+"""FDF5E519878FF61E_C24713A598F148C3_6031_UN""","""CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)OCCCI""",21,"""6F13D74E2C7D3FA3"""
+"""7842BE096C67BED9_B1AD3F04C7CD807A_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=CC(=C3)C""",21,"""6F7621BD863FA98F"""
+"""E06BC990504C3E47_907144CE0C843EE9_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=C(C)C=C3""",21,"""6F7621BD863FA98F"""
+"""8BEE7EC05AFDEC10_29DE82B881FB62B3_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC(=CC=C3)F""",21,"""6F7621BD863FA98F"""
+"""AE23D5657DCFDA5E_B3CE5B5AEB9F5C78_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC(=CN=C3)F""",21,"""6F7621BD863FA98F"""
+"""D8A836F8E3C0A288_C48CE920F194141D_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(N)C=CN=C3""",21,"""6F7621BD863FA98F"""
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+"""B157E0CC16B07776_77513513546ACBCE_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=C(C#N)S3""",21,"""6F7621BD863FA98F"""
+"""58F013A8112EA546_B0B259360DAA2707_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(N=CC=C3)Cl""",21,"""6F7621BD863FA98F"""
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+"""AE3CEB39197E8A3C_A14DA85F50554FE6_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(N=CC=C3)F""",21,"""6F7621BD863FA98F"""
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+"""C65569AC14C563D0_1A15BF712F947F87_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=CC(=C3)N""",21,"""6F7621BD863FA98F"""
+"""C997AE68AF3F3CFE_60C04B6B23027796_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CN=C(N)C=C3""",21,"""6F7621BD863FA98F"""
+"""A4A418F0A3250E80_B723157A0EB4039E_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(ON=C3C)C""",21,"""6F7621BD863FA98F"""
+"""2F35C4DF0CF8CE2C_E84D9C5131F22314_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CSC(=C3)C#N""",21,"""6F7621BD863FA98F"""
+"""319F6FF4494DC066_354F8171F2C30B0C_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=N[N]3CC""",21,"""6F7621BD863FA98F"""
+"""A8C921F6BE900AD1_11844BADFA54C485_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC(=C(Cl)S3)Cl""",21,"""6F7621BD863FA98F"""
+"""87F19B29DA36DB39_3A43BB23BD82E089_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC(=NS3)OC""",21,"""6F7621BD863FA98F"""
+"""B5B622CB763F2192_49B468D8B940F4A3_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC(=CC=C3)Cl""",21,"""6F7621BD863FA98F"""
+"""B646091C864AA82E_CFBD31CDF7323818_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(C=CC=C3)O""",21,"""6F7621BD863FA98F"""
+"""443CFFB2A19DB3D3_F3B61AA5CAFA079E_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=C(C=C3)Cl""",21,"""6F7621BD863FA98F"""
+"""5BA75F0C63A05285_1BA6D70A4F09DE49_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(C=CC=N3)Cl""",21,"""6F7621BD863FA98F"""
+"""56F17538DF9EDCCC_A8EABA039B492EEA_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=C(C=C3)F""",21,"""6F7621BD863FA98F"""
+"""B2D2B5C645868B85_7E33D0E539A2CAA1_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC(=NC=C3)Cl""",21,"""6F7621BD863FA98F"""
+"""23498535ACE98FFE_6426B4531455F22B_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(C)C=CC=C3""",21,"""6F7621BD863FA98F"""
+"""FDEF5ADCB44833E9_2487D914DC2A680A_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(SC=C3)C#N""",21,"""6F7621BD863FA98F"""
+"""ED8F2D11FCC23D44_D17B86E6CD506BCD_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(C=NC=C3)F""",21,"""6F7621BD863FA98F"""
+"""6C7DCFE0B77519FF_D378DD61AB3A2CCA_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(C)SC(=C3)C""",21,"""6F7621BD863FA98F"""
+"""7D7A72E46E6FBDC0_6473FA6938C873F5_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(OC=C3)C#N""",21,"""6F7621BD863FA98F"""
+"""C56C00260024E7D3_971E0279EEF045EA_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(N)C=NC=C3""",21,"""6F7621BD863FA98F"""
+"""1B39D97D724FB57E_ECDE0AD29FF703E5_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(N)N=CC=C3""",21,"""6F7621BD863FA98F"""
+"""D7018CEA6581795D_E0B6B4BB2612E67E_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(C=CO3)C#N""",21,"""6F7621BD863FA98F"""
+"""F614BEB3444C7602_CC9EE48E505358FE_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(C)C=NC=C3""",21,"""6F7621BD863FA98F"""
+"""E08B366FA6F5FDDD_253FC3A0815911F0_6004_DP""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=C(CN)O3""",21,"""6F7621BD863FA98F"""
+"""2705A39AE2620DB0_26F07C86C8A96036_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=C(SC(=C3)Cl)Cl""",21,"""6F7621BD863FA98F"""
+"""1E7E204A3F045358_F381C263281A1DBB_6004_DP""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=C(CN)S3""",21,"""6F7621BD863FA98F"""
+"""0243BA64332CC45B_9AE0B72D34052B86_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=N[N](C=C3C)C""",21,"""6F7621BD863FA98F"""
+"""DDAAFC8BF6198014_7356E4C70A8C1E78_6004_DP""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=C(O)C=C3""",21,"""6F7621BD863FA98F"""
+"""45811E1BAE8FAA40_65BA45ED45D9D238_6004_UN""","""C[N]1C(=C(C#N)C2=C1N=C(N=C2N)Cl)C3=CC=C(C#N)O3""",21,"""6F7621BD863FA98F"""
+"""A4A0FAFFC7171C9C_63F1F331940FB9D5_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(C)=C)C(F)(F)F""",21,"""6F908111B3F5AF56"""
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+"""894D4A058217B7FB_C70A6F531F0C522F_6031_DP""","""COC1=CC=C(C=C1)CC(C(=O)OCCNC)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""14E7DC601614820C_C32AA221FD830941_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OC[C@H](C)N)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""762C53DE482AAC6D_1F7ED3B7E9636182_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(C)S)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""13D266D0EF52C4E5_625C278FBDA2648F_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCSC)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""B84B13A801C1D1D3_21842D5A6DC69DF8_6031_DP""","""COC1=CC=C(C=C1)CC(C(=O)OCC(C)N)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""C03775D3129436AF_753B02D01A3A0879_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC#CC)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""CED2F5483D77B8E4_E04A357E602EBBA6_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCON)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""B97C1E60E7046730_E731A79E84C700A6_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(=C)Br)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""1C0DD6F6A5BD4BED_CD03C717E886F5BF_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OC[C@@H](C)N)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""83F17513E3039E9F_FC58FBE7293D623D_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OC[CH]=[C]=[CH2])C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""67F8FC52FB7C1242_0B80EFCBE329F670_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC#CBr)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""ECEE5C12A27E4BBA_85C4D6FE37B16EFE_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(C)Cl)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""D83524D1C7A7550C_957DB97C80976143_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCCF)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""8EA5780F41D38156_11BEA0C5719582D9_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(N)=S)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""9D776468A9A8D758_10267D230B5D5CFE_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCCS)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""82A1749A9E94F476_6FD75D71D1965C90_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCCC)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""79399B5A371DEDF4_EDB5948713C0C864_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCCN)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""4CB510C9364AFCFD_4DB41365E67009D7_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCCBr)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""23C9FA480894CDE2_086827D243D6A5F7_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(C)C)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""9A3626A3C997596C_3A22F91348453D40_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC2CC2)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""D4905F014223E5B3_64AD45DD3359EE47_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCC=C)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""92A185060C9F93CE_A5A5EF86F54BEE2B_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCC#C)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""B28E49FADFF1BCEF_BFCF9C5A354EF4E4_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCCCl)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""DBD3774E20CCD386_113512CF7629D24B_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCC#N)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""97D4CDB749B2A359_6E434F940F82DA63_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(F)Br)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""9C01761D601DFDAB_D9A5CFCD1A5E1251_6031_DP""","""COC1=CC=C(C=C1)CC(C(=O)OCCNN)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""BCBBE15775F159F5_26D6514A81093D5A_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(=C)F)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""89655EB33F221CDB_221E155763E0C9FF_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC=CBr)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""1DF2F4368BC32F47_B0DAB85E15A2B6EA_6031_DP""","""COC1=CC=C(C=C1)CC(C(=O)OCCCO)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""C43B0F52AFA86AC8_5EC1D746A87F97CD_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCOC)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""F771684CA574E929_0AC540E6296A8979_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OC[C@@H]2CO2)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""2D584CBBACD77752_EDCA116FA7AEC25E_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OC[C@H]2CO2)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""2D0B18C6CD2F8E25_03F39267E605913A_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC2CO2)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""F8D559D9EE019569_07B3F4BB7EEB44E9_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(Cl)Cl)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""D8652EE36E060AA8_504FC4A939007090_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(=C)Cl)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""EFD95126148E9F73_37A07FB166C1CD28_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(C)F)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""761C099A64A392E2_89EC76AC10245CCF_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC=CCl)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""FB822EE5BC008D5C_176423EE2A674F74_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCC(C)Br)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""0DC027F1080FAD6B_C2C445FA0779D836_6031_UN""","""COC1=CC=C(C=C1)CC(C(=O)OCCCI)C(F)(F)F""",21,"""6F908111B3F5AF56"""
+"""894B5D2B78D1B537_63BC4CFCB83AAE75_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(C)=C""",21,"""6FDD3EDC9FC0B8F6"""
+"""E79F359A5952C4A9_7FA23C1F67B47ED4_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(F)F""",21,"""6FDD3EDC9FC0B8F6"""
+"""3A73044F03A7DD33_C747D09E3339458F_6031_DP""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCNC""",21,"""6FDD3EDC9FC0B8F6"""
+"""CAC9A0BB8400590E_C3671DECD1B61EE1_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OC[C@H](C)N""",21,"""6FDD3EDC9FC0B8F6"""
+"""9F23F920398851B0_1F336C7AC5567622_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(C)S""",21,"""6FDD3EDC9FC0B8F6"""
+"""9AB84B00D15A190C_621198429197732F_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCSC""",21,"""6FDD3EDC9FC0B8F6"""
+"""5A8FFDF962E10212_21C9929741F38A58_6031_DP""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(C)N""",21,"""6FDD3EDC9FC0B8F6"""
+"""F71F2B1B00E4AD91_7576BD1D360F1FD9_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC#CC""",21,"""6FDD3EDC9FC0B8F6"""
+"""520DC2A16388B7F2_E0078AB34C1BAC06_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCON""",21,"""6FDD3EDC9FC0B8F6"""
+"""DD2C5900452D6BDA_E77C1853A8F21706_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(=C)Br""",21,"""6FDD3EDC9FC0B8F6"""
+"""351542B4B5562D09_CD4E78DAC4B3E21F_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OC[C@@H](C)N""",21,"""6FDD3EDC9FC0B8F6"""
+"""520DFADB30E107B0_FC15442A0508759D_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OC[CH]=[C]=[CH2]""",21,"""6FDD3EDC9FC0B8F6"""
+"""F1AB8BAD5602BEEC_0BCD5006CF1CE1D0_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC#CBr""",21,"""6FDD3EDC9FC0B8F6"""
+"""166D643F1C457E5A_858969331B84795E_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(C)Cl""",21,"""6FDD3EDC9FC0B8F6"""
+"""7F01905C7DBE9DD2_953006B1ACA276E3_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCCF""",21,"""6FDD3EDC9FC0B8F6"""
+"""1B2A0CBB555EA601_11F31F085DA09579_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(N)=S""",21,"""6FDD3EDC9FC0B8F6"""
+"""D7924804489A660F_106BC2EE27684B5E_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCCS""",21,"""6FDD3EDC9FC0B8F6"""
+"""6FF2DC9EC02E7836_6F9AE2BCFDA34B30_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCCC""",21,"""6FDD3EDC9FC0B8F6"""
+"""36157CC60E97EF94_EDF82B4A3FF5DFC4_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCCN""",21,"""6FDD3EDC9FC0B8F6"""
+"""681B256533429AAD_4DF9ACA8CA451E77_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCCBr""",21,"""6FDD3EDC9FC0B8F6"""
+"""3676525EE2280EE5_0825981F6FE3B257_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(C)C""",21,"""6FDD3EDC9FC0B8F6"""
+"""4823F5CAD848B574_3A6F46DE64702AE0_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC3CC3""",21,"""6FDD3EDC9FC0B8F6"""
+"""B83C3B20AB9B3805_64E0FA101F6CF9E7_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCC=C""",21,"""6FDD3EDC9FC0B8F6"""
+"""9A912018A19A09CA_A5E8504BD97EF98B_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCC#C""",21,"""6FDD3EDC9FC0B8F6"""
+"""2FDAA96EA3142F74_BF822397197BE344_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCCCl""",21,"""6FDD3EDC9FC0B8F6"""
+"""751FDB2FF3241017_1178AD025A1CC5EB_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCC#N""",21,"""6FDD3EDC9FC0B8F6"""
+"""978F68031CB6C978_6E0EF05923B7CDC3_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(F)Br""",21,"""6FDD3EDC9FC0B8F6"""
+"""3EA98C404399A39D_D9E87000366B05F1_6031_DP""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCNN""",21,"""6FDD3EDC9FC0B8F6"""
+"""2D54A3AC8D455B17_269BEE87AD3C2AFA_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(=C)F""",21,"""6FDD3EDC9FC0B8F6"""
+"""5F1EC369CD139EB5_2253AA9A4FD5DE5F_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC=CBr""",21,"""6FDD3EDC9FC0B8F6"""
+"""0FA19535AAE5D8A4_B09707933997A14A_6031_DP""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCCO""",21,"""6FDD3EDC9FC0B8F6"""
+"""9F7BA453A94CBB44_5E8C688B844A806D_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCOC""",21,"""6FDD3EDC9FC0B8F6"""
+"""11C4CEFD5712B891_0A88FF2B055F9ED9_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OC[C@@H]3CO3""",21,"""6FDD3EDC9FC0B8F6"""
+"""AE17BC768DCBE34F_ED87AEA28B9BD5FE_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OC[C@H]3CO3""",21,"""6FDD3EDC9FC0B8F6"""
+"""81F68324786676C7_03BE2DAACA30869A_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC3CO3""",21,"""6FDD3EDC9FC0B8F6"""
+"""659D369C810B81BF_07FE4B7652DE5349_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(Cl)Cl""",21,"""6FDD3EDC9FC0B8F6"""
+"""4F544CCBD16A929C_50027B6415356730_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(=C)Cl""",21,"""6FDD3EDC9FC0B8F6"""
+"""D0456E4AFEEF508E_37EDC07C4AF4DA88_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(C)F""",21,"""6FDD3EDC9FC0B8F6"""
+"""E8644336E4357FC7_89A1C9613C114B6F_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC=CCl""",21,"""6FDD3EDC9FC0B8F6"""
+"""B315F05FD29C9A5C_17299C23065258D4_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCC(C)Br""",21,"""6FDD3EDC9FC0B8F6"""
+"""A1925723C1924E01_C289FA372B4CCF96_6031_UN""","""CC1=NC2=C(C(=C1)C)C(=N[N]2C)OCC(=O)OCCCI""",21,"""6FDD3EDC9FC0B8F6"""
+"""46055B7459A87805_7C844EB31D483A5B_6031_UN""","""CC(C)[N]1N=CC=C1[C@@H]2OCCC[C@H]2C(=O)OCC(C)=C""",21,"""70E53C933AB22CD8"""
+"""E13BDD8ED6EA53A9_609A3E50C2C6EAFA_6031_UN""","""CC(C)[N]1N=CC=C1[C@@H]2OCCC[C@H]2C(=O)OCC(F)F""",21,"""70E53C933AB22CD8"""
+"""143E7C7EBD8EC3AF_D87FD2D1964BD1A1_6031_DP""","""CC(C)[N]1N=CC=C1[C@@H]2OCCC[C@H]2C(=O)OCCNC""",21,"""70E53C933AB22CD8"""
+"""DF3ACE38E15139A2_DC5F1FA374C48ACF_6031_UN""","""CC(C)[N]1N=CC=C1[C@@H]2OCCC[C@H]2C(=O)OC[C@H](C)N""",21,"""70E53C933AB22CD8"""
+"""FB91FB320BDF9EE0_000B6E356024E20C_6031_UN""","""CC(C)[N]1N=CC=C1[C@@H]2OCCC[C@H]2C(=O)OCC(C)S""",21,"""70E53C933AB22CD8"""
+"""A67DDDC97517EA21_7D299A0D34E5E701_6031_UN""","""CC(C)[N]1N=CC=C1[C@@H]2OCCC[C@H]2C(=O)OCCSC""",21,"""70E53C933AB22CD8"""
+"""4FFB88C8F328479D_3EF190D8E4811E76_6031_DP""","""CC(C)[N]1N=CC=C1[C@@H]2OCCC[C@H]2C(=O)OCC(C)N""",21,"""70E53C933AB22CD8"""
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+"""F9E0842E97AA17DD_AA7173FAA0F8ED5B_6004_UN""","""OC(=O)C3=CC1=C(C=C(C=C1)C2=C(ON=C2C)C)C(=O)N3""",21,"""7224473D2873474A"""
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+"""953635B0B68A1413_20F7D52F69727E1F_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC2CC2)OC(C)C""",21,"""7545AD2D92C2EC09"""
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+"""87772C45EC2BD034_749663A82EB5993C_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC(F)Br)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""663D5939259CF01F_C370E3F13B69510E_6031_DP""","""CCCOC1=CC(=C(C=C1)C(=O)OCCNN)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""6126B230574BE1D9_3C037D76A03E7E05_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC(=C)F)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""F294B0C58BB9DB67_38CB396B42D78AA0_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC=CBr)OC(C)C""",21,"""7545AD2D92C2EC09"""
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+"""DD6C949539AA269F_4414FB7A8948D492_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCCOC)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""BA61065FF56E66A4_10106CDA085DCA26_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OC[C@@H]2CO2)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""829E2F016CEF21C4_F71F3D5386998101_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OC[C@H]2CO2)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""CD180249DA411F1B_1926BE5BC732D265_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC2CO2)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""007773825C738AEF_1D66D8875FDC07B6_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC(Cl)Cl)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""62A6A09148D28E76_4A9AE895183733CF_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC(=C)Cl)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""D6B7590061530A83_2D75538D47F68E77_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC(C)F)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""D5E283A925DE6D01_93395A9031131F90_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC=CCl)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""E7F344284BF56EE5_0DB10FD20B500C2B_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC(C)Br)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""9EE28DDA56EB8CB3_D81169C6264E9B69_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCCCI)OC(C)C""",21,"""7545AD2D92C2EC09"""
+"""1B247D59EE5368DD_7B7920139203E319_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(C)=C)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""1E106D8DCD0197E5_676750F04D8D33B8_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(F)F)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""8A94AAABD36881FD_DF82BC71190008E3_6031_DP""","""CC1=C(C=CC(=C1)C=CC(=O)OCCNC)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""F55248A40EC620F3_DBA27103FB8F538D_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OC[C@H](C)N)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""56F23B2204A8E24E_07F60095EF6F3B4E_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(C)S)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""824C0222C944B59E_7AD4F4ADBBAE3E43_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCSC)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""B917F905927A7910_390CFE786BCAC734_6031_DP""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(C)N)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""4AC8C230D0EE6DD8_6DB3D1F21C3652B5_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC#CC)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""1287A8BDA3D88B42_F8C2E65C6622E16A_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCON)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""0A57B5EFDCF278BB_FFB974BC82CB5A6A_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(=C)Br)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""13953E7829E1AA3A_D58B1435EE8AAF73_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OC[C@@H](C)N)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""4DF39F7F6C1A428D_E4D028C52F3138F1_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OC[CH]=[C]=[CH2])OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""DB9E61884A1C2B40_13083CE9E525ACBC_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC#CBr)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""28DA80AE50A8B17C_9D4C05DC31BD3432_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(C)Cl)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""5DE480274777C6A0_8DF56A5E869B3B8F_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCCF)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""26F2258ABB611190_093673E77799D815_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(N)=S)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""284DF2BFC0283ED6_08AEAE010D510632_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCCS)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""EAB9659A288335C6_775F8E53D79A065C_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCCC)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""E26E12B4DDEE80F6_F53D47A515CC92A8_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCCN)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""CD4B89AB4290688E_553CC047E07C531B_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCCBr)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""BC9D15D2C05B8CD5_10E0F4F045DAFF3B_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(C)C)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""7E25F9A45E63C17F_22AA2A314E49678C_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC2CC2)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""CB23E68BBF912F5B_7C2596FF3555B48B_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCC=C)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""895E397F3B56A968_BD2D3CA4F347B4E7_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCC#C)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""5F558CBE14E89825_A7474F783342AE28_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCCCl)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""10FF9E2C4DDBA747_09BDC1ED70258887_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCC#N)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""1612CBCCA1C653FB_76CB9CB6098E80AF_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(F)Br)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""B43B8D6B94FF4169_C12D1CEF1C52489D_6031_DP""","""CC1=C(C=CC(=C1)C=CC(=O)OCCNN)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""3B5DEEEE0DDAB9A0_3E5E826887056796_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(=C)F)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""6D2EE952A8F2FB69_3A96C67565EC9333_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC=CBr)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""869F0FF8122F2894_A8526B7C13AEEC26_6031_DP""","""CC1=C(C=CC(=C1)C=CC(=O)OCCCO)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""8D33F9B74A8279F8_46490464AE73CD01_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCOC)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""53C42ED702312C3E_124D93C42F66D3B5_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OC[C@@H]2CO2)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""EA1E4440BEE21F0A_F542C24DA1A29892_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OC[C@H]2CO2)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""BDBE5B98BF4BD8F2_1B7B4145E009CBF6_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC2CO2)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""EDAB2ACD115E17DF_1F3B279978E71E25_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(Cl)Cl)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""4DB27CC715992963_48C7178B3F0C2A5C_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(=C)Cl)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""82624379C3CA8391_2F28AC9360CD97E4_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(C)F)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""AA0835088F054B95_9164A58E16280603_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC=CCl)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""A87ACA5F5104091F_0FECF0CC2C6B15B8_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCC(C)Br)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""50E27C9AACF2815A_DA4C96D8017582FA_6031_UN""","""CC1=C(C=CC(=C1)C=CC(=O)OCCCI)OC(F)(F)F""",21,"""77185233B5F9F59A"""
+"""77DBA15169F65491_A650BD99CBBF9F6C_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=CC(=C3)C""",21,"""788BA3208A4DB699"""
+"""D1E72208C4D9DFCE_878CC65300F621FF_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=C(C)C=C3""",21,"""788BA3208A4DB699"""
+"""552B5BB5FC11AACA_3E2300258D897DA5_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC(=CC=C3)F""",21,"""788BA3208A4DB699"""
+"""1BD479438F9687B7_A433D9C7E7ED436E_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC(=CN=C3)F""",21,"""788BA3208A4DB699"""
+"""0F957392CBE5E80D_D3716BBDFDE60B0B_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(N)C=CN=C3""",21,"""788BA3208A4DB699"""
+"""7F27FC1D75DA69A3_C7D1C7926BD24064_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CN=C(C=C3)F""",21,"""788BA3208A4DB699"""
+"""D82AE17C8E695E17_DA41D701A390938D_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(C=CC=C3)Cl""",21,"""788BA3208A4DB699"""
+"""4BFE169F4D5278A9_60ACB78E5818D4D8_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=C(C#N)S3""",21,"""788BA3208A4DB699"""
+"""83BAC8193D85AE0A_A74FDBAB01D83811_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(N=CC=C3)Cl""",21,"""788BA3208A4DB699"""
+"""CE7C1B58884005E2_4938794625E7D68E_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC(=CC=C3)O""",21,"""788BA3208A4DB699"""
+"""2ABB0381EC39AF97_B6B02AC25C2750F0_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(N=CC=C3)F""",21,"""788BA3208A4DB699"""
+"""A393C2AADD22D827_3CEA3372F4C6E6F4_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=C(C=C3)O""",21,"""788BA3208A4DB699"""
+"""1D283A5761AA22F0_2655D3401DD21DAC_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CN=C(C=C3)Cl""",21,"""788BA3208A4DB699"""
+"""7B7C047266FB3510_0DE83DEC23E66091_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=CC(=C3)N""",21,"""788BA3208A4DB699"""
+"""20C373ADEB31AC3A_773DC9F62F706880_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CN=C(N)C=C3""",21,"""788BA3208A4DB699"""
+"""759EE790B7A1C1C9_A0DE97E702C61C88_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(ON=C3C)C""",21,"""788BA3208A4DB699"""
+"""AD7C1A02FDBD8E52_FFB01ECC3D803C02_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CSC(=C3)C#N""",21,"""788BA3208A4DB699"""
+"""0B93B02A9CF9A739_22B203ECFEB1141A_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=N[N]3CC""",21,"""788BA3208A4DB699"""
+"""CA0F25AE7980C037_0679C930F626DB93_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC(=C(Cl)S3)Cl""",21,"""788BA3208A4DB699"""
+"""CAAC4E364B1310AD_2DBE39BEB1F0FF9F_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC(=NS3)OC""",21,"""788BA3208A4DB699"""
+"""916533CFDBFA5553_5E49EA45B532EBB5_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC(=CC=C3)Cl""",21,"""788BA3208A4DB699"""
+"""CA3D2426AF877E71_D840B350FB40270E_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(C=CC=C3)O""",21,"""788BA3208A4DB699"""
+"""A5D013F5536FA044_E44B9838C6881888_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=C(C=C3)Cl""",21,"""788BA3208A4DB699"""
+"""03255EB6121DDDF6_0C5B5597437BC15F_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(C=CC=N3)Cl""",21,"""788BA3208A4DB699"""
+"""F89384332163CE27_BF17389E973B31FC_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=C(C=C3)F""",21,"""788BA3208A4DB699"""
+"""086F792F1F077B9D_69CE527835D0D5B7_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC(=NC=C3)Cl""",21,"""788BA3208A4DB699"""
+"""6BCF278371919118_73DB36CE1827ED3D_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(C)C=CC=C3""",21,"""788BA3208A4DB699"""
+"""249AA9E6647D3455_337A5B89D058771C_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(SC=C3)C#N""",21,"""788BA3208A4DB699"""
+"""F1485052D07DA16D_C686047BC12274DB_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(C=NC=C3)F""",21,"""788BA3208A4DB699"""
+"""9A3EFC91F6430C86_C4855FFCA74833DC_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(C)SC(=C3)C""",21,"""788BA3208A4DB699"""
+"""C18349FD59E22BAD_738E78F434BA6CE3_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(OC=C3)C#N""",21,"""788BA3208A4DB699"""
+"""6AFD593EE93A6AD4_80E380E4E2825AFC_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(N)C=NC=C3""",21,"""788BA3208A4DB699"""
+"""62CD785CF14A439C_FB23884F93851CF3_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(N)N=CC=C3""",21,"""788BA3208A4DB699"""
+"""E3D86C8385B41520_F74B36262A60F968_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(C=CO3)C#N""",21,"""788BA3208A4DB699"""
+"""5B4D28258EA260DB_DB6366135C2147E8_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(C)C=NC=C3""",21,"""788BA3208A4DB699"""
+"""FCC790CA763DAFD8_32C2413D8D2B0EE6_6004_DP""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=C(CN)O3""",21,"""788BA3208A4DB699"""
+"""D6700B6D691FF700_310DFE1BC4DB7F20_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=C(SC(=C3)Cl)Cl""",21,"""788BA3208A4DB699"""
+"""6C098BA4D1EAB76A_E47C40FE246802AD_6004_DP""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=C(CN)S3""",21,"""788BA3208A4DB699"""
+"""0CBF9378914CE72F_8D1D35B038773490_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=N[N](C=C3C)C""",21,"""788BA3208A4DB699"""
+"""A393C2AADD22D827_64AB665A06FE016E_6004_DP""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=C(O)C=C3""",21,"""788BA3208A4DB699"""
+"""39779A5E6EFB0072_7247C77049ABCD2E_6004_UN""","""CC(=O)NC2=C(C=C1C(CCC1=C2)=O)C3=CC=C(C#N)O3""",21,"""788BA3208A4DB699"""
+"""C11B1863A0BC0FAA_764F528DD51AD39F_6031_UN""","""CC(C)(C(=O)OCC(C)=C)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""74CDDA0A6913F8F3_6A51226E0A94033E_6031_UN""","""CC(C)(C(=O)OCC(F)F)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""A1CCA0B2C97993E5_D2B4CEEF5E193865_6031_DP""","""CC(C)(C(=O)OCCNC)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""760E282E3193185B_D694039DBC96630B_6031_UN""","""CC(C)(C(=O)OC[C@H](C)N)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""4E8B6A066388ECF6_0AC0720BA8760BC8_6031_UN""","""CC(C)(C(=O)OCC(C)S)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""BBD0BDD789D23DF1_77E28633FCB70EC5_6031_UN""","""CC(C)(C(=O)OCCSC)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""AE6B3FDFCE8F9E0A_343A8CE62CD3F7B2_6031_DP""","""CC(C)(C(=O)OCC(C)N)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""8EB1A33EAF74B472_6085A36C5B2F6233_6031_UN""","""CC(C)(C(=O)OCC#CC)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""ECBDBFAA5B9FACE9_F5F494C2213BD1EC_6031_UN""","""CC(C)(C(=O)OCCON)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""2952DA97D01F0895_F28F0622C5D26AEC_6031_UN""","""CC(C)(C(=O)OCC(=C)Br)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""6D7FDBB2D48F2F60_D8BD66ABA9939FF5_6031_UN""","""CC(C)(C(=O)OC[C@@H](C)N)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""553E6019815E6B76_E9E65A5B68280877_6031_UN""","""CC(C)(C(=O)OC[CH]=[C]=[CH2])C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""A7D2A7D2F9F9FDC1_1E3E4E77A23C9C3A_6031_UN""","""CC(C)(C(=O)OCC#CBr)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""C5119E4EA77AD7D8_907A774276A404B4_6031_UN""","""CC(C)(C(=O)OCC(C)Cl)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""9E09851E86D41173_80C318C0C1820B09_6031_UN""","""CC(C)(C(=O)OCCCF)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""5F84EEC3D05C2CF4_040001793080E893_6031_UN""","""CC(C)(C(=O)OCC(N)=S)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""CB77E27C5AAA2E53_0598DC9F4A4836B4_6031_UN""","""CC(C)(C(=O)OCCCS)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""8FC6EF6B09DC403C_7A69FCCD908336DA_6031_UN""","""CC(C)(C(=O)OCCCC)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""4C1C905F4F52CD37_F80B353B52D5A22E_6031_UN""","""CC(C)(C(=O)OCCCN)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""21EA59879930D963_580AB2D9A765639D_6031_UN""","""CC(C)(C(=O)OCCCBr)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""0D7BDBCF304D7C8F_1DD6866E02C3CFBD_6031_UN""","""CC(C)(C(=O)OCC(C)C)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""5F70DC2E29B291F0_2F9C58AF0950570A_6031_UN""","""CC(C)(C(=O)OCC1CC1)C2=CC=C(C=C2)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""337398E6877B4B01_7113E461724C840D_6031_UN""","""CC(C)(C(=O)OCCC=C)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""25106CF784CC61B6_B01B4E3AB45E8461_6031_UN""","""CC(C)(C(=O)OCCC#C)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""44E6BAE0B456F6E8_AA713DE6745B9EAE_6031_UN""","""CC(C)(C(=O)OCCCCl)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""6D44A2A2F2981B25_048BB373373CB801_6031_UN""","""CC(C)(C(=O)OCCC#N)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""F322D1929540C5A8_7BFDEE284E97B029_6031_UN""","""CC(C)(C(=O)OCC(F)Br)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""7033A4D3C1CB1221_CC1B6E715B4B781B_6031_DP""","""CC(C)(C(=O)OCCNN)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""7178ACD3506DAA6F_3368F0F6C01C5710_6031_UN""","""CC(C)(C(=O)OCC(=C)F)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""29D97EF6DF719AD9_37A0B4EB22F5A3B5_6031_UN""","""CC(C)(C(=O)OCC=CBr)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""54EFA132CE480E7F_A56419E254B7DCA0_6031_DP""","""CC(C)(C(=O)OCCCO)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""19B0C55B141F020C_4B7F76FAE96AFD87_6031_UN""","""CC(C)(C(=O)OCCOC)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""86866FBCEDF1EDD5_1F7BE15A687FE333_6031_UN""","""CC(C)(C(=O)OC[C@@H]1CO1)C2=CC=C(C=C2)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""A90A999F1ABEC41D_F874B0D3E6BBA814_6031_UN""","""CC(C)(C(=O)OC[C@H]1CO1)C2=CC=C(C=C2)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""BF2D278EB730A8C8_164D33DBA710FB70_6031_UN""","""CC(C)(C(=O)OCC1CO1)C2=CC=C(C=C2)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""378F330FCC6DC196_120D55073FFE2EA3_6031_UN""","""CC(C)(C(=O)OCC(Cl)Cl)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""77D23366DA411E85_45F1651578151ADA_6031_UN""","""CC(C)(C(=O)OCC(=C)Cl)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""F53AD3E507211670_221EDE0D27D4A762_6031_UN""","""CC(C)(C(=O)OCC(C)F)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""463F007740D19A3A_9C52D71051313685_6031_UN""","""CC(C)(C(=O)OCC=CCl)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""10756511FE0237A6_02DA82526B72253E_6031_UN""","""CC(C)(C(=O)OCC(C)Br)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""392A85B3B484484D_D77AE446466CB27C_6031_UN""","""CC(C)(C(=O)OCCCI)C1=CC=C(C=C1)OC(F)(F)F""",21,"""7A2E20ADF2E0C51C"""
+"""AECE0CC4C7BACB58_76F00BF3B82885D3_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC(C)=C)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""73D5474C81DD5B1D_6AEE7B1067A65572_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC(F)F)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""1A7526B6BB2118D7_D20B9791332B6E29_6031_DP""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCCNC)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""9316809A4E31FD97_D62B5AE3D1A43547_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OC[C@H](C)N)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""5380D399697062F9_0A7F2B75C5445D84_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC(C)S)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""A3445402F1E7C63F_775DDF4D91855889_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCCSC)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""7F94554EEDF0F35F_3485D59841E1A1FE_6031_DP""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC(C)N)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""8398FFE0AF2A57F2_603AFA12361D347F_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC#CC)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""1AC8524B291176BF_F54BCDBC4C0987A0_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCCON)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""BE68A372041A4B8D_F2305F5CA8E03CA0_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC(=C)Br)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""6AFE9F0D89F6E84B_D8023FD5C4A1C9B9_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OC[C@@H](C)N)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""80DEF07980186E7D_E9590325051A5E3B_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OC[CH]=[C]=[CH2])C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""649C58C548889621_1E811709CF0ECA76_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC#CBr)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""479B1B7F6171B615_90C52E3C1B9652F8_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC(C)Cl)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""CFAB45FEB8B0FB58_807C41BEACB05D45_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCCCF)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""C2213A47C0DB5D30_04BF58075DB2BEDF_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC(N)=S)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""AA5C56A9F1DCC2BB_052785E1277A60F8_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCCCS)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""D98398945783C9CE_7AD6A5B3FDB16096_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCCCC)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""0C69C69B341D8356_F8B46C453FE7F462_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCCCN)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""4AFD375186D795EE_58B5EBA7CA5735D1_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCCCBr)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""17CA655A43B2048F_1D69DF106FF199F1_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC(C)C)C2=CC=N[N]2C""",21,"""7A9179D39FD29350"""
+"""C0AF54C21FF1AE35_2F2301D164620146_6031_UN""","""CN1[C@@H]([C@H](OCC1=O)C(=O)OCC2CC2)C3=CC=N[N]3C""",21,"""7A9179D39FD29350"""
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+"""C63EC3E2ADCD69F5_33A36639B967FD6D_6031_UN""","""CCCOC1=CC(=C(C=C1)C(=O)OCC(=C)F)OC(F)F""",21,"""7AE5B6628B9B6F61"""
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+"""C675F7179C7BE132_97DB2EB3787F55B8_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC(C)Cl""",21,"""7D8F795CFC3B9410"""
+"""F70044E3F38ABC8F_87624131CF595A05_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCCF""",21,"""7D8F795CFC3B9410"""
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+"""CEBC49188261319B_0239856E449367B8_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCCS""",21,"""7D8F795CFC3B9410"""
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+"""F431DAB756BBF8DC_FFAA6CCA5C0EF322_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCCN""",21,"""7D8F795CFC3B9410"""
+"""BD9594565389710E_5FABEB28A9BE3291_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCCBr""",21,"""7D8F795CFC3B9410"""
+"""147D26900D676E23_1A77DF9F0C189EB1_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC(C)C""",21,"""7D8F795CFC3B9410"""
+"""152F288D7F0339EE_283D015E078B0606_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC3CC3""",21,"""7D8F795CFC3B9410"""
+"""2DA54D02715A8C9B_76B2BD907C97D501_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCC=C""",21,"""7D8F795CFC3B9410"""
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+"""820A2DCCB453CEBE_ADD064177A80CFA2_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCCCl""",21,"""7D8F795CFC3B9410"""
+"""ED3A7362C9A9DB34_032AEA8239E7E90D_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCC#N""",21,"""7D8F795CFC3B9410"""
+"""35AF8B2EFCD3A6A9_7C5CB7D9404CE125_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC(F)Br""",21,"""7D8F795CFC3B9410"""
+"""54A8C0C4DAA10A3F_CBBA378055902917_6031_DP""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCNN""",21,"""7D8F795CFC3B9410"""
+"""3DAC2DC7A134C807_34C9A907CEC7061C_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC(=C)F""",21,"""7D8F795CFC3B9410"""
+"""1CA30ADA2A385005_3001ED1A2C2EF2B9_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC=CBr""",21,"""7D8F795CFC3B9410"""
+"""735FB72973ADF0FC_A2C540135A6C8DAC_6031_DP""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCCO""",21,"""7D8F795CFC3B9410"""
+"""53139C75330E0E19_4CDE2F0BE7B1AC8B_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCOC""",21,"""7D8F795CFC3B9410"""
+"""09D5A735169D1435_18DAB8AB66A4B23F_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)C[C@@H]3CO3""",21,"""7D8F795CFC3B9410"""
+"""5CE77E397A5FCC85_FFD5E922E860F918_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)C[C@H]3CO3""",21,"""7D8F795CFC3B9410"""
+"""205958910D35ADB5_11EC6A2AA9CBAA7C_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC3CO3""",21,"""7D8F795CFC3B9410"""
+"""75A767377E948BEE_15AC0CF631257FAF_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC(Cl)Cl""",21,"""7D8F795CFC3B9410"""
+"""B419131FAEFD9C97_42503CE476CE4BD6_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC(=C)Cl""",21,"""7D8F795CFC3B9410"""
+"""C38762A61C2C8913_25BF87FC290FF66E_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC(C)F""",21,"""7D8F795CFC3B9410"""
+"""E9575129D6021E71_9BF38EE15FEA6789_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC=CCl""",21,"""7D8F795CFC3B9410"""
+"""A6AF7E7D678B5B2C_057BDBA365A97432_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CC(C)Br""",21,"""7D8F795CFC3B9410"""
+"""EE97002B5838852B_D0DBBDB748B7E370_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=CC=C(C=C2)Cl)CCCI""",21,"""7D8F795CFC3B9410"""
+"""880B3160DE9DD227_A1D14B88D1F072B3_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C2=CC=C(S2)C3=CC=CC(=C3)C""",21,"""7F0A553190025B46"""
+"""DDE7C4D7A4B53AA7_800D30421AB9CC20_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C2=CC=C(S2)C3=CC=C(C)C=C3""",21,"""7F0A553190025B46"""
+"""B8CBA7A73A7EFE5B_39A2F63497C6907A_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C2=CC=C(S2)C3=CC(=CC=C3)F""",21,"""7F0A553190025B46"""
+"""75FD81B421473F79_A3B22FD6FDA2AEB1_6004_UN""","""Cl[S](=O)(=O)C1=CC=C(S1)C2=CC=C(S2)C3=CC(=CN=C3)F""",21,"""7F0A553190025B46"""
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+"""A4EA87177248BAD9_01D582060823FA19_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CCC#N""",21,"""7F7011D8CDFF8704"""
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+"""9AF427A674309C2C_C9455F0464543A03_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CCNN""",21,"""7F7011D8CDFF8704"""
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+"""1C96B1F7ED927E8E_32FE859E1DEAE1AD_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CC=CBr""",21,"""7F7011D8CDFF8704"""
+"""F740431D39828DD5_A03A28976BA89EB8_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CCCO""",21,"""7F7011D8CDFF8704"""
+"""3713C2AD2A2CEB8C_4E21478FD675BF9F_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CCOC""",21,"""7F7011D8CDFF8704"""
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+"""5954CFFB3D9CAA98_FD2A81A6D9A4EA0C_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)C[C@H]4CO4""",21,"""7F7011D8CDFF8704"""
+"""4A8356693F54E230_131302AE980FB968_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CC4CO4""",21,"""7F7011D8CDFF8704"""
+"""9F9F52CB588F4CAD_1753647200E16CBB_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CC(Cl)Cl""",21,"""7F7011D8CDFF8704"""
+"""5CB080633D5C37E7_40AF5460470A58C2_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CC(=C)Cl""",21,"""7F7011D8CDFF8704"""
+"""91B2E84B90DA3E76_2740EF7818CBE57A_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CC(C)F""",21,"""7F7011D8CDFF8704"""
+"""1F21873565216702_990CE6656E2E749D_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CC=CCl""",21,"""7F7011D8CDFF8704"""
+"""7D7B34AE890CFD61_0784B327546D6726_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CC(C)Br""",21,"""7F7011D8CDFF8704"""
+"""7765118542FA0B67_D224D5337973F064_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)N=C(O2)C3CCCO3)CCCI""",21,"""7F7011D8CDFF8704"""
+"""C944CF90026D653C_8F7D33186A178132_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC=C3)CC(C)=C""",21,"""831C41384DED97B1"""
+"""72A38091D47D6D8B_936343FBB5995193_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC=C3)CC(F)F""",21,"""831C41384DED97B1"""
+"""B0BA5770671DB078_2B86AF7AE1146AC8_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC=C3)CCNC""",21,"""831C41384DED97B1"""
+"""9B5D4F2EF9A22A0A_2FA66208039B31A6_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC=C3)C[C@H](C)N""",21,"""831C41384DED97B1"""
+"""70BF6ED2C97C916C_F3F2139E177B5965_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC=C3)CC(C)S""",21,"""831C41384DED97B1"""
+"""2CAED9964E4E6D9A_8ED0E7A643BA5C68_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC=C3)CCSC""",21,"""831C41384DED97B1"""
+"""60637F20A810B336_CD08ED7393DEA51F_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC=C3)CC(C)N""",21,"""831C41384DED97B1"""
+"""7288E459C0A940F8_99B7C2F9E422309E_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC=C3)CC#CC""",21,"""831C41384DED97B1"""
+"""3205B442B18E0A96_0CC6F5579E368341_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC=C3)CCON""",21,"""831C41384DED97B1"""
+"""39EEA7A6F658AF09_0BBD67B77ADF3841_6031_UN""","""O(C(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC=C3)CC(=C)Br""",21,"""831C41384DED97B1"""
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+"""9E92131986C2B5E6_B2F255A418D2A515_6031_UN""","""COC1=C(C(=CC=C1)C=CC(=O)OCCOC)OC(F)F""",21,"""83A303F303589D8E"""
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+"""7251760BAEAC458D_EB807659CE467631_6031_UN""","""COC1=C(C(=CC=C1)C=CC(=O)OCC(Cl)Cl)OC(F)F""",21,"""83A303F303589D8E"""
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+"""7B56B3DF523477F6_2EF7C718B7D4EAEE_6031_UN""","""COC1=C(C(=CC=C1)C=CC(=O)OCCCI)OC(F)F""",21,"""83A303F303589D8E"""
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+"""A715F44F77DB437D_2F7C9C8C3673F8CA_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OC[C@H](C)N)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
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+"""697AE167E362850B_8E0A192276529504_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCSC)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
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+"""C56606CEEF9EBD5A_996D3C7DD1CAF9F2_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC#CC)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""CC9C56727685F8E2_0C1C0BD3ABDE4A2D_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCON)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
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+"""E7F26FFBD713AA9F_2155F9BA23760434_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OC[C@@H](C)N)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""367E146CED4A134A_100EC54AE2CD93B6_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OC[CH]=[C]=[CH2])C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""11921445C5BCBCCE_E7D6D16628D907FB_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC#CBr)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""CEF44FBBA2A7D197_6992E853FC419F75_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(C)Cl)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
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+"""16024EF1B581D116_FDE89E68BA657352_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(N)=S)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""35E681851DC44806_FC70438EC0ADAD75_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCS)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""FA344D50656CE08C_838163DC1A66AD1B_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCC)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""B2268E3BAB8DB26F_01E3AA2AD83039EF_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCN)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""A53839A8FF7DCD34_A1E22DC82D80F85C_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCCBr)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""47D5C61965AE7CDD_E43E197F8826547C_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC(C)C)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""8212EB5E61069E6B_D674C7BE83B5CCCB_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCC2CC2)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""3A6DC614A40D2007_88FB7B70F8A91FCC_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCC=C)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
+"""4E07DA164072C28A_49F3D12B3EBB1FA0_6031_UN""","""COC1=C(C=CC(=C1)C=CC(=O)OCCC#C)C(F)(F)F""",21,"""83C6BFBC78055EDD"""
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+"""737B21041F75F639_17E81864502B823D_6031_UN""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OC[CH]=[C]=[CH2]""",21,"""84206292CAE34F56"""
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+"""05389EB7A05DAE8E_A604F0E69F66E9D7_6031_UN""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OCCCBr""",21,"""84206292CAE34F56"""
+"""C9BBC81E39A8D710_E3D8C4513AC045F7_6031_UN""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OCC(C)C""",21,"""84206292CAE34F56"""
+"""6DFBD68D4F6FAAB4_D1921A903153DD40_6031_UN""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OCC2CC2""",21,"""84206292CAE34F56"""
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+"""D09513D8337ADC2A_32152C4E6348F251_6031_DP""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OCCNN""",21,"""84206292CAE34F56"""
+"""D5AD09D57A1432F2_CD66B2C9F81FDD5A_6031_UN""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OCC(=C)F""",21,"""84206292CAE34F56"""
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+"""C70EC254A69717D1_5B6A5BDD6CB456EA_6031_DP""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OCCCO""",21,"""84206292CAE34F56"""
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+"""FEF7861E2E346F3B_E175A365507C6979_6031_UN""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OC[C@@H]2CO2""",21,"""84206292CAE34F56"""
+"""E32774E5FFF237EE_067AF2ECDEB8225E_6031_UN""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OC[C@H]2CO2""",21,"""84206292CAE34F56"""
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+"""0AD28049CBA38580_BBFF272A40169090_6031_UN""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OCC(=C)Cl""",21,"""84206292CAE34F56"""
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+"""EEBD89329C58EF3D_625C952F6932BCCF_6031_UN""","""CC(C)(NC1=C(C=C(C=C1)Br)[N](=O)=O)C(=O)OCC=CCl""",21,"""84206292CAE34F56"""
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+"""2B8B082F079ABAC2_166A0449EDD80861_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)C[CH]=[C]=[CH2]""",21,"""85A27EBF7710C50A"""
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+"""0C0273A3B22F7589_6FF62950F35404A2_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC(C)Cl""",21,"""85A27EBF7710C50A"""
+"""B525E9B3C230C5AF_7F4F46D244720B1F_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCCF""",21,"""85A27EBF7710C50A"""
+"""40830BA0D38509C7_FB8C5F6BB570E885_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC(N)=S""",21,"""85A27EBF7710C50A"""
+"""E2B15F782578CDA0_FA14828DCFB836A2_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCCS""",21,"""85A27EBF7710C50A"""
+"""C9FD63C030E48382_85E5A2DF157336CC_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCCC""",21,"""85A27EBF7710C50A"""
+"""9BAD0FDE85037F6D_07876B29D725A238_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCCN""",21,"""85A27EBF7710C50A"""
+"""8DD6731A752DF4BF_A786ECCB2295638B_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCCBr""",21,"""85A27EBF7710C50A"""
+"""269F741507B3900B_E25AD87C8733CFAB_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC(C)C""",21,"""85A27EBF7710C50A"""
+"""DA32A38AA9B6F46B_D01006BD8CA0571C_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC3CC3""",21,"""85A27EBF7710C50A"""
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+"""3B5D2FAFB4C62C40_4F97102831AE8477_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCC#C""",21,"""85A27EBF7710C50A"""
+"""33BC012507912799_55FD63F4F1AB9EB8_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCCCl""",21,"""85A27EBF7710C50A"""
+"""64E4353735A65F28_FB07ED61B2CCB817_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCC#N""",21,"""85A27EBF7710C50A"""
+"""957C2C600A4A690C_8471B03ACB67B03F_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC(F)Br""",21,"""85A27EBF7710C50A"""
+"""E4F3B5B2FEE0701A_33973063DEBB780D_6031_DP""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCNN""",21,"""85A27EBF7710C50A"""
+"""BA196387F369F8D1_CCE4AEE445EC5706_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC(=C)F""",21,"""85A27EBF7710C50A"""
+"""1739EE3F6642E00D_C82CEAF9A705A3A3_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC=CBr""",21,"""85A27EBF7710C50A"""
+"""A990F38D538B1C9F_5AE847F0D147DCB6_6031_DP""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCCO""",21,"""85A27EBF7710C50A"""
+"""3FD5D20DBE429E04_B4F328E86C9AFD91_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CCOC""",21,"""85A27EBF7710C50A"""
+"""E082343049BF2097_E0F7BF48ED8FE325_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)C[C@@H]3CO3""",21,"""85A27EBF7710C50A"""
+"""BBEEE8C6EFC3460B_07F8EEC1634BA802_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)C[C@H]3CO3""",21,"""85A27EBF7710C50A"""
+"""F006A21999EF4CA0_E9C16DC922E0FB66_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC3CO3""",21,"""85A27EBF7710C50A"""
+"""01940C1462752317_ED810B15BA0E2EB5_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC(Cl)Cl""",21,"""85A27EBF7710C50A"""
+"""F5BA21F71CD65DDB_BA7D3B07FDE51ACC_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC(=C)Cl""",21,"""85A27EBF7710C50A"""
+"""43FAA600CAE580F1_DD92801FA224A774_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC(C)F""",21,"""85A27EBF7710C50A"""
+"""D4C0400D9CDD327B_63DE8902D4C13693_6031_UN""","""O(C(=O)C1=CC=C(C=C1)CN2C(=O)CCC2=O)CC=CCl""",21,"""85A27EBF7710C50A"""
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+"""254F35649FF7DB1B_F67657E3F1671A17_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC(C)S""",21,"""86980545ABF1D4C3"""
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+"""20E4C0DD2B6FD94B_9C338684023E73EC_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC#CC""",21,"""86980545ABF1D4C3"""
+"""06A3A4632BE7DB48_0942B12A782AC033_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCON""",21,"""86980545ABF1D4C3"""
+"""2D9711A29BB8423F_0E3923CA9CC37B33_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC(=C)Br""",21,"""86980545ABF1D4C3"""
+"""F0368265CE05F495_240B4343F0828E2A_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OC[C@@H](C)N""",21,"""86980545ABF1D4C3"""
+"""164468F7055A8BCC_15507FB3313919A8_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OC[CH]=[C]=[CH2]""",21,"""86980545ABF1D4C3"""
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+"""2590D7BA7D9235BB_6CCC52AA2FB5156B_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC(C)Cl""",21,"""86980545ABF1D4C3"""
+"""40458AD8916E381D_7C753D2898931AD6_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCCF""",21,"""86980545ABF1D4C3"""
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+"""9B8B4ADFF26609B5_04BD10D30BC4B3F1_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCCN""",21,"""86980545ABF1D4C3"""
+"""A257D9EDA120C0C1_A4BC9731FE747242_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCCBr""",21,"""86980545ABF1D4C3"""
+"""F967A9C4E3BB3473_E160A3865BD2DE62_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC(C)C""",21,"""86980545ABF1D4C3"""
+"""AEA37FB51884F9EE_D32A7D47504146D5_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC3CC3""",21,"""86980545ABF1D4C3"""
+"""BCEDB0CD34C30FF5_8DA5C1892B5D95D2_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCC=C""",21,"""86980545ABF1D4C3"""
+"""B8F24AE2D71F0708_4CAD6BD2ED4F95BE_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCC#C""",21,"""86980545ABF1D4C3"""
+"""BC3D7D9EB81F0025_56C7180E2D4A8F71_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCCCl""",21,"""86980545ABF1D4C3"""
+"""10DFD91FFFF8F1C0_F83D969B6E2DA9DE_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCC#N""",21,"""86980545ABF1D4C3"""
+"""BF438035AC70CF3B_874BCBC01786A1F6_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC(F)Br""",21,"""86980545ABF1D4C3"""
+"""4D7185882C9C883B_30AD4B99025A69C4_6031_DP""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCNN""",21,"""86980545ABF1D4C3"""
+"""F226C7AFC2356D91_CFDED51E990D46CF_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC(=C)F""",21,"""86980545ABF1D4C3"""
+"""29851CD7A48A5AF5_CB1691037BE4B26A_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC=CBr""",21,"""86980545ABF1D4C3"""
+"""12A14E7E4231E755_59D23C0A0DA6CD7F_6031_DP""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCCO""",21,"""86980545ABF1D4C3"""
+"""B87C28DC26B46334_B7C95312B07BEC58_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCOC""",21,"""86980545ABF1D4C3"""
+"""C66D8C04AE5705DD_E3CDC4B2316EF2EC_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OC[C@@H]3CO3""",21,"""86980545ABF1D4C3"""
+"""F82EA954EED8AADB_04C2953BBFAAB9CB_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OC[C@H]3CO3""",21,"""86980545ABF1D4C3"""
+"""3777E7C31896D776_EAFB1633FE01EAAF_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC3CO3""",21,"""86980545ABF1D4C3"""
+"""AEDB75D754BDC8AD_EEBB70EF66EF3F7C_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC(Cl)Cl""",21,"""86980545ABF1D4C3"""
+"""37A6784B4203D0AF_B94740FD21040B05_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC(=C)Cl""",21,"""86980545ABF1D4C3"""
+"""FAEDC87A50F463AF_DEA8FBE57EC5B6BD_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC(C)F""",21,"""86980545ABF1D4C3"""
+"""1B64A425AE8D0D5C_60E4F2F80820275A_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC=CCl""",21,"""86980545ABF1D4C3"""
+"""211FEB3F80D716BA_FE6CA7BA326334E1_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCC(C)Br""",21,"""86980545ABF1D4C3"""
+"""52744A3B1A9AAA20_2BCCC1AE1F7DA3A3_6031_UN""","""CCCOC2=C(C=C1C=CC=CC1=N2)C(=O)OCCCI""",21,"""86980545ABF1D4C3"""
+"""858F3AF6962D3B47_858618AA953156BF_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(C)=C""",21,"""89E76A8AB2CB403C"""
+"""55D2B0898BE8DBC9_999868494ABF861E_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(F)F""",21,"""89E76A8AB2CB403C"""
+"""C79D9146FD3342D3_217D84C81E32BD45_6031_DP""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCNC""",21,"""89E76A8AB2CB403C"""
+"""0CDAB1FB275BA3AD_255D49BAFCBDE62B_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)C[C@H](C)N""",21,"""89E76A8AB2CB403C"""
+"""53B6A71ACB192804_F909382CE85D8EE8_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(C)S""",21,"""89E76A8AB2CB403C"""
+"""3D0FA8EAF02E2BAA_842BCC14BC9C8BE5_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCSC""",21,"""89E76A8AB2CB403C"""
+"""195A9DAEC1ACEC84_C7F3C6C16CF87292_6031_DP""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(C)N""",21,"""89E76A8AB2CB403C"""
+"""7A2C949FF6099D8E_934CE94B1B04E713_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC#CC""",21,"""89E76A8AB2CB403C"""
+"""E8D730FC3EC90211_063DDEE5611054CC_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCON""",21,"""89E76A8AB2CB403C"""
+"""EB0976406E151127_01464C0585F9EFCC_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(=C)Br""",21,"""89E76A8AB2CB403C"""
+"""28092F501395AB88_2B742C8CE9B81AD5_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)C[C@@H](C)N""",21,"""89E76A8AB2CB403C"""
+"""9AE854D946743739_1A2F107C28038D57_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)C[CH]=[C]=[CH2]""",21,"""89E76A8AB2CB403C"""
+"""44B28BA54669309F_EDF70450E217191A_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC#CBr""",21,"""89E76A8AB2CB403C"""
+"""DEAD2C36B18F1B4D_63B33D65368F8194_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(C)Cl""",21,"""89E76A8AB2CB403C"""
+"""E53F1BE3873F475D_730A52E781A98E29_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCCF""",21,"""89E76A8AB2CB403C"""
+"""0201EF9588A1430B_F7C94B5E70AB6DB3_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(N)=S""",21,"""89E76A8AB2CB403C"""
+"""E948C1FDB5D3A31E_F65196B80A63B394_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCCS""",21,"""89E76A8AB2CB403C"""
+"""211AB352C2DB8238_89A0B6EAD0A8B3FA_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCCC""",21,"""89E76A8AB2CB403C"""
+"""16D011297F349337_0BC27F1C12FE270E_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCCN""",21,"""89E76A8AB2CB403C"""
+"""62188CCA59C1F7A9_ABC3F8FEE74EE6BD_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCCBr""",21,"""89E76A8AB2CB403C"""
+"""A78EF8AC1BE97F05_EE1FCC4942E84A9D_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(C)C""",21,"""89E76A8AB2CB403C"""
+"""F9598928D62113B8_DC551288497BD22A_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC3CC3""",21,"""89E76A8AB2CB403C"""
+"""5032E1CDC4E62108_82DAAE463267012D_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCC=C""",21,"""89E76A8AB2CB403C"""
+"""5EF959343E8452D0_43D2041DF4750141_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCC#C""",21,"""89E76A8AB2CB403C"""
+"""56EF219E4C675568_59B877C134701B8E_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCCCl""",21,"""89E76A8AB2CB403C"""
+"""B33A9BED5BDAD026_F742F95477173D21_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCC#N""",21,"""89E76A8AB2CB403C"""
+"""F706AE2058931B09_8834A40F0EBC3509_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(F)Br""",21,"""89E76A8AB2CB403C"""
+"""CB994791C65CE3B7_3FD224561B60FD3B_6031_DP""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCNN""",21,"""89E76A8AB2CB403C"""
+"""49FA52D667D6B5A7_C0A1BAD18037D230_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(=C)F""",21,"""89E76A8AB2CB403C"""
+"""4AFED73B81BD2B1C_C469FECC62DE2695_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC=CBr""",21,"""89E76A8AB2CB403C"""
+"""6AC9BEF96EC8A154_56AD53C5149C5980_6031_DP""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCCO""",21,"""89E76A8AB2CB403C"""
+"""4FBA44AEBCD514A4_B8B63CDDA94178A7_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCOC""",21,"""89E76A8AB2CB403C"""
+"""98CB17FC516AC96E_ECB2AB7D28546613_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)C[C@@H]3CO3""",21,"""89E76A8AB2CB403C"""
+"""CF958ABCBDA0CA26_0BBDFAF4A6902D34_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)C[C@H]3CO3""",21,"""89E76A8AB2CB403C"""
+"""202E95907FDF5C88_E58479FCE73B7E50_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC3CO3""",21,"""89E76A8AB2CB403C"""
+"""B34EB464604D359D_E1C41F207FD5AB83_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(Cl)Cl""",21,"""89E76A8AB2CB403C"""
+"""4372D2902ED454B7_B6382F32383E9FFA_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(=C)Cl""",21,"""89E76A8AB2CB403C"""
+"""A5DE2DB0B38ED510_D1D7942A67FF2242_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(C)F""",21,"""89E76A8AB2CB403C"""
+"""1E3B14B4A604A3EC_6F9B9D37111AB3A5_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC=CCl""",21,"""89E76A8AB2CB403C"""
+"""D19773E0715931CE_F113C8752B59A01E_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CC(C)Br""",21,"""89E76A8AB2CB403C"""
+"""4C7296BE3FA098DF_24B3AE610647375C_6031_UN""","""O(C(=O)C1(CCCCCC1)C2=CC=C(C=C2)Br)CCCI""",21,"""89E76A8AB2CB403C"""
+"""25F456E132A2A6C6_877E3F3D25702237_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCC(C)=C""",21,"""8B1F4D1D028A34B4"""
+"""9C8E53A4267B1440_9B604FDEFAFEF296_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCC(F)F""",21,"""8B1F4D1D028A34B4"""
+"""61A91F0C10EF0CFE_2385A35FAE73C9CD_6031_DP""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCCNC""",21,"""8B1F4D1D028A34B4"""
+"""B5D6B27BAA372586_27A56E2D4CFC92A3_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OC[C@H](C)N""",21,"""8B1F4D1D028A34B4"""
+"""7D85A346E4178C45_FBF11FBB581CFA60_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCC(C)S""",21,"""8B1F4D1D028A34B4"""
+"""FEF8BC5871BEA11C_86D3EB830CDDFF6D_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCCSC""",21,"""8B1F4D1D028A34B4"""
+"""412BD739D9FC1596_C50BE156DCB9061A_6031_DP""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCC(C)N""",21,"""8B1F4D1D028A34B4"""
+"""BE2EC564B8AD2F99_91B4CEDCAB45939B_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCC#CC""",21,"""8B1F4D1D028A34B4"""
+"""58ABB1C556394341_04C5F972D1512044_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCCON""",21,"""8B1F4D1D028A34B4"""
+"""1CA47A94B82FA413_03BE6B9235B89B44_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCC(=C)Br""",21,"""8B1F4D1D028A34B4"""
+"""BF3DD657480353A4_298C0B1B59F96E5D_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OC[C@@H](C)N""",21,"""8B1F4D1D028A34B4"""
+"""89BD607ED64B6F3F_18D737EB9842F9DF_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OC[CH]=[C]=[CH2]""",21,"""8B1F4D1D028A34B4"""
+"""988DA754E1180ABB_EF0F23C752566D92_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCC#CBr""",21,"""8B1F4D1D028A34B4"""
+"""4D7D04E6E57FF551_614B1AF286CEF51C_6031_UN""","""CC(C)[N]1N=CC(=C1C2=CC=CC=C2)C(=O)OCC(C)Cl""",21,"""8B1F4D1D028A34B4"""
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+"""F8F6CB6F552F3A38_8003AFC1CA0F1967_6031_UN""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CC(C)=C""",21,"""8C62DDE1EDF50FE4"""
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+"""705F31B496A6BE38_8C2501818F96FC22_6031_UN""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CCCC""",21,"""8C62DDE1EDF50FE4"""
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+"""D0B6FAFAFC3EF98D_EB9A7B221DD60545_6031_UN""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CC(C)C""",21,"""8C62DDE1EDF50FE4"""
+"""173B9BA8179AF2D2_D9D0A5E316459DF2_6031_UN""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CC3CC3""",21,"""8C62DDE1EDF50FE4"""
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+"""0EB13D7FA50C90C7_5C3DC0AA6B4E5456_6031_UN""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CCCCl""",21,"""8C62DDE1EDF50FE4"""
+"""3A3E7F5F2D8CF6D1_F2C74E3F282972F9_6031_UN""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CCC#N""",21,"""8C62DDE1EDF50FE4"""
+"""40112BB07EAA9058_8DB1136451827AD1_6031_UN""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CC(F)Br""",21,"""8C62DDE1EDF50FE4"""
+"""12151413C76F6013_3A57933D445EB2E3_6031_DP""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CCNN""",21,"""8C62DDE1EDF50FE4"""
+"""D66971B44D9659F4_C5240DBADF099DE8_6031_UN""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CC(=C)F""",21,"""8C62DDE1EDF50FE4"""
+"""B71CDA0C591172F2_C1EC49A73DE0694D_6031_UN""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CC=CBr""",21,"""8C62DDE1EDF50FE4"""
+"""C549DF484741DD9F_5328E4AE4BA21658_6031_DP""","""O(C(=O)CCN1C(=O)NC(=O)C2=C1C=CC=C2)CCCO""",21,"""8C62DDE1EDF50FE4"""
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+"""D151B6F6387951EB_325633334C15AFDF_6004_DP""","""CN(CC1=NC(=CC=C1)C2=C(C)SC(=C2)C)C3CC(C3)N""",21,"""8E58CFEF61102A9A"""
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+"""63B7E329030E9CEA_12AF2C31CF359EAE_6004_DP""","""CN(CC1=NC(=CC=C1)C2=CC=C(CN)S2)C3CC(C3)N""",21,"""8E58CFEF61102A9A"""
+"""D88BA80D066DBF3B_7BCE597FD32AA893_6004_DP""","""CN(CC1=NC(=CC=C1)C2=N[N](C=C2C)C)C3CC(C3)N""",21,"""8E58CFEF61102A9A"""
+"""F7DF347F1CF618CD_92780A95EDA39D6D_6004_DP""","""CN(CC1=NC(=CC=C1)C2=CC=C(O)C=C2)C3CC(C3)N""",21,"""8E58CFEF61102A9A"""
+"""AC4700674E64EE38_8494ABBFA2F6512D_6004_DP""","""CN(CC1=NC(=CC=C1)C2=CC=C(C#N)O2)C3CC(C3)N""",21,"""8E58CFEF61102A9A"""
+"""7892DC8027CCE4C8_829D613742F50BA4_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(C)=C""",21,"""8EFC1317650F1D27"""
+"""FC7A41853D1BE6E2_9E8311D49D7BDB05_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(F)F""",21,"""8EFC1317650F1D27"""
+"""605597BB4357C9AD_2666FD55C9F6E05E_6031_DP""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCNC""",21,"""8EFC1317650F1D27"""
+"""2EB6C0A5DCB205E1_224630272B79BB30_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OC[C@H](C)N""",21,"""8EFC1317650F1D27"""
+"""D790D51C4CD7C008_FE1241B13F99D3F3_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(C)S""",21,"""8EFC1317650F1D27"""
+"""16243BC3227B0889_8330B5896B58D6FE_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCSC""",21,"""8EFC1317650F1D27"""
+"""53399FE529828E4F_C0E8BF5CBB3C2F89_6031_DP""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(C)N""",21,"""8EFC1317650F1D27"""
+"""B17393932DE760EA_945790D6CCC0BA08_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC#CC""",21,"""8EFC1317650F1D27"""
+"""826C6EA35967E6D1_0126A778B6D409D7_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCON""",21,"""8EFC1317650F1D27"""
+"""F95CF190BC13C121_065D3598523DB2D7_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(=C)Br""",21,"""8EFC1317650F1D27"""
+"""7EE84E957A2B1F4C_2C6F55113E7C47CE_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OC[C@@H](C)N""",21,"""8EFC1317650F1D27"""
+"""9AC17D790DD27C03_1D3469E1FFC7D04C_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OC[CH]=[C]=[CH2]""",21,"""8EFC1317650F1D27"""
+"""2CBD00FB54C5C710_EAEC7DCD35D34401_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC#CBr""",21,"""8EFC1317650F1D27"""
+"""24BE27B55326EC43_64A844F8E14BDC8F_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(C)Cl""",21,"""8EFC1317650F1D27"""
+"""F359629191A74E37_74112B7A566DD332_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCCF""",21,"""8EFC1317650F1D27"""
+"""75D02B216D7B69D4_F0D232C3A76F30A8_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(N)=S""",21,"""8EFC1317650F1D27"""
+"""696F71E9C95722EB_F14AEF25DDA7EE8F_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCCS""",21,"""8EFC1317650F1D27"""
+"""464444D05D237D97_8EBBCF77076CEEE1_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCCC""",21,"""8EFC1317650F1D27"""
+"""EE60A3444760583A_0CD90681C53A7A15_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCCN""",21,"""8EFC1317650F1D27"""
+"""C51AB5DD7DD10288_ACD88163308ABBA6_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCCBr""",21,"""8EFC1317650F1D27"""
+"""B09666964D56D48D_E904B5D4952C1786_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(C)C""",21,"""8EFC1317650F1D27"""
+"""823C5D2C299C977B_DB4E6B159EBF8F31_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC3CC3""",21,"""8EFC1317650F1D27"""
+"""CF5DC785687BA2E3_85C1D7DBE5A35C36_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCC=C""",21,"""8EFC1317650F1D27"""
+"""41E78A66B4683E23_44C97D8023B15C5A_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCC#C""",21,"""8EFC1317650F1D27"""
+"""590344B43A0EB185_5EA30E5CE3B44695_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCCCl""",21,"""8EFC1317650F1D27"""
+"""61BF72E59DC3C635_F05980C9A0D3603A_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCC#N""",21,"""8EFC1317650F1D27"""
+"""AEAD4203A381EDC0_8F2FDD92D9786812_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(F)Br""",21,"""8EFC1317650F1D27"""
+"""F42540EF8E62ACB5_38C95DCBCCA4A020_6031_DP""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCNN""",21,"""8EFC1317650F1D27"""
+"""08BD033878A4440F_C7BAC34C57F38F2B_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(=C)F""",21,"""8EFC1317650F1D27"""
+"""6C0F7E2C5F45B445_C3728751B51A7B8E_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC=CBr""",21,"""8EFC1317650F1D27"""
+"""935B09EFDFCB5A22_51B62A58C358049B_6031_DP""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCCO""",21,"""8EFC1317650F1D27"""
+"""F0C992DC633065DB_BFAD45407E8525BC_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCOC""",21,"""8EFC1317650F1D27"""
+"""0EF4FF6CE8A61A83_EBA9D2E0FF903B08_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OC[C@@H]3CO3""",21,"""8EFC1317650F1D27"""
+"""F1D74D9B7B37CDA4_0CA683697154702F_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OC[C@H]3CO3""",21,"""8EFC1317650F1D27"""
+"""7C7021B107E1C478_E29F006130FF234B_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC3CO3""",21,"""8EFC1317650F1D27"""
+"""2A519E5AAEE26F11_E6DF66BDA811F698_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(Cl)Cl""",21,"""8EFC1317650F1D27"""
+"""22A0E286A4862DB3_B12356AFEFFAC2E1_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(=C)Cl""",21,"""8EFC1317650F1D27"""
+"""2E28C637D72FA990_D6CCEDB7B03B7F59_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(C)F""",21,"""8EFC1317650F1D27"""
+"""55C31FF53FDFACD0_6880E4AAC6DEEEBE_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC=CCl""",21,"""8EFC1317650F1D27"""
+"""BE1E5463DADF0F18_F608B1E8FC9DFD05_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCC(C)Br""",21,"""8EFC1317650F1D27"""
+"""2983210244E8A707_23A8D7FCD1836A47_6031_UN""","""CC1=C(C2=C([NH]1)C=CC=C2)CC(F)(F)C(=O)OCCCI""",21,"""8EFC1317650F1D27"""
+"""31F6FFC84B1D5E12_51BAF883EC060A48_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=CC(=C2)C""",21,"""8F61E63AADF423BD"""
+"""8FD7C16CF33B2E17_70668349274FB4DB_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=C(C)C=C2""",21,"""8F61E63AADF423BD"""
+"""F40F5339B6CDCB7A_C9C9453FAA30E881_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC(=CC=C2)F""",21,"""8F61E63AADF423BD"""
+"""7A250F3C574FEADF_53D99CDDC054D64A_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC(=CN=C2)F""",21,"""8F61E63AADF423BD"""
+"""6BC3F240CAFC00F2_249B2EA7DA5F9E2F_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(N)C=CN=C2""",21,"""8F61E63AADF423BD"""
+"""12CB0FDBD12EFC0D_303B82884C6BD540_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CN=C(C=C2)F""",21,"""8F61E63AADF423BD"""
+"""339E93A8FE854641_2DAB921B842906A9_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(C=CC=C2)Cl""",21,"""8F61E63AADF423BD"""
+"""0E811929542B2099_9746F2947FA141FC_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=C(C#N)S2""",21,"""8F61E63AADF423BD"""
+"""50213252721D99BA_50A59EB12661AD35_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(N=CC=C2)Cl""",21,"""8F61E63AADF423BD"""
+"""05BE8DDBCC3B63CE_BED23C5C025E43AA_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC(=CC=C2)O""",21,"""8F61E63AADF423BD"""
+"""A51E21675385F1B6_415A6FD87B9EC5D4_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(N=CC=C2)F""",21,"""8F61E63AADF423BD"""
+"""4E58F1B00164102B_CB007668D37F73D0_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=C(C=C2)O""",21,"""8F61E63AADF423BD"""
+"""E69D313541E12C29_D1BF965A3A6B8888_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CN=C(C=C2)Cl""",21,"""8F61E63AADF423BD"""
+"""D2134240E715BAE8_FA0278F6045FF5B5_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=CC(=C2)N""",21,"""8F61E63AADF423BD"""
+"""1A1BAC6C7CD11197_80D78CEC08C9FDA4_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CN=C(N)C=C2""",21,"""8F61E63AADF423BD"""
+"""AC5EE7FCC80FE273_5734D2FD257F89AC_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(ON=C2C)C""",21,"""8F61E63AADF423BD"""
+"""692E280C32D9D75E_085A5BD61A39A926_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CSC(=C2)C#N""",21,"""8F61E63AADF423BD"""
+"""2B3BEA4FA130D76D_D55846F6D908813E_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=N[N]2CC""",21,"""8F61E63AADF423BD"""
+"""9A2BB80B119F55A5_F1938C2AD19F4EB7_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC(=C(Cl)S2)Cl""",21,"""8F61E63AADF423BD"""
+"""46A9C828D5B4A253_DA547CA496496ABB_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC(=NS2)OC""",21,"""8F61E63AADF423BD"""
+"""FC875FD04BB06620_A9A3AF5F928B7E91_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC(=CC=C2)Cl""",21,"""8F61E63AADF423BD"""
+"""129EBB60164D47DB_2FAAF64ADCF9B22A_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(C=CC=C2)O""",21,"""8F61E63AADF423BD"""
+"""936A9897A990EC18_13A1DD22E1318DAC_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=C(C=C2)Cl""",21,"""8F61E63AADF423BD"""
+"""CBE49484602601E2_FBB1108D64C2547B_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(C=CC=N2)Cl""",21,"""8F61E63AADF423BD"""
+"""19531A54EB1A1233_48FD7D84B082A4D8_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=C(C=C2)F""",21,"""8F61E63AADF423BD"""
+"""E0760EBF164E5752_9E24176212694093_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC(=NC=C2)Cl""",21,"""8F61E63AADF423BD"""
+"""7CB909F0F33BAAA2_843173D43F9E7819_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(C)C=CC=C2""",21,"""8F61E63AADF423BD"""
+"""9FBBFC65A87D1E9B_C4901E93F7E1E238_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(SC=C2)C#N""",21,"""8F61E63AADF423BD"""
+"""91B6538D5DF60098_316C4161E69BE1FF_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(C=NC=C2)F""",21,"""8F61E63AADF423BD"""
+"""FB7BCDC4D71C50B8_336F1AE680F1A6F8_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(C)SC(=C2)C""",21,"""8F61E63AADF423BD"""
+"""8328B91D10FEBB8A_84643DEE1303F9C7_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(OC=C2)C#N""",21,"""8F61E63AADF423BD"""
+"""241F641C5902340E_7709C5FEC53BCFD8_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(N)C=NC=C2""",21,"""8F61E63AADF423BD"""
+"""CE718243763AEF4A_0CC9CD55B43C89D7_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(N)N=CC=C2""",21,"""8F61E63AADF423BD"""
+"""68760BA9C4D81998_00A1733C0DD96C4C_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(C=CO2)C#N""",21,"""8F61E63AADF423BD"""
+"""67EA9F055FD05C8E_2C8923097B98D2CC_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(C)C=NC=C2""",21,"""8F61E63AADF423BD"""
+"""3A5A138ADF8E8B51_C5280427AA929BC2_6004_DP""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=C(CN)O2""",21,"""8F61E63AADF423BD"""
+"""D8679FD5AACBCB1C_C6E7BB01E362EA04_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=C(SC(=C2)Cl)Cl""",21,"""8F61E63AADF423BD"""
+"""C385DDD3FE00D2DE_139605E403D19789_6004_DP""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=C(CN)S2""",21,"""8F61E63AADF423BD"""
+"""12F661A5B30EF0AB_7AF770AA1FCEA1B4_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=N[N](C=C2C)C""",21,"""8F61E63AADF423BD"""
+"""4E58F1B00164102B_934123402147944A_6004_DP""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=C(O)C=C2""",21,"""8F61E63AADF423BD"""
+"""D0E18561D0FF4863_85AD826A6E12580A_6004_UN""","""FC(F)(F)C1=C(C(=CC=C1)[S](=O)(=O)Cl)C2=CC=C(C#N)O2""",21,"""8F61E63AADF423BD"""
+"""D84481524E1951EC_9C26A78867CC679D_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)=C""",21,"""9047D5A84036711E"""
+"""C6F1725424C1C335_8038D76BB842B73C_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(F)F""",21,"""9047D5A84036711E"""
+"""65693CA6927520DA_38DD3BEAECCF8C67_6031_DP""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCNC""",21,"""9047D5A84036711E"""
+"""5BEE205B3054BCA9_3CFDF6980E40D709_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OC[C@H](C)N""",21,"""9047D5A84036711E"""
+"""D049440FA9E5DB91_E0A9870E1AA0BFCA_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)S""",21,"""9047D5A84036711E"""
+"""C2172A33BB3FA84B_9D8B73364E61BAC7_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCSC""",21,"""9047D5A84036711E"""
+"""1E270C55C9D9624F_DE5379E39E0543B0_6031_DP""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)N""",21,"""9047D5A84036711E"""
+"""A9315C1A8E9129FF_8AEC5669E9F9D631_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC#CC""",21,"""9047D5A84036711E"""
+"""2EC8614B36A21160_1F9D61C793ED65EE_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCON""",21,"""9047D5A84036711E"""
+"""0C2455642C59FC68_18E6F3277704DEEE_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(=C)Br""",21,"""9047D5A84036711E"""
+"""8CCF567C292160DC_32D493AE1B452BF7_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OC[C@@H](C)N""",21,"""9047D5A84036711E"""
+"""8E7D64516CF94F9F_038FAF5EDAFEBC75_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OC[CH]=[C]=[CH2]""",21,"""9047D5A84036711E"""
+"""69BAC705E5551363_F457BB7210EA2838_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC#CBr""",21,"""9047D5A84036711E"""
+"""8EB11E0C171B10F0_7A138247C472B0B6_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)Cl""",21,"""9047D5A84036711E"""
+"""04D6B7E37A3B008C_6AAAEDC57354BF0B_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCCF""",21,"""9047D5A84036711E"""
+"""1305789ABF325C81_EE69F47C82565C91_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(N)=S""",21,"""9047D5A84036711E"""
+"""28369E18D6FF0B3C_EFF1299AF89E82B6_6031_UN""","""CCC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCCS""",21,"""9047D5A84036711E"""
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+"""BE2F95662B7A0E83_199FF19F36D120D4_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CC(=C)Br""",21,"""913ED71001E38F24"""
+"""3EE7436D6544C371_33AD91165A90D5CD_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)C[C@@H](C)N""",21,"""913ED71001E38F24"""
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+"""20988280784104FF_F52EB9CA513FD602_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CC#CBr""",21,"""913ED71001E38F24"""
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+"""20E5DC1953C51BA6_F6C671D3F1C08585_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CC(C)C""",21,"""913ED71001E38F24"""
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+"""F420167E686DE780_4161CA5B8758D496_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CCCCl""",21,"""913ED71001E38F24"""
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+"""B1B78AC2E4C1896B_90ED1995BD94FA11_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CC(F)Br""",21,"""913ED71001E38F24"""
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+"""C4F81A1493C89DD3_DCB04356D1F6E98D_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CC=CBr""",21,"""913ED71001E38F24"""
+"""1C3F9F4B7227C942_4E74EE5FA7B49698_6031_DP""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CCCO""",21,"""913ED71001E38F24"""
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+"""E3BC86C4F4553773_F46B16E79B7CA90B_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)C[C@@H]3CO3""",21,"""913ED71001E38F24"""
+"""2296F213AA20386A_1364476E15B8E22C_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)C[C@H]3CO3""",21,"""913ED71001E38F24"""
+"""6C0006D910E0769A_FD5DC4665413B148_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CC3CO3""",21,"""913ED71001E38F24"""
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+"""58C6D733DA1D7918_AEE192A88B1650E2_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CC(=C)Cl""",21,"""913ED71001E38F24"""
+"""141A19D9EEC5371A_C90E29B0D4D7ED5A_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CC(C)F""",21,"""913ED71001E38F24"""
+"""42BBCCA135AF6A93_774220ADA2327CBD_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CC=CCl""",21,"""913ED71001E38F24"""
+"""382867F4F077B537_E9CA75EF98716F06_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CC(C)Br""",21,"""913ED71001E38F24"""
+"""68F05488225040DA_3C6A13FBB56FF844_6031_UN""","""O(C(=O)C=CC1=CC=C(C=C1)N2CCCC2=O)CCCI""",21,"""913ED71001E38F24"""
+"""152D6B09D1437EA2_9EF9EE96FD64BD73_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(C)=C""",21,"""92989CB6DA9EABF0"""
+"""11D5F900EC9F23F3_82E79E7522EA6DD2_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(F)F""",21,"""92989CB6DA9EABF0"""
+"""9DC2D89124C9410A_3A0272F476675689_6031_DP""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCNC""",21,"""92989CB6DA9EABF0"""
+"""E2D84C98461F9485_3E22BF8694E80DE7_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OC[C@H](C)N""",21,"""92989CB6DA9EABF0"""
+"""42F5CB9B26B9073C_E276CE1080086524_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(C)S""",21,"""92989CB6DA9EABF0"""
+"""DF0CE5430D92F938_9F543A28D4C96029_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCSC""",21,"""92989CB6DA9EABF0"""
+"""88F208CF244A36CD_DC8C30FD04AD995E_6031_DP""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(C)N""",21,"""92989CB6DA9EABF0"""
+"""B525C412CA594239_88331F7773510CDF_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC#CC""",21,"""92989CB6DA9EABF0"""
+"""998BB6A32DA70C40_1D4228D90945BF00_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCON""",21,"""92989CB6DA9EABF0"""
+"""D04D7CE55BC881EF_1A39BA39EDAC0400_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(=C)Br""",21,"""92989CB6DA9EABF0"""
+"""3FA83B3F91D115AA_300BDAB081EDF119_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OC[C@@H](C)N""",21,"""92989CB6DA9EABF0"""
+"""0C9F50912E751823_0150E6404056669B_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OC[CH]=[C]=[CH2]""",21,"""92989CB6DA9EABF0"""
+"""77402CCDD9D640FA_F688F26C8A42F2D6_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC#CBr""",21,"""92989CB6DA9EABF0"""
+"""33D3E04A19E4CFD6_78CCCB595EDA6A58_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(C)Cl""",21,"""92989CB6DA9EABF0"""
+"""40D8708E3CC7EE4D_6875A4DBE9FC65E5_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCCF""",21,"""92989CB6DA9EABF0"""
+"""C7DE1DA1DD1879B4_ECB6BD6218FE867F_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(N)=S""",21,"""92989CB6DA9EABF0"""
+"""0A9A0335B7116FE4_ED2E608462365858_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCCS""",21,"""92989CB6DA9EABF0"""
+"""49B92D1DE760C5E3_92DF40D6B8FD5836_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCCC""",21,"""92989CB6DA9EABF0"""
+"""D4946AB7572F04E9_10BD89207AABCCC2_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCCN""",21,"""92989CB6DA9EABF0"""
+"""6EE8AF3608D5E007_B0BC0EC28F1B0D71_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCCBr""",21,"""92989CB6DA9EABF0"""
+"""9CCE1A5D08769E7E_F5603A752ABDA151_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(C)C""",21,"""92989CB6DA9EABF0"""
+"""94A68A5FCF2B36A3_C72AE4B4212E39E6_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC2CC2""",21,"""92989CB6DA9EABF0"""
+"""10FC39F09AEDA1F5_99A5587A5A32EAE1_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCC=C""",21,"""92989CB6DA9EABF0"""
+"""924291AEC434C723_58ADF2219C20EA8D_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCC#C""",21,"""92989CB6DA9EABF0"""
+"""2E2B3FA07B35AADD_42C781FD5C25F042_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCCCl""",21,"""92989CB6DA9EABF0"""
+"""FC8CADF0205BA4BC_EC3D0F681F42D6ED_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCC#N""",21,"""92989CB6DA9EABF0"""
+"""DBBFFFA03B952312_934B523366E9DEC5_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(F)Br""",21,"""92989CB6DA9EABF0"""
+"""C88D80AB69F69A11_24ADD26A733516F7_6031_DP""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCNN""",21,"""92989CB6DA9EABF0"""
+"""0B0DAA300F81B3EB_DBDE4CEDE86239FC_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(=C)F""",21,"""92989CB6DA9EABF0"""
+"""AC5C47590CA16827_DF1608F00A8BCD59_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC=CBr""",21,"""92989CB6DA9EABF0"""
+"""DDF946EDD72134F7_4DD2A5F97CC9B24C_6031_DP""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCCO""",21,"""92989CB6DA9EABF0"""
+"""B141FB0A40B6A791_A3C9CAE1C114936B_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCOC""",21,"""92989CB6DA9EABF0"""
+"""E2DE1603A85C36DE_F7CD5D4140018DDF_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OC[C@@H]2CO2""",21,"""92989CB6DA9EABF0"""
+"""CDD31D93A815D168_10C20CC8CEC5C6F8_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OC[C@H]2CO2""",21,"""92989CB6DA9EABF0"""
+"""548CC30BD79BFEEF_FEFB8FC08F6E959C_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC2CO2""",21,"""92989CB6DA9EABF0"""
+"""8D1B9038CDA63237_FABBE91C1780404F_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(Cl)Cl""",21,"""92989CB6DA9EABF0"""
+"""A1D20E92A1A0A9A4_AD47D90E506B7436_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(=C)Cl""",21,"""92989CB6DA9EABF0"""
+"""7A9014CAC38C4A7E_CAA862160FAAC98E_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(C)F""",21,"""92989CB6DA9EABF0"""
+"""07D817119020A7D7_74E46B0B794F5869_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC=CCl""",21,"""92989CB6DA9EABF0"""
+"""CCE361476B134174_EA6C3E49430C4BD2_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCC(C)Br""",21,"""92989CB6DA9EABF0"""
+"""392FD2FAB4686950_3FCC585D6E12DC90_6031_UN""","""CC1=CC=C(C=C1)C(=O)CC(C)(C)CC(=O)OCCCI""",21,"""92989CB6DA9EABF0"""
+"""BEEA9D19F6EB8C54_4F0CD9E5F899F337_6016_UN""","""CSC1=NC(=C(C(=N1)N)C(=O)C2=CC3=C(C=C2)OCO3)Cl""",21,"""9308D660B46D3BB8"""
+"""8DDD632AF9E3F407_92F8873445F6C264_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=CC=C2)OC3CCCC3""",21,"""9308D660B46D3BB8"""
+"""18E4C42FBAD321EE_3D8F7F18BEE66E98_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=C(OCC)C=C2)OCC""",21,"""9308D660B46D3BB8"""
+"""E24C4FB831873583_C18F08DF210D99B2_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=CC(=C2)OCCC(C)C""",21,"""9308D660B46D3BB8"""
+"""3F71BFE0F7E30941_9DB5F089B221AFB6_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=C(C=C2)C[N]3C=CN=C3""",21,"""9308D660B46D3BB8"""
+"""6A7B182DAB6FEC0A_AE9D9F48354F591E_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=C(C=C2)OC3CCOC3""",21,"""9308D660B46D3BB8"""
+"""9BCFC2FF46E05D23_657C7B3CED38ADED_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=C(OC)C=C2)CN(C)C""",21,"""9308D660B46D3BB8"""
+"""AA5746F1556E1246_BD135F30B9FCBC65_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=CC(=C2)COCCOC""",21,"""9308D660B46D3BB8"""
+"""4B24BB097822A58A_347ED231B740B709_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=CC(=C2)CN(C)C3CC3""",21,"""9308D660B46D3BB8"""
+"""3F201B7B9D3DB04D_2B65C6D2800A506C_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=CC(=C2)OC(COC)C""",21,"""9308D660B46D3BB8"""
+"""FB74B1FB4A15E97F_79243EE60BBFF040_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=C(C(NOC)=O)C=C2)F""",21,"""9308D660B46D3BB8"""
+"""35383F95494E0567_6CDDD8D290C25102_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(OC)N=C(C=C2)C(F)(F)F""",21,"""9308D660B46D3BB8"""
+"""1ED236D8C4A43B71_1566B7FE67F86D7F_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=CC=C2)CN3CCCC3""",21,"""9308D660B46D3BB8"""
+"""D925E85A0762A76E_0C4293FC0F9482FF_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C3=CC=C([N]2C=C(C)C=N2)C=C3""",21,"""9308D660B46D3BB8"""
+"""572A4596EAA8E531_71B6CC1E88823396_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=CC(=C2)OCCN(C)C""",21,"""9308D660B46D3BB8"""
+"""F9D462250DA133B1_866B00DC19E090AD_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""9308D660B46D3BB8"""
+"""78AF1C7C034F07C9_B14C3858EE8A9319_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=C(C=C2)C3=CC=CC=C3""",21,"""9308D660B46D3BB8"""
+"""DD33E66D250DC326_6380C6DCC485B9AA_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(C=CC=C2F)OC(F)(F)F""",21,"""9308D660B46D3BB8"""
+"""8B0FF8543090ECA7_B355085431DF8DB9_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=C(C=C2)Cl)OC(F)(F)F""",21,"""9308D660B46D3BB8"""
+"""3DC3ED13E9C066D5_08DAB844EB506517_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C=CC2=CC(=CC=C2)C(F)(F)F""",21,"""9308D660B46D3BB8"""
+"""36A7D6CC7FAAC0E4_9CC03C1B22F8EF7C_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(C=C(OC)C=C2)C(F)(F)F""",21,"""9308D660B46D3BB8"""
+"""1F600874F77228FC_99FBC2BEFEC83D55_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=CC(=C2F)C(N(C)C)=O""",21,"""9308D660B46D3BB8"""
+"""51B3DA823B4F68E8_5C0064499E48A161_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=C(OC)C=C2)C(F)(F)F""",21,"""9308D660B46D3BB8"""
+"""5D0E79D3F1752D28_4C2CF41841A61595_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(C=C(C=C2)C(=O)O)[N](=O)=O""",21,"""9308D660B46D3BB8"""
+"""7087A5C9EB413C1C_913FAD21EF05E1EF_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=CC=C2)C3=CC=CC=C3""",21,"""9308D660B46D3BB8"""
+"""ED0A15899859B51F_014C495B76F86B3A_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(OC)C=C(C=C2)C(F)(F)F""",21,"""9308D660B46D3BB8"""
+"""F0160BB165CB77C1_246DF9E896F7A5E1_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(C)C=C(C=C2)OC(F)(F)F""",21,"""9308D660B46D3BB8"""
+"""3B64576369AE7B14_429049A9BF7E1481_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=C(OCCC(C)C)C=C2""",21,"""9308D660B46D3BB8"""
+"""F6685131D6957571_BFFD2ABF413484D1_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=C(C=C2)OC3CCCC3""",21,"""9308D660B46D3BB8"""
+"""3C2832DEA508D57F_3ECBF341F6CFEC05_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(C=C(OC)C=C2)CN(C)C""",21,"""9308D660B46D3BB8"""
+"""BE99011E5CC045BC_4BB491738CE348B2_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=C(N=C2)C(F)(F)F)OC""",21,"""9308D660B46D3BB8"""
+"""0B1CFFCC3F4C74EF_B45356FF5BE2B65F_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(C)C=C(C=C2)OCC3CC3""",21,"""9308D660B46D3BB8"""
+"""336E1ED4E011456E_43D4BF0A709B9B41_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(C=CC(=C2)C3(CC3)C#N)F""",21,"""9308D660B46D3BB8"""
+"""4F9F8EB40582DD31_35DF9116B8F79C2A_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(OCC(C)(C)C)N=CC=C2""",21,"""9308D660B46D3BB8"""
+"""7680474C3F4A67E7_F0EF002C2113F555_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC=C(C=C2)C[N]3C=NC=N3""",21,"""9308D660B46D3BB8"""
+"""37FD5693E33093EE_9A8B350ADE25FE35_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(OCC)C=CC(=C2)[N](=O)=O""",21,"""9308D660B46D3BB8"""
+"""B5D64B12919CE3A7_EBB0877FCF2E70C6_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""9308D660B46D3BB8"""
+"""7EB4CAF751E10CF9_597B6B0A0D677984_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=C(C=C2C3CC3)Cl)OC""",21,"""9308D660B46D3BB8"""
+"""DC24EA42EC346B8E_2CB5F98237CBE9B6_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=CC(=CC=C2)C3=CC=NC=C3""",21,"""9308D660B46D3BB8"""
+"""F38CD50D0C0D7369_7F49A1DB09B948A7_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(C=CC=C2)CN3CCCC3""",21,"""9308D660B46D3BB8"""
+"""B3713BC9704D7DED_ED9ADB59EC764FE0_6025_UN""","""C1(=NC(=C(C(=N1)N)Br)Cl)C2=C(C=C(C=C2)OC(F)(F)F)F""",21,"""9308D660B46D3BB8"""
+"""FA3BF05C0C33DFA4_992A798BAD5BC896_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(C)=C""",21,"""954B0BAB8AA1DE15"""
+"""34B3045B550D9CB6_8534096872D51837_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(F)F""",21,"""954B0BAB8AA1DE15"""
+"""730DA97571F48A12_3DD1E5E92658236C_6031_DP""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCNC""",21,"""954B0BAB8AA1DE15"""
+"""FEFC36C7B83139BD_39F1289BC4D77802_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OC[C@H](C)N""",21,"""954B0BAB8AA1DE15"""
+"""B9BA9B3DC0B43199_E5A5590DD03710C1_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(C)S""",21,"""954B0BAB8AA1DE15"""
+"""4ED90BF4F1AAE6B4_9887AD3584F615CC_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCSC""",21,"""954B0BAB8AA1DE15"""
+"""F556897532E1D117_DB5FA7E05492ECBB_6031_DP""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(C)N""",21,"""954B0BAB8AA1DE15"""
+"""5514F5931872176A_8FE0886A236E793A_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC#CC""",21,"""954B0BAB8AA1DE15"""
+"""10A11BFF494460D0_1A91BFC4597ACAE5_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCON""",21,"""954B0BAB8AA1DE15"""
+"""A3B9660C579BE934_1DEA2D24BD9371E5_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(=C)Br""",21,"""954B0BAB8AA1DE15"""
+"""9283D704C3D3AFB1_37D84DADD1D284FC_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OC[C@@H](C)N""",21,"""954B0BAB8AA1DE15"""
+"""4DA687BCC1E21FD6_0683715D1069137E_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OC[CH]=[C]=[CH2]""",21,"""954B0BAB8AA1DE15"""
+"""E14453736F462768_F15B6571DA7D8733_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC#CBr""",21,"""954B0BAB8AA1DE15"""
+"""DDC267C0833FC4A2_7F1F5C440EE51FBD_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(C)Cl""",21,"""954B0BAB8AA1DE15"""
+"""8FE31C04CC141F17_6FA633C6B9C31000_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCCF""",21,"""954B0BAB8AA1DE15"""
+"""04E56BDCA38AEB07_EB652A7F48C1F39A_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(N)=S""",21,"""954B0BAB8AA1DE15"""
+"""54926D67E2321583_EAFDF79932092DBD_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCCS""",21,"""954B0BAB8AA1DE15"""
+"""8FA0C319121F45EB_950CD7CBE8C22DD3_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCCC""",21,"""954B0BAB8AA1DE15"""
+"""90BF117BBF58C7F2_176E1E3D2A94B927_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCCN""",21,"""954B0BAB8AA1DE15"""
+"""4C33C03E575B66C9_B76F99DFDF247894_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCCBr""",21,"""954B0BAB8AA1DE15"""
+"""46B9FEAC2EC011F2_F2B3AD687A82D4B4_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(C)C""",21,"""954B0BAB8AA1DE15"""
+"""8F4F41045FDED7C1_C0F973A971114C03_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC3CC3""",21,"""954B0BAB8AA1DE15"""
+"""8FE11C7081BA9754_9E76CF670A0D9F04_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCC=C""",21,"""954B0BAB8AA1DE15"""
+"""6848B4A82EFC4C9A_5F7E653CCC1F9F68_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCC#C""",21,"""954B0BAB8AA1DE15"""
+"""11B701DD0F4161A6_451416E00C1A85A7_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCCCl""",21,"""954B0BAB8AA1DE15"""
+"""88832A2C6036790A_EBEE98754F7DA308_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCC#N""",21,"""954B0BAB8AA1DE15"""
+"""7234F60C440D9BA2_9498C52E36D6AB20_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(F)Br""",21,"""954B0BAB8AA1DE15"""
+"""1FFD97B66C360901_237E4577230A6312_6031_DP""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCNN""",21,"""954B0BAB8AA1DE15"""
+"""DF7A54AC527DB205_DC0DDBF0B85D4C19_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(=C)F""",21,"""954B0BAB8AA1DE15"""
+"""0553577D6026BD20_D8C59FED5AB4B8BC_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC=CBr""",21,"""954B0BAB8AA1DE15"""
+"""B2E3730F07096B23_4A0132E42CF6C7A9_6031_DP""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCCO""",21,"""954B0BAB8AA1DE15"""
+"""90D030F1499A74B2_A41A5DFC912BE68E_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCOC""",21,"""954B0BAB8AA1DE15"""
+"""C32E419BDFC36CE1_F01ECA5C103EF83A_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OC[C@@H]3CO3""",21,"""954B0BAB8AA1DE15"""
+"""E5BB991F7A6DA435_17119BD59EFAB31D_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OC[C@H]3CO3""",21,"""954B0BAB8AA1DE15"""
+"""DB49A5C0C4980FE5_F92818DDDF51E079_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC3CO3""",21,"""954B0BAB8AA1DE15"""
+"""3A04D7F3AC8E4F29_FD687E0147BF35AA_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(Cl)Cl""",21,"""954B0BAB8AA1DE15"""
+"""54091CFEE9D71C7E_AA944E13005401D3_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(=C)Cl""",21,"""954B0BAB8AA1DE15"""
+"""05ECB567C07E4CDB_CD7BF50B5F95BC6B_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(C)F""",21,"""954B0BAB8AA1DE15"""
+"""D500B6DA08B6F948_7337FC1629702D8C_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC=CCl""",21,"""954B0BAB8AA1DE15"""
+"""B8D08932B0D98FB6_EDBFA95413333E37_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCC(C)Br""",21,"""954B0BAB8AA1DE15"""
+"""AF9A264EAB60FE0E_381FCF403E2DA975_6031_UN""","""CCC1=C(C=N[N]1C2=C(C=CC=C2)Cl)C(=O)OCCCI""",21,"""954B0BAB8AA1DE15"""
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+"""2C61A8EDA4EDCF68_ED2D1DDFA1106C2E_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=CC(=C2)N)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""E5BA730DBD81F6CD_97F8E9C5AD86643F_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CN=C(N)C=C2)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""B0101AF02A0DB9A3_401BB7D480301037_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(ON=C2C)C)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""7E3AC0580FC9F562_1F753EFFBF7630BD_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CSC(=C2)C#N)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""F0C1FCF8C7D31E41_C27723DF7C4718A5_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=N[N]2CC)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""3A14744AD4AEB7D3_E6BCE90374D0D72C_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC(=C(Cl)S2)Cl)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""6D8BFB1A459D69B4_CD7B198D3306F320_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC(=NS2)OC)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""F58CDD8FEE4B714B_BE8CCA7637C4E70A_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC(=CC=C2)Cl)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""7CEA16EAD41C4622_3885936379B62BB1_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C=CC=C2)O)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""998F745E1AF03EAD_048EB80B447E1437_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(C=C2)Cl)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""1E0949737C9D85A8_EC9E75A4C18DCDE0_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C=CC=N2)Cl)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""54401EA238E69978_5FD218AD15CD3D43_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(C=C2)F)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""5A264B11D7A7214B_890B724BB726D908_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC(=NC=C2)Cl)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""BA139E7718CE892C_931E16FD9AD1E182_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C)C=CC=C2)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""1DEC4BBE4598201C_D3BF7BBA52AE7BA3_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(SC=C2)C#N)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""D9C434B083934C06_2643244843D47864_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C=NC=C2)F)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""5CF4CF0882012672_24407FCF25BE3F63_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C)SC(=C2)C)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""3EB2E9B53AE37B7B_934B58C7B64C605C_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(OC=C2)C#N)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""23453C5C7C797C34_6026A0D760745643_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(N)C=NC=C2)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""F4FB7A44D1D3D72E_1BE6A87C1173104C_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(N)N=CC=C2)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""7C6039C9AB940DD2_178E1615A896F5D7_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C=CO2)C#N)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""900E1C26F22320B0_3BA64620DED74B57_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(C)C=NC=C2)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""B1CC978496A59AB2_D207610E0FDD0259_6004_DP""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(CN)O2)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""188383A0347B1EF2_D1C8DE28462D739F_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=C(SC(=C2)Cl)Cl)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""7A2C6B8D24922C43_04B960CDA69E0E12_6004_DP""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(CN)S2)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""1965DE1879818D9B_6DD81583BA81382F_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=N[N](C=C2C)C)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""7C07AF37E35043EC_846E466984080DD1_6004_DP""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(O)C=C2)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""9815481D0D2C5457_9282E743CB5DC191_6004_UN""","""N[S](=O)(=O)C1=C(C=C(C=C1)C2=CC=C(C#N)O2)C(F)(F)F""",21,"""984E831308BBBA26"""
+"""8C8B8DABC6A3061D_94D791987DAADB6F_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(C)=C""",21,"""98B6E3B85A50CDEC"""
+"""835A3F120A4CE1A5_88C9E17BA2240BCE_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(F)F""",21,"""98B6E3B85A50CDEC"""
+"""7C27BBAE3CBA1869_302C0DFAF6A93095_6031_DP""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCNC""",21,"""98B6E3B85A50CDEC"""
+"""574755BAD207CA84_340CC08814266BFB_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OC[C@H](C)N""",21,"""98B6E3B85A50CDEC"""
+"""FE109008B0D3235F_E858B11E00C60338_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(C)S""",21,"""98B6E3B85A50CDEC"""
+"""0CC217DB607FAF03_957A452654070635_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCSC""",21,"""98B6E3B85A50CDEC"""
+"""A8E616D9FED3346A_D6A24FF38463FF42_6031_DP""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(C)N""",21,"""98B6E3B85A50CDEC"""
+"""0684D98FD88685ED_821D6079F39F6AC3_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC#CC""",21,"""98B6E3B85A50CDEC"""
+"""8A884DA9F7A03FDD_176C57D7898BD91C_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCON""",21,"""98B6E3B85A50CDEC"""
+"""CE1FE3E10F3B301A_1017C5376D62621C_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(=C)Br""",21,"""98B6E3B85A50CDEC"""
+"""8C676B7819903DBB_3A25A5BE01239705_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OC[C@@H](C)N""",21,"""98B6E3B85A50CDEC"""
+"""F31B76B889BFC728_0B7E994EC0980087_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OC[CH]=[C]=[CH2]""",21,"""98B6E3B85A50CDEC"""
+"""55BA986F78BB68ED_FCA68D620A8C94CA_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC#CBr""",21,"""98B6E3B85A50CDEC"""
+"""25563EAF62D50D83_72E2B457DE140C44_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(C)Cl""",21,"""98B6E3B85A50CDEC"""
+"""6DA6BBEF6D9E3FDD_625BDBD5693203F9_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCCF""",21,"""98B6E3B85A50CDEC"""
+"""2CACFD758810DBC2_E698C26C9830E063_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(N)=S""",21,"""98B6E3B85A50CDEC"""
+"""525252CDBF03BBE3_E7001F8AE2F83E44_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCCS""",21,"""98B6E3B85A50CDEC"""
+"""3862EA4798A0B3A9_98F13FD838333E2A_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCCC""",21,"""98B6E3B85A50CDEC"""
+"""4FC0012C565C4E69_1A93F62EFA65AADE_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCCN""",21,"""98B6E3B85A50CDEC"""
+"""0EB96DA5F78FB058_BA9271CC0FD56B6D_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCCBr""",21,"""98B6E3B85A50CDEC"""
+"""497965AB958D1667_FF4E457BAA73C74D_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(C)C""",21,"""98B6E3B85A50CDEC"""
+"""77A1B99CB0218961_CD049BBAA1E05FFA_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC3CC3""",21,"""98B6E3B85A50CDEC"""
+"""AE027E51846005B7_938B2774DAFC8CFD_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCC=C""",21,"""98B6E3B85A50CDEC"""
+"""751FB19BC513A5EB_52838D2F1CEE8C91_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCC#C""",21,"""98B6E3B85A50CDEC"""
+"""53D572034E1AB4C1_48E9FEF3DCEB965E_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCCCl""",21,"""98B6E3B85A50CDEC"""
+"""FBF9729B3CB214E4_E61370669F8CB0F1_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCC#N""",21,"""98B6E3B85A50CDEC"""
+"""142F6C04081B4AEC_99652D3DE627B8D9_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(F)Br""",21,"""98B6E3B85A50CDEC"""
+"""3C217E8706E89F6C_2E83AD64F3FB70EB_6031_DP""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCNN""",21,"""98B6E3B85A50CDEC"""
+"""1CA7284A9E48F32A_D1F033E368AC5FE0_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(=C)F""",21,"""98B6E3B85A50CDEC"""
+"""0D2483001DF8FF64_D53877FE8A45AB45_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC=CBr""",21,"""98B6E3B85A50CDEC"""
+"""A29B97F04CACB3F6_47FCDAF7FC07D450_6031_DP""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCCO""",21,"""98B6E3B85A50CDEC"""
+"""C701117029E53DC5_A9E7B5EF41DAF577_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCOC""",21,"""98B6E3B85A50CDEC"""
+"""C9994380B6AD5D74_FDE3224FC0CFEBC3_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OC[C@@H]3CO3""",21,"""98B6E3B85A50CDEC"""
+"""99384ABE23E3E8A3_1AEC73C64E0BA0E4_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OC[C@H]3CO3""",21,"""98B6E3B85A50CDEC"""
+"""8024AA5C7C0AFAA2_F4D5F0CE0FA0F380_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC3CO3""",21,"""98B6E3B85A50CDEC"""
+"""34D3CD11BA53EC5F_F0959612974E2653_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(Cl)Cl""",21,"""98B6E3B85A50CDEC"""
+"""651FB5C0F64A492B_A769A600D0A5122A_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(=C)Cl""",21,"""98B6E3B85A50CDEC"""
+"""B957FE2C6D651871_C0861D188F64AF92_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(C)F""",21,"""98B6E3B85A50CDEC"""
+"""12526ACEC8B510B5_7ECA1405F9813E75_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC=CCl""",21,"""98B6E3B85A50CDEC"""
+"""139E80734058FAE3_E0424147C3C22DCE_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCC(C)Br""",21,"""98B6E3B85A50CDEC"""
+"""7F1AAE240192E02A_35E22753EEDCBA8C_6031_UN""","""CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)OCCCI""",21,"""98B6E3B85A50CDEC"""
+"""671543F5566C2DF1_96DD4BF884E10C2B_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CC(C)=C""",21,"""9ABC39D8A31B1AA8"""
+"""6468C7AF41D0952D_8AC33B1B5B6FDC8A_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CC(F)F""",21,"""9ABC39D8A31B1AA8"""
+"""D1B6F8A131483220_3226D79A0FE2E7D1_6031_DP""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CCNC""",21,"""9ABC39D8A31B1AA8"""
+"""2C6A3531923F6275_36061AE8ED6DBCBF_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)C[C@H](C)N""",21,"""9ABC39D8A31B1AA8"""
+"""8E60F8B70932D06B_EA526B7EF98DD47C_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CC(C)S""",21,"""9ABC39D8A31B1AA8"""
+"""090A1DAA5D8A1725_97709F46AD4CD171_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CCSC""",21,"""9ABC39D8A31B1AA8"""
+"""EE8C78C37B89936D_D4A895937D282806_6031_DP""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CC(C)N""",21,"""9ABC39D8A31B1AA8"""
+"""7DAD76850DCDFA1A_8017BA190AD4BD87_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CC#CC""",21,"""9ABC39D8A31B1AA8"""
+"""ABEA902A0B369E44_15668DB770C00E58_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CCON""",21,"""9ABC39D8A31B1AA8"""
+"""4C9785B8F783F841_121D1F579429B558_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CC(=C)Br""",21,"""9ABC39D8A31B1AA8"""
+"""D5346A3C9E0C4192_382F7FDEF8684041_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)C[C@@H](C)N""",21,"""9ABC39D8A31B1AA8"""
+"""CABC5B9183DA0B4E_0974432E39D3D7C3_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)C[CH]=[C]=[CH2]""",21,"""9ABC39D8A31B1AA8"""
+"""8DD4928E5F518DFA_FEAC5702F3C7438E_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CC#CBr""",21,"""9ABC39D8A31B1AA8"""
+"""845E419993D34AE8_70E86E37275FDB00_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CC(C)Cl""",21,"""9ABC39D8A31B1AA8"""
+"""5B67C16FDFA9272B_605101B59079D4BD_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CCCF""",21,"""9ABC39D8A31B1AA8"""
+"""A73FABBCAA2543FA_E492180C617B3727_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CC(N)=S""",21,"""9ABC39D8A31B1AA8"""
+"""6EA7D77B2CD61E08_E50AC5EA1BB3E900_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CCCS""",21,"""9ABC39D8A31B1AA8"""
+"""1FAB579998AF2D6D_9AFBE5B8C178E96E_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CCCC""",21,"""9ABC39D8A31B1AA8"""
+"""F39E968B7649D8E6_18992C4E032E7D9A_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CCCN""",21,"""9ABC39D8A31B1AA8"""
+"""D95CE6920460E069_B898ABACF69EBC29_6031_UN""","""O(C(=O)C2CN(OCC1=CC=CC=C1)C(=O)C2)CCCBr""",21,"""9ABC39D8A31B1AA8"""
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+"""4852940998F04080_C7A727E19DFAEE0B_6031_UN""","""COC2=C(C=C1OC(CC1=C2)C)C=CC(=O)OC[C@@H]3CO3""",21,"""A2F2E6160765C824"""
+"""0ADB6BB320B7070A_20A87668133EA52C_6031_UN""","""COC2=C(C=C1OC(CC1=C2)C)C=CC(=O)OC[C@H]3CO3""",21,"""A2F2E6160765C824"""
+"""F47C4A354CFA05CC_CE91F5605295F648_6031_UN""","""COC2=C(C=C1OC(CC1=C2)C)C=CC(=O)OCC3CO3""",21,"""A2F2E6160765C824"""
+"""71C8FDDD09A0171B_CAD193BCCA7B239B_6031_UN""","""COC2=C(C=C1OC(CC1=C2)C)C=CC(=O)OCC(Cl)Cl""",21,"""A2F2E6160765C824"""
+"""608C66150B97F18B_9D2DA3AE8D9017E2_6031_UN""","""COC2=C(C=C1OC(CC1=C2)C)C=CC(=O)OCC(=C)Cl""",21,"""A2F2E6160765C824"""
+"""F4F28B0FFE87831F_FAC218B6D251AA5A_6031_UN""","""COC2=C(C=C1OC(CC1=C2)C)C=CC(=O)OCC(C)F""",21,"""A2F2E6160765C824"""
+"""C0F5A5C1C0614C05_448E11ABA4B43BBD_6031_UN""","""COC2=C(C=C1OC(CC1=C2)C)C=CC(=O)OCC=CCl""",21,"""A2F2E6160765C824"""
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+"""3C07C290BB53A13E_0FA622FDB3E9BF44_6031_UN""","""COC2=C(C=C1OC(CC1=C2)C)C=CC(=O)OCCCI""",21,"""A2F2E6160765C824"""
+"""12A82CDFA1E43364_A96B75072C7850E9_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC(C)=C""",21,"""A50A07270B82466A"""
+"""E396820084183295_B57505E4F3F68048_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC(F)F""",21,"""A50A07270B82466A"""
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+"""BB0D20BC269120CB_4F5E50C88FC687C2_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC(C)Cl""",21,"""A50A07270B82466A"""
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+"""1DE5CA6258C458AB_DABCFB15B32AB5C2_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CCCS""",21,"""A50A07270B82466A"""
+"""0D6DB7CEFA3B1D08_A54DDB4769E1B5AC_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CCCC""",21,"""A50A07270B82466A"""
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+"""859D33025CFE6CC2_C2F2A1E4FBA14CCB_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC(C)C""",21,"""A50A07270B82466A"""
+"""8C010F82EC3DD3E6_F0B87F25F032D47C_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC3CC3""",21,"""A50A07270B82466A"""
+"""E1703A73568196E3_AE37C3EB8B2E077B_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CCC=C""",21,"""A50A07270B82466A"""
+"""8CF44D7F2C44BB3F_6F3F69B04D3C0717_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CCC#C""",21,"""A50A07270B82466A"""
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+"""3CB7F74529505C10_DBAF94F9CE5E3B77_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CCC#N""",21,"""A50A07270B82466A"""
+"""B5F008FEE9DE9DB9_A4D9C9A2B7F5335F_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC(F)Br""",21,"""A50A07270B82466A"""
+"""68F6ECD29861E73E_133F49FBA229FB6D_6031_DP""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CCNN""",21,"""A50A07270B82466A"""
+"""E1DC2B3C0BC99322_EC4CD77C397ED466_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC(=C)F""",21,"""A50A07270B82466A"""
+"""9E2340900DEFAE6D_E8849361DB9720C3_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC=CBr""",21,"""A50A07270B82466A"""
+"""1F3E867B41B79F5F_7A403E68ADD55FD6_6031_DP""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CCCO""",21,"""A50A07270B82466A"""
+"""29C29B67AB8639ED_945B517010087EF1_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CCOC""",21,"""A50A07270B82466A"""
+"""C40D7C64C070E829_C05FC6D0911D6045_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)C[C@@H]3CO3""",21,"""A50A07270B82466A"""
+"""1A53E49AE9682B8F_275097591FD92B62_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)C[C@H]3CO3""",21,"""A50A07270B82466A"""
+"""E3674782C65C198B_C96914515E727806_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC3CO3""",21,"""A50A07270B82466A"""
+"""D93B05A85581DC1C_CD29728DC69CADD5_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC(Cl)Cl""",21,"""A50A07270B82466A"""
+"""7A57EEFC6B27A7F1_9AD5429F817799AC_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC(=C)Cl""",21,"""A50A07270B82466A"""
+"""21C820828C6B9766_FD3AF987DEB62414_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC(C)F""",21,"""A50A07270B82466A"""
+"""6FDE2D4EFFD848EC_4376F09AA853B5F3_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC=CCl""",21,"""A50A07270B82466A"""
+"""125F809395C300B5_DDFEA5D89210A648_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CC(C)Br""",21,"""A50A07270B82466A"""
+"""F23C72EEC9353B9B_085EC3CCBF0E310A_6031_UN""","""O(C(=O)C[N]1N=C(C2=C1CCCC2)C(F)(F)F)CCCI""",21,"""A50A07270B82466A"""
+"""F691F235BF0C71BC_A9EE9298A585D1BF_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(C)=C)C""",21,"""A58FE0B8827FC73C"""
+"""E3F8B0A2C2F23257_B5F0E27B7A0B011E_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(F)F)C""",21,"""A58FE0B8827FC73C"""
+"""09F96F7E5FE0BBB9_0D150EFA2E863A45_6031_DP""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCNC)C""",21,"""A58FE0B8827FC73C"""
+"""BC009B182B8F5FBC_0935C388CC09612B_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OC[C@H](C)N)C""",21,"""A58FE0B8827FC73C"""
+"""9D1F7925386365D8_D561B21ED8E909E8_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(C)S)C""",21,"""A58FE0B8827FC73C"""
+"""6D40463F8110B890_A84346268C280CE5_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCSC)C""",21,"""A58FE0B8827FC73C"""
+"""45E480A61658A006_EB9B4CF35C4CF592_6031_DP""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(C)N)C""",21,"""A58FE0B8827FC73C"""
+"""B7D9842D2B07C19B_BF2463792BB06013_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC#CC)C""",21,"""A58FE0B8827FC73C"""
+"""6768CF913079A674_2A5554D751A4D3CC_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCON)C""",21,"""A58FE0B8827FC73C"""
+"""895C8F76D91E0F68_2D2EC637B54D68CC_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(=C)Br)C""",21,"""A58FE0B8827FC73C"""
+"""B6DE38466FB8A5A3_071CA6BED90C9DD5_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OC[C@@H](C)N)C""",21,"""A58FE0B8827FC73C"""
+"""067B756FA955B060_36479A4E18B70A57_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OC[CH]=[C]=[CH2])C""",21,"""A58FE0B8827FC73C"""
+"""F1B5E846CE1AF3AE_C19F8E62D2A39E1A_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC#CBr)C""",21,"""A58FE0B8827FC73C"""
+"""C0175B147B571AC4_4FDBB757063B0694_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(C)Cl)C""",21,"""A58FE0B8827FC73C"""
+"""95D3B8E52F322C43_5F62D8D5B11D0929_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCCF)C""",21,"""A58FE0B8827FC73C"""
+"""661332C293E6E917_DBA1C16C401FEAB3_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(N)=S)C""",21,"""A58FE0B8827FC73C"""
+"""8ECBE2631A82F4F7_DA391C8A3AD73494_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCCS)C""",21,"""A58FE0B8827FC73C"""
+"""06E7AAB28F7584A2_A5C83CD8E01C34FA_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCCC)C""",21,"""A58FE0B8827FC73C"""
+"""518106D9FCB5B784_27AAF52E224AA00E_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCCN)C""",21,"""A58FE0B8827FC73C"""
+"""45724CF5DD5874F4_87AB72CCD7FA61BD_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCCBr)C""",21,"""A58FE0B8827FC73C"""
+"""5E244FDF1DE9AA1E_C277467B725CCD9D_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(C)C)C""",21,"""A58FE0B8827FC73C"""
+"""7C0821CA7C5C46BD_F03D98BA79CF552A_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC2CC2)C""",21,"""A58FE0B8827FC73C"""
+"""6BD9F34DC969FB98_AEB2247402D3862D_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCC=C)C""",21,"""A58FE0B8827FC73C"""
+"""471AD55DAF634379_6FBA8E2FC4C18641_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCC#C)C""",21,"""A58FE0B8827FC73C"""
+"""6FA4821CE5D7FCAC_75D0FDF304C49C8E_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCCCl)C""",21,"""A58FE0B8827FC73C"""
+"""E164260B6ADD9AD9_DB2A736647A3BA21_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCC#N)C""",21,"""A58FE0B8827FC73C"""
+"""DBBC43E95A259959_A45C2E3D3E08B209_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(F)Br)C""",21,"""A58FE0B8827FC73C"""
+"""14C8F401B6014137_13BAAE642BD47A3B_6031_DP""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCNN)C""",21,"""A58FE0B8827FC73C"""
+"""FE06CA67431CEFE8_ECC930E3B0835530_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(=C)F)C""",21,"""A58FE0B8827FC73C"""
+"""48FB160951565478_E80174FE526AA195_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC=CBr)C""",21,"""A58FE0B8827FC73C"""
+"""2CA640D7ED752429_7AC5D9F72428DE80_6031_DP""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCCO)C""",21,"""A58FE0B8827FC73C"""
+"""95A1D4D401AB385E_94DEB6EF99F5FFA7_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCOC)C""",21,"""A58FE0B8827FC73C"""
+"""61787DC0A233A992_C0DA214F18E0E113_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OC[C@@H]2CO2)C""",21,"""A58FE0B8827FC73C"""
+"""251B58DFBE4FF0AC_27D570C69624AA34_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OC[C@H]2CO2)C""",21,"""A58FE0B8827FC73C"""
+"""5BE98B037AB789EC_C9ECF3CED78FF950_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC2CO2)C""",21,"""A58FE0B8827FC73C"""
+"""5B33950822A51883_CDAC95124F612C83_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(Cl)Cl)C""",21,"""A58FE0B8827FC73C"""
+"""EC5A0C5F37D0B602_9A50A500088A18FA_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(=C)Cl)C""",21,"""A58FE0B8827FC73C"""
+"""57014EFD69DE0F7B_FDBF1E18574BA542_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(C)F)C""",21,"""A58FE0B8827FC73C"""
+"""4FD0F1E4199CB02F_43F3170521AE34A5_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC=CCl)C""",21,"""A58FE0B8827FC73C"""
+"""B510602BEA4FEFBE_DD7B42471BED271E_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCC(C)Br)C""",21,"""A58FE0B8827FC73C"""
+"""A75D6CABE1B7CFCC_08DB245336F3B05C_6031_UN""","""CC1=CC(=C(C(=C1)C)C(NCC#C)C(=O)OCCCI)C""",21,"""A58FE0B8827FC73C"""
+"""D427358B7A0F6967_AA2E7F0B7710547D_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=C(C=CC=C2)F)CC(C)=C""",21,"""A64F0D2B50EA42FE"""
+"""480380BD150B3906_B6300FE8A89E84DC_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=C(C=CC=C2)F)CC(F)F""",21,"""A64F0D2B50EA42FE"""
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+"""AE022DC9168D5B1F_DEBBAFD4C978A2DC_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=C(C=CC=C2)F)CC(C)Br""",21,"""A64F0D2B50EA42FE"""
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+"""E7B7194B9B01A296_7990BB4E477EC97C_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=CC(=C2)C)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""BAC550DB705CBB71_584CC0848C3777EF_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=C(C)C=C2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""0B7FC30E37359958_E1E306F201482BB5_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC(=CC=C2)F)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""088FC4D6D52D544F_7BF3DF106B2C157E_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC(=CN=C2)F)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""F0854033770C6034_0CB16D6A71275D1B_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(N)C=CN=C2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""0F829C3EA244AE6E_1811C145E7131674_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CN=C(C=C2)F)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""02FB1F00D9CFC97B_0581D1D62F51C59D_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(C=CC=C2)Cl)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""F062A1C978328A2B_BF6CB159D4D982C8_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=C(C#N)S2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""D394EC22E68722E8_788FDD7C8D196E01_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(N=CC=C2)Cl)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""56470D884EB0A1EA_96F87F91A926809E_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC(=CC=C2)O)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""F9198A61916395B9_69702C15D0E606E0_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(N=CC=C2)F)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""6308D3AC9B3BD420_E32A35A57807B0E4_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=C(C=C2)O)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""126BAF17E82B6AD9_F995D59791134BBC_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CN=C(C=C2)Cl)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""8E3B314075CC5EBA_D2283B3BAF273681_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=CC(=C2)N)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""195D0DF950F09D46_A8FDCF21A3B13E90_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CN=C(N)C=C2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""F499A7F14045D05D_7F1E91308E074A98_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(ON=C2C)C)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""9A6FB81A34D61186_2070181BB1416A12_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CSC(=C2)C#N)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""D900163CD63A4B87_FD72053B7270420A_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=N[N]2CC)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""598598C89A144D5E_D9B9CFE77AE78D83_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC(=C(Cl)S2)Cl)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""D16E484E082B8382_F27E3F693D31A98F_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC(=NS2)OC)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""D3917C5CC1591A39_8189EC9239F3BDA5_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC(=CC=C2)Cl)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""91951853ACF11AA0_0780B5877781711E_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(C=CC=C2)O)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""001C8F353E10DD9E_3B8B9EEF4A494E98_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=C(C=C2)Cl)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""6EBC12DF5F4CA604_D39B5340CFBA974F_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(C=CC=N2)Cl)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""2B7AEE554B6F8B73_60D73E491BFA67EC_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=C(C=C2)F)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""A7C8507C131DEF02_B60E54AFB91183A7_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC(=NC=C2)Cl)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""5A3577CD1186DA61_AC1B301994E6BB2D_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(C)C=CC=C2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""286F742776FB9E49_ECBA5D5E5C99210C_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(SC=C2)C#N)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""5464B15DEDC3FB73_194602AC4DE322CB_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(C=NC=C2)F)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""AF2AEB7104233FD7_1B45592B2B8965CC_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(C)SC(=C2)C)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""37DFDD9F880D8ED4_AC4E7E23B87B3AF3_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(OC=C2)C#N)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""45A25AE10B4B33C6_5F2386336E430CEC_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(N)C=NC=C2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""F4C8158989739F36_24E38E981F444AE3_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(N)N=CC=C2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""3056535E133EB9D3_288B30F1A6A1AF78_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(C=CO2)C#N)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""B3519368E004F2EA_04A360C4D0E011F8_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(C)C=NC=C2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""E60A290A92D7F60E_ED0247EA01EA58F6_6004_DP""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=C(CN)O2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""D375052FD1CB1623_EECDF8CC481A2930_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=C(SC(=C2)Cl)Cl)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""210556411F7D813F_3BBC4629A8A954BD_6004_DP""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=C(CN)S2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""0ABD5D47C6C56372_52DD3367B4B66280_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=N[N](C=C2C)C)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""6308D3AC9B3BD420_BB6B608D8A3F577E_6004_DP""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=C(O)C=C2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""AB4244AA70672F83_AD87C1A7C56A9B3E_6004_UN""","""NC1=C(C(=CC=C1C(=O)O)C2=CC=C(C#N)O2)C(F)(F)F""",21,"""A74BA5F7068CE089"""
+"""445EDE5B44FC6689_A5BD5B8136F6DB7C_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)=C""",21,"""A9DC29A1110CCDFF"""
+"""96730DF38084F6CD_B9A32B62E9780BDD_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(F)F""",21,"""A9DC29A1110CCDFF"""
+"""166AD1453D5325C3_0146C7E3BDF53086_6031_DP""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCNC""",21,"""A9DC29A1110CCDFF"""
+"""CB353CB7421D61CF_05660A915F7A6BE8_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OC[C@H](C)N""",21,"""A9DC29A1110CCDFF"""
+"""E0E105C9E30EA47F_D9327B074B9A032B_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)S""",21,"""A9DC29A1110CCDFF"""
+"""75ED0D00864CB506_A4108F3F1F5B0626_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCSC""",21,"""A9DC29A1110CCDFF"""
+"""E584B0122340A930_E7C885EACF3FFF51_6031_DP""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)N""",21,"""A9DC29A1110CCDFF"""
+"""D543B640D79621CF_B377AA60B8C36AD0_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC#CC""",21,"""A9DC29A1110CCDFF"""
+"""6096FC7806142249_26069DCEC2D7D90F_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCON""",21,"""A9DC29A1110CCDFF"""
+"""F2C290CD861B8CDC_217D0F2E263E620F_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(=C)Br""",21,"""A9DC29A1110CCDFF"""
+"""63E3E1E0B4F1FBFD_0B4F6FA74A7F9716_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OC[C@@H](C)N""",21,"""A9DC29A1110CCDFF"""
+"""FAD81057593B9DA9_3A1453578BC40094_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OC[CH]=[C]=[CH2]""",21,"""A9DC29A1110CCDFF"""
+"""43F3FD71C2B53776_CDCC477B41D094D9_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC#CBr""",21,"""A9DC29A1110CCDFF"""
+"""15617007858D2E12_43887E4E95480C57_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)Cl""",21,"""A9DC29A1110CCDFF"""
+"""C300F67D1994BFD2_533111CC226E03EA_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCCF""",21,"""A9DC29A1110CCDFF"""
+"""AFEA307D1D6320EC_D7F20875D36CE070_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(N)=S""",21,"""A9DC29A1110CCDFF"""
+"""AA7931EA52B2BF24_D66AD593A9A43E57_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCCS""",21,"""A9DC29A1110CCDFF"""
+"""5903790BB03D0B98_A99BF5C1736F3E39_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCCC""",21,"""A9DC29A1110CCDFF"""
+"""8BC9E9D6918242FA_2BF93C37B139AACD_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCCN""",21,"""A9DC29A1110CCDFF"""
+"""4999A4BA957F1D24_8BF8BBD544896B7E_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCCBr""",21,"""A9DC29A1110CCDFF"""
+"""71C732C28D6A1E7A_CE248F62E12FC75E_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)C""",21,"""A9DC29A1110CCDFF"""
+"""6ED3FFF840C123F7_FC6E51A3EABC5FE9_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC2CC2""",21,"""A9DC29A1110CCDFF"""
+"""D2849D9201E89BA7_A2E1ED6D91A08CEE_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCC=C""",21,"""A9DC29A1110CCDFF"""
+"""F287F972CF333B3F_63E9473657B28C82_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCC#C""",21,"""A9DC29A1110CCDFF"""
+"""8BF98B955E3E43C5_798334EA97B7964D_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCCCl""",21,"""A9DC29A1110CCDFF"""
+"""BD4D7D271F79DE08_D779BA7FD4D0B0E2_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCC#N""",21,"""A9DC29A1110CCDFF"""
+"""D5D1DD33FE3F9952_A80FE724AD7BB8CA_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(F)Br""",21,"""A9DC29A1110CCDFF"""
+"""1F66BCF2FFDEE1BB_1FE9677DB8A770F8_6031_DP""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCNN""",21,"""A9DC29A1110CCDFF"""
+"""1DBA952D62735C17_E09AF9FA23F05FF3_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(=C)F""",21,"""A9DC29A1110CCDFF"""
+"""A78BC720FF89CB31_E452BDE7C119AB56_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC=CBr""",21,"""A9DC29A1110CCDFF"""
+"""C6EEF370E1B1C6F5_769610EEB75BD443_6031_DP""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCCO""",21,"""A9DC29A1110CCDFF"""
+"""6727060B59FE9AA3_988D7FF60A86F564_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCOC""",21,"""A9DC29A1110CCDFF"""
+"""21A97D1DCA9750E2_CC89E8568B93EBD0_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OC[C@@H]2CO2""",21,"""A9DC29A1110CCDFF"""
+"""1D34B7CF24A1EDE2_2B86B9DF0557A0F7_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OC[C@H]2CO2""",21,"""A9DC29A1110CCDFF"""
+"""AF4D532B9B071684_C5BF3AD744FCF393_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC2CO2""",21,"""A9DC29A1110CCDFF"""
+"""05E5BA534D368439_C1FF5C0BDC122640_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(Cl)Cl""",21,"""A9DC29A1110CCDFF"""
+"""3D6239C300867B33_96036C199BF91239_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(=C)Cl""",21,"""A9DC29A1110CCDFF"""
+"""7812ED75CA200A1C_F1ECD701C438AF81_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)F""",21,"""A9DC29A1110CCDFF"""
+"""D51070ECFED8342A_4FA0DE1CB2DD3E66_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC=CCl""",21,"""A9DC29A1110CCDFF"""
+"""CCF3DC2CF06AB45D_D1288B5E889E2DDD_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCC(C)Br""",21,"""A9DC29A1110CCDFF"""
+"""F0BD95379F0ACEB9_0488ED4AA580BA9F_6031_UN""","""CC(C)(CC1=CC=C(C=C1)C(F)(F)F)C(=O)OCCCI""",21,"""A9DC29A1110CCDFF"""
+"""9C8524387B22D644_A7FD8DD16E18634B_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(C)=C""",21,"""AB9CFFF149E275C8"""
+"""DF5927FB9566F710_BBE3FD32B196B3EA_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(F)F""",21,"""AB9CFFF149E275C8"""
+"""52E87698C284EECA_030611B3E51B88B1_6031_DP""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCNC""",21,"""AB9CFFF149E275C8"""
+"""8A141C20A110F177_0726DCC10794D3DF_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OC[C@H](C)N""",21,"""AB9CFFF149E275C8"""
+"""69C9A60CCA202986_DB72AD571374BB1C_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(C)S""",21,"""AB9CFFF149E275C8"""
+"""A6C1D50E23213748_A650596F47B5BE11_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCSC""",21,"""AB9CFFF149E275C8"""
+"""2897D7E131A5B66F_E58853BA97D14766_6031_DP""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(C)N""",21,"""AB9CFFF149E275C8"""
+"""39774002399712D4_B1377C30E02DD2E7_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC#CC""",21,"""AB9CFFF149E275C8"""
+"""F556B534431BF6D0_24464B9E9A396138_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCON""",21,"""AB9CFFF149E275C8"""
+"""85FFCB4F82338604_233DD97E7ED0DA38_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(=C)Br""",21,"""AB9CFFF149E275C8"""
+"""F927BEDAFC9571E3_090FB9F712912F21_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OC[C@@H](C)N""",21,"""AB9CFFF149E275C8"""
+"""F854081915A482DB_38548507D32AB8A3_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OC[CH]=[C]=[CH2]""",21,"""AB9CFFF149E275C8"""
+"""97B8003192CFC9CA_CF8C912B193E2CEE_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC#CBr""",21,"""AB9CFFF149E275C8"""
+"""DDF4F6C5446605DC_41C8A81ECDA6B460_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(C)Cl""",21,"""AB9CFFF149E275C8"""
+"""51A5A7FD67187461_5171C79C7A80BBDD_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCCF""",21,"""AB9CFFF149E275C8"""
+"""E48FA6F53B42D226_D5B2DE258B825847_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(N)=S""",21,"""AB9CFFF149E275C8"""
+"""CD88AD090AD67011_D42A03C3F14A8660_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCCS""",21,"""AB9CFFF149E275C8"""
+"""0C5EE7166F5782DA_ABDB23912B81860E_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCCC""",21,"""AB9CFFF149E275C8"""
+"""D7371EF1CAC989CE_29B9EA67E9D712FA_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCCN""",21,"""AB9CFFF149E275C8"""
+"""FF200971419B9C80_89B86D851C67D349_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCCBr""",21,"""AB9CFFF149E275C8"""
+"""10AC1B196E37BDB0_CC645932B9C17F69_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(C)C""",21,"""AB9CFFF149E275C8"""
+"""8E0D9A20DE8B5344_FE2E87F3B252E7DE_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC2CC2""",21,"""AB9CFFF149E275C8"""
+"""BD0521600F969992_A0A13B3DC94E34D9_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCC=C""",21,"""AB9CFFF149E275C8"""
+"""C327A0BB44BDCC17_61A991660F5C34B5_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCC#C""",21,"""AB9CFFF149E275C8"""
+"""CA6096266AFC1E39_7BC3E2BACF592E7A_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCCCl""",21,"""AB9CFFF149E275C8"""
+"""1AE392EEF6E9354B_D5396C2F8C3E08D5_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCC#N""",21,"""AB9CFFF149E275C8"""
+"""A2B7667116E002C5_AA4F3174F59500FD_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(F)Br""",21,"""AB9CFFF149E275C8"""
+"""FB4FB3E8AE56ECB4_1DA9B12DE049C8CF_6031_DP""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCNN""",21,"""AB9CFFF149E275C8"""
+"""9F688FC573FE21FD_E2DA2FAA7B1EE7C4_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(=C)F""",21,"""AB9CFFF149E275C8"""
+"""611D8A9A23114162_E6126BB799F71361_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC=CBr""",21,"""AB9CFFF149E275C8"""
+"""DC85B14D9967B59C_74D6C6BEEFB56C74_6031_DP""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCCO""",21,"""AB9CFFF149E275C8"""
+"""7D6CFD717ED1420D_9ACDA9A652684D53_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCOC""",21,"""AB9CFFF149E275C8"""
+"""AB98D9C5FE09706B_CEC93E06D37D53E7_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OC[C@@H]2CO2""",21,"""AB9CFFF149E275C8"""
+"""B269B8DFD63EC32B_29C66F8F5DB918C0_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OC[C@H]2CO2""",21,"""AB9CFFF149E275C8"""
+"""B8423643EBFE3EE4_C7FFEC871C124BA4_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC2CO2""",21,"""AB9CFFF149E275C8"""
+"""0CEC2F23D4B0D17C_C3BF8A5B84FC9E77_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(Cl)Cl""",21,"""AB9CFFF149E275C8"""
+"""6643B77942FD6266_9443BA49C317AA0E_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(=C)Cl""",21,"""AB9CFFF149E275C8"""
+"""6A645B19BFE4753A_F3AC01519CD617B6_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(C)F""",21,"""AB9CFFF149E275C8"""
+"""4FEC248A322972D8_4DE0084CEA338651_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC=CCl""",21,"""AB9CFFF149E275C8"""
+"""2D66C8CEF69D1F1D_D3685D0ED07095EA_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCC(C)Br""",21,"""AB9CFFF149E275C8"""
+"""9BF17AC081FC3965_06C83B1AFD6E02A8_6031_UN""","""CC(C)OC1=C(C=CC(=N1)C(F)(F)F)C(=O)OCCCI""",21,"""AB9CFFF149E275C8"""
+"""B3D878B39AA36848_A19A6CF0B03383BB_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC(C)=C""",21,"""ADFB1ED097C99538"""
+"""10A4FB579FA35AA1_BD841C136FBD531A_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC(F)F""",21,"""ADFB1ED097C99538"""
+"""D284B5F584BB0F65_0561F0923B306841_6031_DP""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCNC""",21,"""ADFB1ED097C99538"""
+"""D5874E32E72F405A_01413DE0D9BF332F_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OC[C@H](C)N""",21,"""ADFB1ED097C99538"""
+"""6708AE441E4CA51E_DD154C76CD5F5BEC_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC(C)S""",21,"""ADFB1ED097C99538"""
+"""E164F2A7AE163E6C_A037B84E999E5EE1_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCSC""",21,"""ADFB1ED097C99538"""
+"""DE56CBAFC697EC98_E3EFB29B49FAA796_6031_DP""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC(C)N""",21,"""ADFB1ED097C99538"""
+"""8E80D55B739A8AEE_B7509D113E063217_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC#CC""",21,"""ADFB1ED097C99538"""
+"""C4093E79FF86001F_2221AABF441281C8_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCON""",21,"""ADFB1ED097C99538"""
+"""169ACF1B6973CE96_255A385FA0FB3AC8_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC(=C)Br""",21,"""ADFB1ED097C99538"""
+"""D98E3CB86CE3E987_0F6858D6CCBACFD1_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OC[C@@H](C)N""",21,"""ADFB1ED097C99538"""
+"""9EE95DE4F6F9F79B_3E3364260D015853_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OC[CH]=[C]=[CH2]""",21,"""ADFB1ED097C99538"""
+"""4DF418A3231516ED_C9EB700AC715CC1E_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC#CBr""",21,"""ADFB1ED097C99538"""
+"""EE82F365CB3D6DE7_47AF493F138D5490_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC(C)Cl""",21,"""ADFB1ED097C99538"""
+"""353BFD9389FBAC39_571626BDA4AB5B2D_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCCF""",21,"""ADFB1ED097C99538"""
+"""88423E0F1C8ECCA7_D3D53F0455A9B8B7_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC(N)=S""",21,"""ADFB1ED097C99538"""
+"""51713355180DF31B_D24DE2E22F616690_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCCS""",21,"""ADFB1ED097C99538"""
+"""0D5F4DAC237F5E22_ADBCC2B0F5AA66FE_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCCC""",21,"""ADFB1ED097C99538"""
+"""59EA6A5651A76745_2FDE0B4637FCF20A_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCCN""",21,"""ADFB1ED097C99538"""
+"""F8FE05D400DEBAAE_8FDF8CA4C24C33B9_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCCBr""",21,"""ADFB1ED097C99538"""
+"""2C4C50F92ED1B662_CA03B81367EA9F99_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC(C)C""",21,"""ADFB1ED097C99538"""
+"""7D3FFA3A748140AE_F84966D26C79072E_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC3CC3""",21,"""ADFB1ED097C99538"""
+"""06C3E36BF11A6007_A6C6DA1C1765D429_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCC=C""",21,"""ADFB1ED097C99538"""
+"""6B3B03544091BFA2_67CE7047D177D445_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCC#C""",21,"""ADFB1ED097C99538"""
+"""9B20AF582EE711B8_7DA4039B1172CE8A_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCCCl""",21,"""ADFB1ED097C99538"""
+"""6F26D48E46E8E05C_D35E8D0E5215E825_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCC#N""",21,"""ADFB1ED097C99538"""
+"""B2D54CFC9EF78520_AC28D0552BBEE00D_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC(F)Br""",21,"""ADFB1ED097C99538"""
+"""8C7D40F282E69A2D_1BCE500C3E62283F_6031_DP""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCNN""",21,"""ADFB1ED097C99538"""
+"""BBE739E280D8B81C_E4BDCE8BA5350734_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC(=C)F""",21,"""ADFB1ED097C99538"""
+"""E493A36D5467C212_E0758A9647DCF391_6031_UN""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCC=CBr""",21,"""ADFB1ED097C99538"""
+"""B9E0676E68E63350_72B1279F319E8C84_6031_DP""","""CCN1CCCC1CN2CC(CC2=O)C(=O)OCCCO""",21,"""ADFB1ED097C99538"""
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+"""CAAE90B042008EA3_D877158B140057C9_6031_UN""","""CC1=C(C=C(C=C1[N](=O)=O)C(=O)OCC(Cl)Cl)[S](=O)(=O)Cl""",21,"""B0546021D91EBC76"""
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+"""C90BDEE520C16DF9_C5F34A2A873EC65F_6004_UN""","""COC(=O)CCNC1=C(C=C(C=N1)C)C2=C(C=CC=N2)Cl""",21,"""B123BC9D4E08B199"""
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+"""AE8823ACCD1A6039_BA732973DC62EA3D_6004_UN""","""COC(=O)CCNC1=C(C=C(C=N1)C)C2=C(C)C=CC=C2""",21,"""B123BC9D4E08B199"""
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+"""675E14066058651C_0F2E1BC6056773DB_6004_UN""","""COC(=O)CCNC1=C(C=C(C=N1)C)C2=C(C=NC=C2)F""",21,"""B123BC9D4E08B199"""
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+"""C6FA81839A84416B_BA266749F0FF6BE3_6004_UN""","""COC(=O)CCNC1=C(C=C(C=N1)C)C2=C(OC=C2)C#N""",21,"""B123BC9D4E08B199"""
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+"""2979828904382BF4_328B97F257C01BF3_6004_UN""","""COC(=O)CCNC1=C(C=C(C=N1)C)C2=C(N)N=CC=C2""",21,"""B123BC9D4E08B199"""
+"""83610471AFB21B27_3EE3299BEE25FE68_6004_UN""","""COC(=O)CCNC1=C(C=C(C=N1)C)C2=C(C=CO2)C#N""",21,"""B123BC9D4E08B199"""
+"""CE557B8D7D079397_12CB79AE986440E8_6004_UN""","""COC(=O)CCNC1=C(C=C(C=N1)C)C2=C(C)C=NC=C2""",21,"""B123BC9D4E08B199"""
+"""A56C43057C645598_FB6A5E80496E09E6_6004_DP""","""COC(=O)CCNC1=C(C=C(C=N1)C)C2=CC=C(CN)O2""",21,"""B123BC9D4E08B199"""
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+"""48B7AC44AE527833_2DD45F43E02D05AD_6004_DP""","""COC(=O)CCNC1=C(C=C(C=N1)C)C2=CC=C(CN)S2""",21,"""B123BC9D4E08B199"""
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+"""A5BE7D668C035A02_8FBB325C7D5B52C2_2238_UN""","""C[N]1C5=C4C(=C1)C2(C(NC3=C2C=C(Cl)C=C3)=O)N(CC4)C5""",21,"""B255626158C864B0"""
+"""7BFA18FC7163DC69_CF064965710DFD1A_2238_UN""","""C[N]1C5=C4C(=C1)C2(C(NC3=C(Br)C=CC=C23)=O)N(CC4)C5""",21,"""B255626158C864B0"""
+"""7D61335E7B2D34F0_E2AECC1584FB441F_2238_UN""","""C[N]1C5=C4C(=C1)C2(C(NC3=C(C)C=CC=C23)=O)N(CC4)C5""",21,"""B255626158C864B0"""
+"""921F9858A1CDDF67_FDBB5AA71034DFB4_2238_UN""","""C[N]1C5=C4C(=C1)C2(C(NC3=C2C=C(C)C=C3)=O)N(CC4)C5""",21,"""B255626158C864B0"""
+"""358420593F9B2487_C83899183720E1CB_2238_UN""","""C[N]1C5=C4C(=C1)C3(C2=C(C=C(F)C=C2)NC3=O)N(CC4)C5""",21,"""B255626158C864B0"""
+"""287113F924630AF7_A6BBB1F6E9CAD5B4_2238_UN""","""C[N]1C5=C4C(=C1)C3(C2=C(C=C(Br)C=C2)NC3=O)N(CC4)C5""",21,"""B255626158C864B0"""
+"""71BDEEE430CEBF45_D3EEC6A01DF8327E_2238_UN""","""C[N]1C5=C4C(=C1)C3(C2=C(Br)C=CC=C2NC3=O)N(CC4)C5""",21,"""B255626158C864B0"""
+"""DCD1824ABEBD4DD4_B7585EA927E41E0C_2238_UN""","""C[N]1C4=C3C(=C1)C(C(O)=O)(CC2=CC=CC=C2)N(CC3)C4""",21,"""B255626158C864B0"""
+"""AB510084CEA160A6_16BCE33150BD3732_2238_UN""","""C[N]1C5=C4C(=C1)C3(C2=C(C=C(O)C=C2)NC3=O)N(CC4)C5""",21,"""B255626158C864B0"""
+"""869F926EB3902832_6CBCA75FF91E3C0C_2238_UN""","""C[N]1C5=C4C(=C1)C3(C2=C(C=C(Cl)C=C2)NC3=O)N(CC4)C5""",21,"""B255626158C864B0"""
+"""296A8E491FD06DB3_CAB6D6DA017ACAEF_2238_UN""","""C[N]1C5=C4C(=C1)C2(C(NC3=C(I)C=CC=C23)=O)N(CC4)C5""",21,"""B255626158C864B0"""
+"""C27524D0B5CC579E_BE34297F0E59BA16_2238_UN""","""C[N]1C5=C4C(=C1)C3(C2=C(Cl)C=CC=C2NC3=O)N(CC4)C5""",21,"""B255626158C864B0"""
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+"""30C30C253B633C1D_1429CD473BF90EE7_2238_UN""","""C[N]1C4=C3C(=C1)C(C(OCC)=O)(C2=CC=NS2)N(CC3)C4""",21,"""B255626158C864B0"""
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+"""B329BD1951AA0689_CC21A13EFF95DC25_6031_UN""","""CC(C)(C)CCOC(C(=O)OCCCS)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
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+"""04ECCD91B96CF957_E625250EBC8DBD9B_6031_UN""","""CC(C)(C)CCOC(C(=O)OCC1CC1)C2=CC=CC=C2""",21,"""B3975D0C473D2F8D"""
+"""0F228D378C6F9484_B8AA99C0C7916E9C_6031_UN""","""CC(C)(C)CCOC(C(=O)OCCC=C)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""5C55DA5F62837A1C_79A2339B01836EF0_6031_UN""","""CC(C)(C)CCOC(C(=O)OCCC#C)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""8E7E154607C1F0D5_63C84047C186743F_6031_UN""","""CC(C)(C)CCOC(C(=O)OCCCCl)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""4BF720C5FEA05011_CD32CED282E15290_6031_UN""","""CC(C)(C)CCOC(C(=O)OCCC#N)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""11144E87059F94AC_B2449389FB4A5AB8_6031_UN""","""CC(C)(C)CCOC(C(=O)OCC(F)Br)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
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+"""0C7779E07A0236AE_FAD18D5775C1BD81_6031_UN""","""CC(C)(C)CCOC(C(=O)OCC(=C)F)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""7893344944506B1B_FE19C94A97284924_6031_UN""","""CC(C)(C)CCOC(C(=O)OCC=CBr)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""1D4909542914FFBE_6CDD6443E16A3631_6031_DP""","""CC(C)(C)CCOC(C(=O)OCCCO)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""5AE1BCC674ABAC18_82C60B5B5CB71716_6031_UN""","""CC(C)(C)CCOC(C(=O)OCCOC)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""EA095944A69734BC_D6C29CFBDDA209A2_6031_UN""","""CC(C)(C)CCOC(C(=O)OC[C@@H]1CO1)C2=CC=CC=C2""",21,"""B3975D0C473D2F8D"""
+"""410773909F45EF06_31CDCD7253664285_6031_UN""","""CC(C)(C)CCOC(C(=O)OC[C@H]1CO1)C2=CC=CC=C2""",21,"""B3975D0C473D2F8D"""
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+"""D500361AB3EF2280_DBB428A68A23C432_6031_UN""","""CC(C)(C)CCOC(C(=O)OCC(Cl)Cl)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""73AEA2AAAE8F3A81_8C4818B4CDC8F04B_6031_UN""","""CC(C)(C)CCOC(C(=O)OCC(=C)Cl)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""FE1E2B874302DF5F_EBA7A3AC92094DF3_6031_UN""","""CC(C)(C)CCOC(C(=O)OCC(C)F)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""FE03C21D40751015_55EBAAB1E4ECDC14_6031_UN""","""CC(C)(C)CCOC(C(=O)OCC=CCl)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""92287045EEA9E7BD_CB63FFF3DEAFCFAF_6031_UN""","""CC(C)(C)CCOC(C(=O)OCC(C)Br)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""66AB6F3BADD302BA_1EC399E7F3B158ED_6031_UN""","""CC(C)(C)CCOC(C(=O)OCCCI)C1=CC=CC=C1""",21,"""B3975D0C473D2F8D"""
+"""BBD1248EF52046DC_6D624626E9D6EE2E_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=CC(=C2)C)CC)N""",21,"""B3B9589FA824C7DB"""
+"""05F193C321304FCE_4CBE3DEC229F50BD_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=C(C)C=C2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""72B5C33E15DC1118_F511FB9AAFE00CE7_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC(=CC=C2)F)CC)N""",21,"""B3B9589FA824C7DB"""
+"""AEDCB015466737DF_6F012278C584322C_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC(=CN=C2)F)CC)N""",21,"""B3B9589FA824C7DB"""
+"""5A0D85F5065D83DF_18439002DF8F7A49_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(N)C=CN=C2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""C81E29F9ED8E2FDC_0CE33C2D49BB3126_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CN=C(C=C2)F)CC)N""",21,"""B3B9589FA824C7DB"""
+"""19F73B1E23A9917C_11732CBE81F9E2CF_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(C=CC=C2)Cl)CC)N""",21,"""B3B9589FA824C7DB"""
+"""A5048EB3E3B0AF1F_AB9E4C317A71A59A_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=C(C#N)S2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""C1E52245D433018D_6C7D201423B14953_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(N=CC=C2)Cl)CC)N""",21,"""B3B9589FA824C7DB"""
+"""E4E7554490F5571D_820A82F9078EA7CC_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC(=CC=C2)O)CC)N""",21,"""B3B9589FA824C7DB"""
+"""B4D58C0B92F3E454_7D82D17D7E4E21B2_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(N=CC=C2)F)CC)N""",21,"""B3B9589FA824C7DB"""
+"""2216C7D7D36ABF53_F7D8C8CDD6AF97B6_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=C(C=C2)O)CC)N""",21,"""B3B9589FA824C7DB"""
+"""C6061389EFD5180A_ED6728FF3FBB6CEE_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CN=C(C=C2)Cl)CC)N""",21,"""B3B9589FA824C7DB"""
+"""225020754DA5C1AE_C6DAC653018F11D3_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=CC(=C2)N)CC)N""",21,"""B3B9589FA824C7DB"""
+"""72B9B16C8F0186CC_BC0F32490D1919C2_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CN=C(N)C=C2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""C78C7469D5A49517_6BEC6C5820AF6DCA_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(ON=C2C)C)CC)N""",21,"""B3B9589FA824C7DB"""
+"""73E0D14609D0A571_3482E5731FE94D40_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CSC(=C2)C#N)CC)N""",21,"""B3B9589FA824C7DB"""
+"""9057318ED7189FEF_E980F853DCD86558_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=N[N]2CC)CC)N""",21,"""B3B9589FA824C7DB"""
+"""668E6404519DAD31_CD4B328FD44FAAD1_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC(=C(Cl)S2)Cl)CC)N""",21,"""B3B9589FA824C7DB"""
+"""CF9F13B1B57B6C40_E68CC20193998EDD_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC(=NS2)OC)CC)N""",21,"""B3B9589FA824C7DB"""
+"""7506AA96EFF16198_957B11FA975B9AF7_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC(=CC=C2)Cl)CC)N""",21,"""B3B9589FA824C7DB"""
+"""41B06CA239BF06C9_137248EFD929564C_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(C=CC=C2)O)CC)N""",21,"""B3B9589FA824C7DB"""
+"""D5CD64C8E2D091C8_2F796387E4E169CA_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=C(C=C2)Cl)CC)N""",21,"""B3B9589FA824C7DB"""
+"""3683092232CDF08F_C769AE286112B01D_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(C=CC=N2)Cl)CC)N""",21,"""B3B9589FA824C7DB"""
+"""80D061B2E91D3478_7425C321B55240BE_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=C(C=C2)F)CC)N""",21,"""B3B9589FA824C7DB"""
+"""EE32E315F251F03D_A2FCA9C717B9A4F5_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC(=NC=C2)Cl)CC)N""",21,"""B3B9589FA824C7DB"""
+"""A2D9FF6EF73E49D9_B8E9CD713A4E9C7F_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(C)C=CC=C2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""759ABC63F42FA31A_F848A036F231065E_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(SC=C2)C#N)CC)N""",21,"""B3B9589FA824C7DB"""
+"""84C4E7CACA74A95C_0DB4FFC4E34B0599_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(C=NC=C2)F)CC)N""",21,"""B3B9589FA824C7DB"""
+"""F8297F1AA8899A8E_0FB7A4438521429E_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(C)SC(=C2)C)CC)N""",21,"""B3B9589FA824C7DB"""
+"""20A55F964294879D_B8BC834B16D31DA1_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(OC=C2)C#N)CC)N""",21,"""B3B9589FA824C7DB"""
+"""D1500EE45360A9AE_4BD17B5BC0EB2BBE_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(N)C=NC=C2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""762DE88A58BCB7D0_301173F0B1EC6DB1_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(N)N=CC=C2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""D77BA02CF0640874_3C79CD990809882A_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(C=CO2)C#N)CC)N""",21,"""B3B9589FA824C7DB"""
+"""76A688E1DC983EA5_10519DAC7E4836AA_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=C(C)C=NC=C2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""C9168F9F6DA8C7DF_F9F0BA82AF427FA4_6004_DP""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=C(CN)O2)CC)N""",21,"""B3B9589FA824C7DB"""
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+"""967642A22FBD6857_2F4EBB41060173EF_6004_DP""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=C(CN)S2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""CE82DC92749B38CF_462FCE0F1A1E45D2_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=N[N](C=C2C)C)CC)N""",21,"""B3B9589FA824C7DB"""
+"""2216C7D7D36ABF53_AF999DE52497702C_6004_DP""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=C(O)C=C2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""727FF4B3B6C376A6_B9753CCF6BC2BC6C_6004_UN""","""CCOC(=O)C1=C(C(=CC(=C1)C2=CC=C(C#N)O2)CC)N""",21,"""B3B9589FA824C7DB"""
+"""EC20F1AB7C8153B6_B826333C12272689_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(C)=C)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""ACC33B231B6CF745_A43843DFCDA9F628_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(F)F)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""2B61A0858DBD7F8D_1CDDAF5E9924CD73_6031_DP""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCNC)[N](=O)=O""",21,"""B447411C35DD300A"""
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+"""E701CEE1B7AD97E1_AEECC2DD9C129725_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC#CC)[N](=O)=O""",21,"""B447411C35DD300A"""
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+"""48F8EB103A23E8D9_16D4071A6EAE6AE3_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OC[C@@H](C)N)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""19DEC581A299A26D_278F3BEAAF15FD61_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OC[CH]=[C]=[CH2])[N](=O)=O""",21,"""B447411C35DD300A"""
+"""101D564C752B0046_D0572FC66501692C_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC#CBr)[N](=O)=O""",21,"""B447411C35DD300A"""
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+"""54167D3C06FD6E03_4EAA797106BFFE1F_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCCF)[N](=O)=O""",21,"""B447411C35DD300A"""
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+"""F0064C087D5908F9_CBF1BD2E8D75C3A2_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCCS)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""5D62E99B2309E7E1_B4009D7C57BEC3CC_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCCC)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""B2B2FE49E209ABEE_3662548A95E85738_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCCN)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""7876C65254ABF2BE_9663D3686058968B_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCCBr)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""AE58F0894469266A_D3BFE7DFC5FE3AAB_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(C)C)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""B274FE36B2E62969_E1F5391ECE6DA21C_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC2CC2)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""5084D0A301AD8922_BF7A85D0B571711B_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCC=C)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""481CC710B0C25A4E_7E722F8B73637177_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCC#C)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""E76F026FDB06B0FB_64185C57B3666BB8_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCCCl)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""A61F1CA2B9DBFC80_CAE2D2C2F0014D17_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCC#N)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""D02061003CBBF8A3_B5948F9989AA453F_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(F)Br)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""E9CD64467AAE4ED9_02720FC09C768D0D_6031_DP""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCNN)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""E2AE7AF9944C84E6_FD0191470721A206_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=C)F)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""AAC803C66D36AE6D_F9C9D55AE5C856A3_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC=CBr)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""F8CEEC9A71E53C1C_6B0D7853938A29B6_6031_DP""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCCO)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""D3C77B264BB86844_8516174B2E570891_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCOC)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""926FF0B2A85D9D29_D11280EBAF421625_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OC[C@@H]2CO2)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""D3F3A986B72D267F_361DD16221865D02_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OC[C@H]2CO2)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""555417A9F8420271_D824526A602D0E66_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC2CO2)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""B4DA8134EA782832_DC6434B6F8C3DBB5_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(Cl)Cl)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""CD196705BA4F1677_8B9804A4BF28EFCC_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=C)Cl)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""A742C5086D940261_EC77BFBCE0E95274_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(C)F)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""2342B5C00CD17D3B_523BB6A1960CC393_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC=CCl)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""29AB7DBBAEFB4D67_CCB3E3E3AC4FD028_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(C)Br)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""169DEE44B6B7B6AB_191385F78151476A_6031_UN""","""CCOC(=O)C1=CC(=CC(=C1)C(=O)OCCCI)[N](=O)=O""",21,"""B447411C35DD300A"""
+"""92A680B165B2D157_B9FC77B7F2C31612_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(C)=C""",21,"""B59D0597D5390091"""
+"""83D1A29CC8350414_A5E207542D4DC6B3_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(F)F""",21,"""B59D0597D5390091"""
+"""18C7DD866213C048_1D07EBD579C0FDE8_6031_DP""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCNC""",21,"""B59D0597D5390091"""
+"""2C0B5743EDB4D6E3_192726A79B4FA686_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)C[C@H](C)N""",21,"""B59D0597D5390091"""
+"""96CE3931546270DD_C57357318FAFCE45_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(C)S""",21,"""B59D0597D5390091"""
+"""338F7E9054D3888F_B851A309DB6ECB48_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCSC""",21,"""B59D0597D5390091"""
+"""01179843C4C97845_FB89A9DC0B0A323F_6031_DP""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(C)N""",21,"""B59D0597D5390091"""
+"""8C33B056CB487482_AF3686567CF6A7BE_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC#CC""",21,"""B59D0597D5390091"""
+"""53D70C9E66C36623_3A47B1F806E21461_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCON""",21,"""B59D0597D5390091"""
+"""FC9D7A5CFD85A911_3D3C2318E20BAF61_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(=C)Br""",21,"""B59D0597D5390091"""
+"""0D888EF00B95C2D7_170E43918E4A5A78_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)C[C@@H](C)N""",21,"""B59D0597D5390091"""
+"""11B5CE96DC884881_26557F614FF1CDFA_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)C[CH]=[C]=[CH2]""",21,"""B59D0597D5390091"""
+"""CF155C9DA9C95945_D18D6B4D85E559B7_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC#CBr""",21,"""B59D0597D5390091"""
+"""EFD628BEB54076C0_5FC95278517DC139_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(C)Cl""",21,"""B59D0597D5390091"""
+"""D6FA6FDAC472294E_4F703DFAE65BCE84_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCCF""",21,"""B59D0597D5390091"""
+"""A8A52503BEFD40A8_CBB3244317592D1E_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(N)=S""",21,"""B59D0597D5390091"""
+"""0A8FCB2796F85873_CA2BF9A56D91F339_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCCS""",21,"""B59D0597D5390091"""
+"""2FAFEE1377DB19D5_B5DAD9F7B75AF357_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCCC""",21,"""B59D0597D5390091"""
+"""E31E2B74B48A996F_37B81001750C67A3_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCCN""",21,"""B59D0597D5390091"""
+"""3027BCEA0CB5B7B3_97B997E380BCA610_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCCBr""",21,"""B59D0597D5390091"""
+"""6E00E7321F6C61BB_D265A354251A0A30_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(C)C""",21,"""B59D0597D5390091"""
+"""7C78426BB13F135E_E02F7D952E899287_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC3CC3""",21,"""B59D0597D5390091"""
+"""57642450921C40D2_BEA0C15B55954180_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCC=C""",21,"""B59D0597D5390091"""
+"""13E3C9A0A823EE37_7FA86B00938741EC_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCC#C""",21,"""B59D0597D5390091"""
+"""EA40C3396D111C7D_65C218DC53825B23_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCCCl""",21,"""B59D0597D5390091"""
+"""7C54AE397D209557_CB38964910E57D8C_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCC#N""",21,"""B59D0597D5390091"""
+"""B686C4C13E3013FA_B44ECB12694E75A4_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(F)Br""",21,"""B59D0597D5390091"""
+"""ECE7663854E8D44A_03A84B4B7C92BD96_6031_DP""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCNN""",21,"""B59D0597D5390091"""
+"""6F7C68C1DE655CD9_FCDBD5CCE7C5929D_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(=C)F""",21,"""B59D0597D5390091"""
+"""8D5F0D9135A857F3_F81391D1052C6638_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC=CBr""",21,"""B59D0597D5390091"""
+"""416212E61D9BB885_6AD73CD8736E192D_6031_DP""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCCO""",21,"""B59D0597D5390091"""
+"""3869B5BD275450E9_84CC53C0CEB3380A_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CCOC""",21,"""B59D0597D5390091"""
+"""FEE8826E26E3B305_D0C8C4604FA626BE_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)C[C@@H]3CO3""",21,"""B59D0597D5390091"""
+"""9A7F756A534EF612_37C795E9C1626D99_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)C[C@H]3CO3""",21,"""B59D0597D5390091"""
+"""600802464CBEDE22_D9FE16E180C93EFD_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC3CO3""",21,"""B59D0597D5390091"""
+"""EDE80B5319DED2D4_DDBE703D1827EB2E_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(Cl)Cl""",21,"""B59D0597D5390091"""
+"""3271CF32B1F92BFC_8A42402F5FCCDF57_6031_UN""","""O(C(=O)C1(CC1)C2=CC(=CC(=C2)F)C(F)(F)F)CC(=C)Cl""",21,"""B59D0597D5390091"""
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+"""13B651E73C79F741_310032803641F336_6031_UN""","""COC1=C(C=C(C=C1)C=C(C#N)C(=O)OCCON)OC""",21,"""BEDA86EFE59AE7C6"""
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+"""D4D5EAAEC20C375C_1C49C0E9BEE9BD2F_6031_UN""","""COC1=C(C=C(C=C1)C=C(C#N)C(=O)OC[C@@H](C)N)OC""",21,"""BEDA86EFE59AE7C6"""
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+"""11D3C2C463434C2C_B7D6799F3B3A5501_6031_UN""","""CCOC(=O)CON=C(C(=O)OCC(C)S)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
+"""3E03B5A6E475C6F0_CAF48DA76FFB500C_6031_UN""","""CCOC(=O)CON=C(C(=O)OCCSC)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
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+"""B6FE09EC6E5198AC_2D6C7CD6E5E85A7D_6031_UN""","""CCOC(=O)CON=C(C(=O)OCC(C)Cl)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
+"""244EA4EC205147D4_3DD5135452CE55C0_6031_UN""","""CCOC(=O)CON=C(C(=O)OCCCF)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
+"""AC4A72878A524231_B9160AEDA3CCB65A_6031_UN""","""CCOC(=O)CON=C(C(=O)OCC(N)=S)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
+"""F8A76B383E88A22C_B88ED70BD904687D_6031_UN""","""CCOC(=O)CON=C(C(=O)OCCCS)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
+"""B642582EF9C7FF46_C77FF75903CF6813_6031_UN""","""CCOC(=O)CON=C(C(=O)OCCCC)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
+"""0C24C289EB1D8963_451D3EAFC199FCE7_6031_UN""","""CCOC(=O)CON=C(C(=O)OCCCN)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
+"""FF2D9B263D75FD93_E51CB94D34293D54_6031_UN""","""CCOC(=O)CON=C(C(=O)OCCCBr)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
+"""56CE81210E70593E_A0C08DFA918F9174_6031_UN""","""CCOC(=O)CON=C(C(=O)OCC(C)C)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
+"""F40CC1DA49CFF6BF_928A533B9A1C09C3_6031_UN""","""CCOC(=O)CON=C(C(=O)OCC1CC1)C2=N[NH]C=C2""",21,"""C7382B3961AC9BD5"""
+"""9D37CD471913ECC1_CC05EFF5E100DAC4_6031_UN""","""CCOC(=O)CON=C(C(=O)OCCC=C)C1=N[NH]C=C1""",21,"""C7382B3961AC9BD5"""
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+"""C70DDA1E3143EF21_45E9970B4BC6C721_6004_UN""","""Cl[S](=O)(=O)C1=CC(=C(S1)C2OCCO2)C3=C(C=CO3)C#N""",21,"""CA29020DEBEB88D0"""
+"""340C78F6B37D5F7B_69C1C73E3D8779A1_6004_UN""","""Cl[S](=O)(=O)C1=CC(=C(S1)C2OCCO2)C3=C(C)C=NC=C3""",21,"""CA29020DEBEB88D0"""
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+"""2232FCE9BA6F0A6F_56DEE1D345CE3CE4_6004_DP""","""Cl[S](=O)(=O)C1=CC(=C(S1)C2OCCO2)C3=CC=C(CN)S3""",21,"""CA29020DEBEB88D0"""
+"""B0AB57297C546C93_3FBF949D59D10AD9_6004_UN""","""Cl[S](=O)(=O)C1=CC(=C(S1)C2OCCO2)C3=N[N](C=C3C)C""",21,"""CA29020DEBEB88D0"""
+"""E643C9AD216225E9_D609C77767583F27_6004_DP""","""Cl[S](=O)(=O)C1=CC(=C(S1)C2OCCO2)C3=CC=C(O)C=C3""",21,"""CA29020DEBEB88D0"""
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+"""F8CF12848CDB253A_C6170276AA967DD6_6031_UN""","""O(C(=O)CC1=CC=C(C=C1)[S](=O)(=O)CC2CC2)CC(C)=C""",21,"""CA7670568D6C6B55"""
+"""F7111B2336ED057E_DA0972957518AD77_6031_UN""","""O(C(=O)CC1=CC=C(C=C1)[S](=O)(=O)CC2CC2)CC(F)F""",21,"""CA7670568D6C6B55"""
+"""0E7BDBEC5C5E3661_62EC9E142195962C_6031_DP""","""O(C(=O)CC1=CC=C(C=C1)[S](=O)(=O)CC2CC2)CCNC""",21,"""CA7670568D6C6B55"""
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+"""73C44E51E6034969_6722B4BD39E01C35_6031_UN""","""O(C(=O)CC1=CC=C(C=C1)[S](=O)(=O)CC2CC2)CCCI""",21,"""CA7670568D6C6B55"""
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+"""4B13B1C8C77CF141_63255F75F855C2C7_6031_DP""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCNC""",21,"""CBBFB13754AC3FBE"""
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+"""EA30D355C8AE55C6_BB51E3910E3AF16A_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(C)S""",21,"""CBBFB13754AC3FBE"""
+"""E7883F3DCB3469EA_C67317A95AFBF467_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCSC""",21,"""CBBFB13754AC3FBE"""
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+"""46687F185601FC51_D11432F6FD639891_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC#CC""",21,"""CBBFB13754AC3FBE"""
+"""1FDA1CFB7926F328_4465055887772B4E_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCON""",21,"""CBBFB13754AC3FBE"""
+"""B7D646C759E75416_431E97B8639E904E_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(=C)Br""",21,"""CBBFB13754AC3FBE"""
+"""CF20094C0C792494_692CF7310FDF6557_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OC[C@@H](C)N""",21,"""CBBFB13754AC3FBE"""
+"""2078FDD1C19A9AAE_5877CBC1CE64F2D5_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OC[CH]=[C]=[CH2]""",21,"""CBBFB13754AC3FBE"""
+"""5474E17674D34A1E_AFAFDFED04706698_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC#CBr""",21,"""CBBFB13754AC3FBE"""
+"""DD1AFFF37FF7E26E_21EBE6D8D0E8FE16_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(C)Cl""",21,"""CBBFB13754AC3FBE"""
+"""8F30A0B381C28E67_3152895A67CEF1AB_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCCF""",21,"""CBBFB13754AC3FBE"""
+"""2AB88DB130098A55_B59190E396CC1231_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(N)=S""",21,"""CBBFB13754AC3FBE"""
+"""1FA8845238A09566_B4094D05EC04CC16_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCCS""",21,"""CBBFB13754AC3FBE"""
+"""CF5057A036AB4239_CBF86D5736CFCC78_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCCC""",21,"""CBBFB13754AC3FBE"""
+"""D81078BC39126068_499AA4A1F499588C_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCCN""",21,"""CBBFB13754AC3FBE"""
+"""29A5A5F741DB0946_E99B23430129993F_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCCBr""",21,"""CBBFB13754AC3FBE"""
+"""EC2FEBB8FF19B4F2_AC4717F4A48F351F_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(C)C""",21,"""CBBFB13754AC3FBE"""
+"""C527CEAFB65B980A_9E0DC935AF1CADA8_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC3CC3""",21,"""CBBFB13754AC3FBE"""
+"""2294EF657BB61471_C08275FBD4007EAF_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCC=C""",21,"""CBBFB13754AC3FBE"""
+"""E2A438C63FEB6254_018ADFA012127EC3_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCC#C""",21,"""CBBFB13754AC3FBE"""
+"""17ED4E450FDAFFEB_1BE0AC7CD217640C_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCCCl""",21,"""CBBFB13754AC3FBE"""
+"""3B9C31051B868305_B51A22E9917042A3_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCC#N""",21,"""CBBFB13754AC3FBE"""
+"""94EC096669861C09_CA6C7FB2E8DB4A8B_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(F)Br""",21,"""CBBFB13754AC3FBE"""
+"""0AD12EE9572DD5B7_7D8AFFEBFD0782B9_6031_DP""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCNN""",21,"""CBBFB13754AC3FBE"""
+"""D725D576D5055444_82F9616C6650ADB2_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(=C)F""",21,"""CBBFB13754AC3FBE"""
+"""BB00F797133F5325_8631257184B95917_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC=CBr""",21,"""CBBFB13754AC3FBE"""
+"""BD6E96F4770A9F04_14F58878F2FB2602_6031_DP""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCCO""",21,"""CBBFB13754AC3FBE"""
+"""E3692FE46864F8E9_FAEEE7604F260725_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCOC""",21,"""CBBFB13754AC3FBE"""
+"""32E3DD0CCC25CF5A_AEEA70C0CE331991_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OC[C@@H]3CO3""",21,"""CBBFB13754AC3FBE"""
+"""79633192D309C700_49E5214940F752B6_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OC[C@H]3CO3""",21,"""CBBFB13754AC3FBE"""
+"""A3E19F5341814A9C_A7DCA241015C01D2_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC3CO3""",21,"""CBBFB13754AC3FBE"""
+"""A27FEB6CA9694955_A39CC49D99B2D401_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(Cl)Cl""",21,"""CBBFB13754AC3FBE"""
+"""6ABB5D6E5E53C6B6_F460F48FDE59E078_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(=C)Cl""",21,"""CBBFB13754AC3FBE"""
+"""1F9683BABA3AC627_938F4F9781985DC0_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(C)F""",21,"""CBBFB13754AC3FBE"""
+"""C15C52A07008FC14_2DC3468AF77DCC27_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC=CCl""",21,"""CBBFB13754AC3FBE"""
+"""3A5878A2BFD9F177_B34B13C8CD3EDF9C_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCC(C)Br""",21,"""CBBFB13754AC3FBE"""
+"""6A2C3033263B57EA_66EB75DCE02048DE_6031_UN""","""CCC1=C(C(=NO1)C2=CC=C(C=C2)Br)C(=O)OCCCI""",21,"""CBBFB13754AC3FBE"""
+"""7A82E055F040E716_C0CDF3C2C91EEC94_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCC(C)=C""",21,"""CCAC81E2EEE4FA17"""
+"""5EF8EC313A283EA2_DCD3832116903C35_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCC(F)F""",21,"""CCAC81E2EEE4FA17"""
+"""5AF35D92C3894DF9_64366FA0421D076E_6031_DP""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCCNC""",21,"""CCAC81E2EEE4FA17"""
+"""FA93DBB9719E8996_6016A2D2A0925C00_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OC[C@H](C)N""",21,"""CCAC81E2EEE4FA17"""
+"""60206C8233BA5FC7_BC42D344B47234C3_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCC(C)S""",21,"""CCAC81E2EEE4FA17"""
+"""491FB4042928E100_C160277CE0B331CE_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCCSC""",21,"""CCAC81E2EEE4FA17"""
+"""CCADA3013D27D20F_82B82DA930D7C8B9_6031_DP""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCC(C)N""",21,"""CCAC81E2EEE4FA17"""
+"""4CE1D1E2BCE9BF22_D6070223472B5D38_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCC#CC""",21,"""CCAC81E2EEE4FA17"""
+"""7B026AC952D80203_4376358D3D3FEEE7_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCCON""",21,"""CCAC81E2EEE4FA17"""
+"""7E32EDD0A2F3F0D2_440DA76DD9D655E7_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCC(=C)Br""",21,"""CCAC81E2EEE4FA17"""
+"""C26783BDAC91D254_6E3FC7E4B597A0FE_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OC[C@@H](C)N""",21,"""CCAC81E2EEE4FA17"""
+"""F479406371AB0243_5F64FB14742C377C_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OC[CH]=[C]=[CH2]""",21,"""CCAC81E2EEE4FA17"""
+"""3D5B4591F01217C3_A8BCEF38BE38A331_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCC#CBr""",21,"""CCAC81E2EEE4FA17"""
+"""7B3B9782A067C060_26F8D60D6AA03BBF_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCC(C)Cl""",21,"""CCAC81E2EEE4FA17"""
+"""8B2820D3C7F911F2_3641B98FDD863402_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCCCF""",21,"""CCAC81E2EEE4FA17"""
+"""1F6FAEB417B50775_B282A0362C84D798_6031_UN""","""CC(C)(N2C(=O)C1=C(C=CC=C1)C2=O)C(=O)OCC(N)=S""",21,"""CCAC81E2EEE4FA17"""
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+"""F832696396B322C1_D5199D075EDDFEAC_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CCCC""",21,"""D55E41673CBE0D6A"""
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+"""E7E510E8078111E7_F77AD313693BABEB_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CCCBr""",21,"""D55E41673CBE0D6A"""
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+"""09B1682FDF367A9C_05015C2CBA0556D8_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CCCCl""",21,"""D55E41673CBE0D6A"""
+"""1F20A6F3DC9ABCCA_ABFBD2B9F9627077_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CCC#N""",21,"""D55E41673CBE0D6A"""
+"""720E1BA78210E76C_D48D8FE280C9785F_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CC(F)Br""",21,"""D55E41673CBE0D6A"""
+"""F9BF91B624BDF7E7_636B0FBB9515B06D_6031_DP""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CCNN""",21,"""D55E41673CBE0D6A"""
+"""BC4E731CDEECBC04_9C18913C0E429F66_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CC(=C)F""",21,"""D55E41673CBE0D6A"""
+"""B5A2D1ACE1BAA15E_98D0D521ECAB6BC3_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CC=CBr""",21,"""D55E41673CBE0D6A"""
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+"""AFC83AA0D166665A_E40F1730273435F1_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CCOC""",21,"""D55E41673CBE0D6A"""
+"""FE3B37E88624C017_B00B8090A6212B45_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)C[C@@H]3CO3""",21,"""D55E41673CBE0D6A"""
+"""5FE17EF242983D7B_5704D11928E56062_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)C[C@H]3CO3""",21,"""D55E41673CBE0D6A"""
+"""4E57B1BE9EADAF3D_B93D5211694E3306_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CC3CO3""",21,"""D55E41673CBE0D6A"""
+"""77814095B9D67551_BD7D34CDF1A0E6D5_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CC(Cl)Cl""",21,"""D55E41673CBE0D6A"""
+"""A46A1F9C0EF89FE2_EA8104DFB64BD2AC_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CC(=C)Cl""",21,"""D55E41673CBE0D6A"""
+"""121B069E83068940_8D6EBFC7E98A6F14_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CC(C)F""",21,"""D55E41673CBE0D6A"""
+"""389BC20613686D48_3322B6DA9F6FFEF3_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CC=CCl""",21,"""D55E41673CBE0D6A"""
+"""7D84FEA0329D87C4_ADAAE398A52CED48_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CC(C)Br""",21,"""D55E41673CBE0D6A"""
+"""4554D5B95D01087D_780A858C88327A0A_6031_UN""","""O(C(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N](=O)=O)CCCI""",21,"""D55E41673CBE0D6A"""
+"""7A617D1AC0657F74_D46A8DF850ED3F08_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCC(C)=C""",21,"""D80BFFD87717298B"""
+"""BA01249D1F1AD894_C874FD1B8F63EFA9_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCC(F)F""",21,"""D80BFFD87717298B"""
+"""CAC4DB610DB8AA50_7091119ADBEED4F2_6031_DP""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCCNC""",21,"""D80BFFD87717298B"""
+"""3F613FF3DF22949D_74B1DCE839618F9C_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OC[C@H](C)N""",21,"""D80BFFD87717298B"""
+"""FF825FC9220FCDE7_A8E5AD7E2D81E75F_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCC(C)S""",21,"""D80BFFD87717298B"""
+"""676813AF907F9097_D5C759467940E252_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCCSC""",21,"""D80BFFD87717298B"""
+"""BDEB1C4E3F37E291_961F5393A9241B25_6031_DP""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCC(C)N""",21,"""D80BFFD87717298B"""
+"""CFD336DB53C288ED_C2A07C19DED88EA4_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCC#CC""",21,"""D80BFFD87717298B"""
+"""60590085CE20829D_57D14BB7A4CC3D7B_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCCON""",21,"""D80BFFD87717298B"""
+"""280EF8B5A88EC0DF_50AAD9574025867B_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCC(=C)Br""",21,"""D80BFFD87717298B"""
+"""765BFE8CE23F3771_7A98B9DE2C647362_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OC[C@@H](C)N""",21,"""D80BFFD87717298B"""
+"""8838A93B48941EBD_4BC3852EEDDFE4E0_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OC[CH]=[C]=[CH2]""",21,"""D80BFFD87717298B"""
+"""E1C2067E5FCD1027_BC1B910227CB70AD_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCC#CBr""",21,"""D80BFFD87717298B"""
+"""188964233CA9483B_325FA837F353E823_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCC(C)Cl""",21,"""D80BFFD87717298B"""
+"""51C26B458213609C_22E6C7B54475E79E_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCCCF""",21,"""D80BFFD87717298B"""
+"""25353CF546DE7C65_A625DE0CB5770404_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCC(N)=S""",21,"""D80BFFD87717298B"""
+"""6BEF689014992D54_A7BD03EACFBFDA23_6031_UN""","""NC2(CCCN(CC1=CC=CC=C1)C2)C(=O)OCCCS""",21,"""D80BFFD87717298B"""
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+"""B7C3923D13362A65_DAE1EDA788C1F041_6031_UN""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CCCC""",21,"""DAA631C7EAA20387"""
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+"""FD543D40F68052FF_A403A2192F7E7E9A_6031_UN""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CCC#N""",21,"""DAA631C7EAA20387"""
+"""FEB042E603FEB720_DB75FF4256D576B2_6031_UN""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CC(F)Br""",21,"""DAA631C7EAA20387"""
+"""F29DCBD270352275_6C937F1B4309BE80_6031_DP""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CCNN""",21,"""DAA631C7EAA20387"""
+"""0603E992BFC0445A_93E0E19CD85E918B_6031_UN""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CC(=C)F""",21,"""DAA631C7EAA20387"""
+"""3C155E9A7F33484E_9728A5813AB7652E_6031_UN""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CC=CBr""",21,"""DAA631C7EAA20387"""
+"""9665941D86DD350A_05EC08884CF51A3B_6031_DP""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CCCO""",21,"""DAA631C7EAA20387"""
+"""533D4C44627E2139_EBF76790F1283B1C_6031_UN""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CCOC""",21,"""DAA631C7EAA20387"""
+"""442AD18B78FC8FEC_BFF3F030703D25A8_6031_UN""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)C[C@@H]3CO3""",21,"""DAA631C7EAA20387"""
+"""2283DA9834589DEC_58FCA1B9FEF96E8F_6031_UN""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)C[C@H]3CO3""",21,"""DAA631C7EAA20387"""
+"""56DA5FE1A22CC079_B6C522B1BF523DEB_6031_UN""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CC3CO3""",21,"""DAA631C7EAA20387"""
+"""EA224346F9327B61_B285446D27BCE838_6031_UN""","""O(C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CC(Cl)Cl""",21,"""DAA631C7EAA20387"""
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+"""B02367D0BC370F34_783D1525BD20CB8A_6031_UN""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)C[C@@H](C)N""",21,"""DAAE5323E6539163"""
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+"""8FA7890508816755_F88AC157B3D637E2_6031_UN""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)CCCBr""",21,"""DAAE5323E6539163"""
+"""B6DEF7149E73354A_BD56F5E016709BC2_6031_UN""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)CC(C)C""",21,"""DAAE5323E6539163"""
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+"""705E70A71F18F6A8_6C9B1DFF4FF82C64_6031_DP""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)CCNN""",21,"""DAAE5323E6539163"""
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+"""0A6993F5D842B29F_05E46A6C400488DF_6031_DP""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)CCCO""",21,"""DAAE5323E6539163"""
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+"""0FF76F353A4EF237_BFFB92D47CCCB74C_6031_UN""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)C[C@@H]4CO4""",21,"""DAAE5323E6539163"""
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+"""86487540A0FA4690_B6CD4055B3A3AF0F_6031_UN""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)CC4CO4""",21,"""DAAE5323E6539163"""
+"""8CC6F3AC322988E1_B28D26892B4D7ADC_6031_UN""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)CC(Cl)Cl""",21,"""DAAE5323E6539163"""
+"""E160ADADC23ED36B_E571169B6CA64EA5_6031_UN""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)CC(=C)Cl""",21,"""DAAE5323E6539163"""
+"""4F8C255FF3A6AD16_829EAD833367F31D_6031_UN""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)CC(C)F""",21,"""DAAE5323E6539163"""
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+"""A2CD69EC37E7E87F_A25AF1DC7FC17141_6031_UN""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)CC(C)Br""",21,"""DAAE5323E6539163"""
+"""334982C430147652_77FA97C852DFE603_6031_UN""","""O(C(=O)CC1CCCC2=C1[NH]C3=C2C=CC=C3)CCCI""",21,"""DAAE5323E6539163"""
+"""191F32C1E3E7B7D5_D75192294774509E_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)=C)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""19D8DB87FDE368D8_CB4FE2CA98FA803F_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(F)F)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""ADAB36C90ACAD12A_73AA0E4BCC77BB64_6031_DP""","""COC1=CC(=C(C=C1)C(=O)OCCNC)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""948CC1257DF3D1A6_778AC3392EF8E00A_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OC[C@H](C)N)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""C3801F2F6E079D1F_ABDEB2AF3A1888C9_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)S)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""A794EA022F50B10B_D6FC46976ED98DC4_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCSC)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""7578D5D7320E0155_95244C42BEBD74B3_6031_DP""","""COC1=CC(=C(C=C1)C(=O)OCC(C)N)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""7C02232F4E9A3F99_C19B63C8C941E132_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC#CC)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""A9E3EA0F4C9D92F2_54EA5466B35552ED_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCON)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""73D6AC3FD6C5FCA0_5391C68657BCE9ED_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(=C)Br)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""B4DC51D5726DA4BD_79A3A60F3BFD1CF4_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OC[C@@H](C)N)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""AB4417AD810C40FC_48F89AFFFA468B76_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OC[CH]=[C]=[CH2])OCCC(C)C""",21,"""DB30E009608E461D"""
+"""6C11BF07BBA4EE52_BF208ED330521F3B_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC#CBr)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""3F17AA0742FBB994_3164B7E6E4CA87B5_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)Cl)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""C991977CDF559643_21DDD86453EC8808_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCF)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""B5364D578E0AAE80_A51EC1DDA2EE6B92_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(N)=S)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""6C6F41E5D5801880_A4861C3BD826B5B5_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCS)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""DFD7BAA8CF3B5B00_DB773C6902EDB5DB_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCC)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""69298B7E09244208_5915F59FC0BB212F_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCN)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""7E8C9F5FDA7DEE60_F914727D350BE09C_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCBr)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""E01FBD0B6F9BD5F0_BCC846CA90AD4CBC_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)C)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""10AC0DDFFC95CA17_8E82980B9B3ED40B_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC2CC2)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""27787A106B56937E_D00D24C5E022070C_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCC=C)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""D687D411C0E333D0_11058E9E26300760_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCC#C)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""E8361FFE95103E57_0B6FFD42E6351DAF_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCCl)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""15F854E5C3083F46_A59573D7A5523B00_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCC#N)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""BE9CFD041BA6D680_DAE32E8CDCF93328_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(F)Br)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""6E14F724EF123B7E_6D05AED5C925FB1A_6031_DP""","""COC1=CC(=C(C=C1)C(=O)OCCNN)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""3A066D71902A7D1B_927630525272D411_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(=C)F)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""F39C7B83189C5CBE_96BE744FB09B20B4_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC=CBr)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""A0A24FD1E7D9294D_047AD946C6D95FA1_6031_DP""","""COC1=CC(=C(C=C1)C(=O)OCCCO)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""24EBB7D497D442BD_EA61B65E7B047E86_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCOC)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""5856FE2BF76AAE75_BE6521FEFA116032_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OC[C@@H]2CO2)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""12D285339E5A6041_596A707774D52B15_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OC[C@H]2CO2)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""B00CB5979B545166_B753F37F357E7871_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC2CO2)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""DC19E2CDDF78ECDC_B31395A3AD90ADA2_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(Cl)Cl)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""7331B6342CC9C19D_E4EFA5B1EA7B99DB_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(=C)Cl)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""F944B1B5C652658F_83001EA9B5BA2463_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)F)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""A2078E02C1092C45_3D4C17B4C35FB584_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC=CCl)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""6035CAC1E1A1E26E_A3C442F6F91CA63F_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCC(C)Br)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""C4DB0FBC22DB9CA3_766424E2D402317D_6031_UN""","""COC1=CC(=C(C=C1)C(=O)OCCCI)OCCC(C)C""",21,"""DB30E009608E461D"""
+"""6FB04F59156F9FDE_D7225A832E5FC66D_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(C)=C""",21,"""DB4328A309A5D0EE"""
+"""7B98BE4647C83ACE_CB3C2A60F1D116CC_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(F)F""",21,"""DB4328A309A5D0EE"""
+"""D9CF55D6195FC2B0_73D9C6E1A55C2D97_6031_DP""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCNC""",21,"""DB4328A309A5D0EE"""
+"""631A18FBA609CE5D_77F90B9347D376F9_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)C[C@H](C)N""",21,"""DB4328A309A5D0EE"""
+"""12E8FD8C376674FF_ABAD7A0553331E3A_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(C)S""",21,"""DB4328A309A5D0EE"""
+"""D5CD4FD47A69792C_D68F8E3D07F21B37_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCSC""",21,"""DB4328A309A5D0EE"""
+"""A853DD634CA739A4_955784E8D796E240_6031_DP""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(C)N""",21,"""DB4328A309A5D0EE"""
+"""9098094B47E4B964_C1E8AB62A06A77C1_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC#CC""",21,"""DB4328A309A5D0EE"""
+"""2288266B53BA816D_54999CCCDA7EC41E_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCON""",21,"""DB4328A309A5D0EE"""
+"""AE9DF00E68041200_53E20E2C3E977F1E_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(=C)Br""",21,"""DB4328A309A5D0EE"""
+"""041D4B7421409DBB_79D06EA552D68A07_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)C[C@@H](C)N""",21,"""DB4328A309A5D0EE"""
+"""F4FCFC988E77F95C_488B5255936D1D85_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)C[CH]=[C]=[CH2]""",21,"""DB4328A309A5D0EE"""
+"""4DAA3F488A18BEF7_BF534679597989C8_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC#CBr""",21,"""DB4328A309A5D0EE"""
+"""328D83C36EBE90F2_31177F4C8DE11146_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(C)Cl""",21,"""DB4328A309A5D0EE"""
+"""C1A11F8E9FD72736_21AE10CE3AC71EFB_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCCF""",21,"""DB4328A309A5D0EE"""
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+"""44C3FF3E0C1500C4_A4F5D491B10D2346_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCCS""",21,"""DB4328A309A5D0EE"""
+"""0F4BA06B0C6D9F75_DB04F4C36BC62328_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCCC""",21,"""DB4328A309A5D0EE"""
+"""01B4B5D4A50C6FC9_59663D35A990B7DC_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCCN""",21,"""DB4328A309A5D0EE"""
+"""C5CF3EB379E77FFE_F967BAD75C20766F_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCCBr""",21,"""DB4328A309A5D0EE"""
+"""39F223A31617D971_BCBB8E60F986DA4F_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(C)C""",21,"""DB4328A309A5D0EE"""
+"""843B754F5004E323_8EF150A1F21542F8_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC3CC3""",21,"""DB4328A309A5D0EE"""
+"""A9CEF3773980CFF8_D07EEC6F890991FF_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCC=C""",21,"""DB4328A309A5D0EE"""
+"""C48CAB7F87479E78_117646344F1B9193_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCC#C""",21,"""DB4328A309A5D0EE"""
+"""6787D68B85D9F480_0B1C35E88F1E8B5C_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCCCl""",21,"""DB4328A309A5D0EE"""
+"""3F3B14045B0C8F76_A5E6BB7DCC79ADF3_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCC#N""",21,"""DB4328A309A5D0EE"""
+"""B1DE0F8F6F84D0F3_DA90E626B5D2A5DB_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(F)Br""",21,"""DB4328A309A5D0EE"""
+"""A79A56B637B97D9D_6D76667FA00E6DE9_6031_DP""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCNN""",21,"""DB4328A309A5D0EE"""
+"""32D40428F0E549CB_9205F8F83B5942E2_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(=C)F""",21,"""DB4328A309A5D0EE"""
+"""51991A5E25F365FE_96CDBCE5D9B0B647_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC=CBr""",21,"""DB4328A309A5D0EE"""
+"""DA2A03CB4950F490_040911ECAFF2C952_6031_DP""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCCO""",21,"""DB4328A309A5D0EE"""
+"""B03FD3C2BE4C548F_EA127EF4122FE875_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCOC""",21,"""DB4328A309A5D0EE"""
+"""26B9BF9AF6D61C61_BE16E954933AF6C1_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)C[C@@H]3CO3""",21,"""DB4328A309A5D0EE"""
+"""F54C65CC89E8B872_5919B8DD1DFEBDE6_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)C[C@H]3CO3""",21,"""DB4328A309A5D0EE"""
+"""63838FEBEA0B0137_B7203BD55C55EE82_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC3CO3""",21,"""DB4328A309A5D0EE"""
+"""9E5698ADE064FFD2_B3605D09C4BB3B51_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(Cl)Cl""",21,"""DB4328A309A5D0EE"""
+"""E63A504FB419CE5B_E49C6D1B83500F28_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(=C)Cl""",21,"""DB4328A309A5D0EE"""
+"""2B473A1E19FBDF22_8373D603DC91B290_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(C)F""",21,"""DB4328A309A5D0EE"""
+"""537AB2860E34D553_3D3FDF1EAA742377_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC=CCl""",21,"""DB4328A309A5D0EE"""
+"""BBCAD66B7F50241F_A3B78A5C903730CC_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CC(C)Br""",21,"""DB4328A309A5D0EE"""
+"""3027158397051A34_7617EC48BD29A78E_6031_UN""","""O(C(=O)C1CC=CCC1C(=O)N2CCOCC2)CCCI""",21,"""DB4328A309A5D0EE"""
+"""F6F506217C2B1B0E_D1D4165CC394EBE7_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(C)=C""",21,"""DDB5647CE46EFD64"""
+"""2BD106CFDBFF8AEA_CDCA66BF1C1A3B46_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(F)F""",21,"""DDB5647CE46EFD64"""
+"""E925E5821F0C2E1F_752F8A3E4897001D_6031_DP""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCNC""",21,"""DDB5647CE46EFD64"""
+"""9142DFDCF6013F04_710F474CAA185B73_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OC[C@H](C)N""",21,"""DDB5647CE46EFD64"""
+"""6DD41BE2A983D8FD_AD5B36DABEF833B0_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(C)S""",21,"""DDB5647CE46EFD64"""
+"""5159ED0500D2E0B1_D079C2E2EA3936BD_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCSC""",21,"""DDB5647CE46EFD64"""
+"""284F942E752E9EBA_93A1C8373A5DCFCA_6031_DP""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(C)N""",21,"""DDB5647CE46EFD64"""
+"""7F4ABD32E517CA71_C71EE7BD4DA15A4B_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC#CC""",21,"""DDB5647CE46EFD64"""
+"""FB53F667F6DCF786_526FD01337B5E994_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCON""",21,"""DDB5647CE46EFD64"""
+"""F92C65D29A740C45_551442F3D35C5294_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(=C)Br""",21,"""DDB5647CE46EFD64"""
+"""F71549BD1423A323_7F26227ABF1DA78D_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OC[C@@H](C)N""",21,"""DDB5647CE46EFD64"""
+"""20796FC1AD002026_4E7D1E8A7EA6300F_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OC[CH]=[C]=[CH2]""",21,"""DDB5647CE46EFD64"""
+"""B7E155016FA052BA_B9A50AA6B4B2A442_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC#CBr""",21,"""DDB5647CE46EFD64"""
+"""9AC2C7A5C450E96F_37E13393602A3CCC_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(C)Cl""",21,"""DDB5647CE46EFD64"""
+"""200DCB4F957DB7D0_27585C11D70C3371_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCCF""",21,"""DDB5647CE46EFD64"""
+"""283EFFF7E6AC4264_A39B45A8260ED0EB_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(N)=S""",21,"""DDB5647CE46EFD64"""
+"""F1A132156BF5F71B_A203984E5CC60ECC_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCCS""",21,"""DDB5647CE46EFD64"""
+"""9422D85A362CB752_DDF2B81C860D0EA2_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCCC""",21,"""DDB5647CE46EFD64"""
+"""D019E1E20959122A_5F9071EA445B9A56_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCCN""",21,"""DDB5647CE46EFD64"""
+"""F168F0B1A8C22C99_FF91F608B1EB5BE5_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCCBr""",21,"""DDB5647CE46EFD64"""
+"""DCB5EE3685965B41_BA4DC2BF144DF7C5_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(C)C""",21,"""DDB5647CE46EFD64"""
+"""99952F305B5B6F0D_88071C7E1FDE6F72_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC2CC2""",21,"""DDB5647CE46EFD64"""
+"""802FEADBBD82C223_D688A0B064C2BC75_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCC=C""",21,"""DDB5647CE46EFD64"""
+"""F207F089F96E2450_17800AEBA2D0BC19_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCC#C""",21,"""DDB5647CE46EFD64"""
+"""4DC1E5E38691582F_0DEA793762D5A6D6_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCCCl""",21,"""DDB5647CE46EFD64"""
+"""860B3905CAFC3A71_A310F7A221B28079_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCC#N""",21,"""DDB5647CE46EFD64"""
+"""B0A19AD2D831A27B_DC66AAF958198851_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(F)Br""",21,"""DDB5647CE46EFD64"""
+"""CDD41C3DDA5E627D_6B802AA04DC54063_6031_DP""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCNN""",21,"""DDB5647CE46EFD64"""
+"""EA7A74C5B27C28B0_94F3B427D6926F68_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(=C)F""",21,"""DDB5647CE46EFD64"""
+"""AA5D440EBF8D6362_903BF03A347B9BCD_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC=CBr""",21,"""DDB5647CE46EFD64"""
+"""D457DFCF9733F3AD_02FF5D334239E4D8_6031_DP""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCCO""",21,"""DDB5647CE46EFD64"""
+"""58519D7B0130E9C1_ECE4322BFFE4C5FF_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCOC""",21,"""DDB5647CE46EFD64"""
+"""B8C6B96FDFC2332E_B8E0A58B7EF1DB4B_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OC[C@@H]2CO2""",21,"""DDB5647CE46EFD64"""
+"""93B038283AB8C7FF_5FEFF402F035906C_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OC[C@H]2CO2""",21,"""DDB5647CE46EFD64"""
+"""9701C6F1FCA86692_B1D6770AB19EC308_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC2CO2""",21,"""DDB5647CE46EFD64"""
+"""7D60E984F44FCEF6_B59611D6297016DB_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(Cl)Cl""",21,"""DDB5647CE46EFD64"""
+"""18DD8823B57B4834_E26A21C46E9B22A2_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(=C)Cl""",21,"""DDB5647CE46EFD64"""
+"""0682C0B31EA35734_85859ADC315A9F1A_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(C)F""",21,"""DDB5647CE46EFD64"""
+"""F88DA0287552AC15_3BC993C147BF0EFD_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC=CCl""",21,"""DDB5647CE46EFD64"""
+"""AAE866BE651F64F8_A541C6837DFC1D46_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCC(C)Br""",21,"""DDB5647CE46EFD64"""
+"""8F97628C1516037B_70E1A09750E28A04_6031_UN""","""CCOC1=CC=C(C=C1)C(=O)CCCC(=O)OCCCI""",21,"""DDB5647CE46EFD64"""
+"""FB6BC738C38133AF_D27660B4A4F63568_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC(C)=C""",21,"""DE171294830C23EB"""
+"""F92D7B35118A91C8_CE6810577B78E5C9_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC(F)F""",21,"""DE171294830C23EB"""
+"""57F1344B425D60FD_768DFCD62FF5DE92_6031_DP""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCNC""",21,"""DE171294830C23EB"""
+"""ACBAB2A216AE36CB_72AD31A4CD7A85FC_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OC[C@H](C)N""",21,"""DE171294830C23EB"""
+"""C903C11269EEA315_AEF94032D99AED3F_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC(C)S""",21,"""DE171294830C23EB"""
+"""356E5F59B49684A2_D3DBB40A8D5BE832_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCSC""",21,"""DE171294830C23EB"""
+"""EAF4D34AD8356834_9003BEDF5D3F1145_6031_DP""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC(C)N""",21,"""DE171294830C23EB"""
+"""888768618EE98598_C4BC91552AC384C4_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC#CC""",21,"""DE171294830C23EB"""
+"""28FAEB8CB864783E_51CDA6FB50D7371B_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCON""",21,"""DE171294830C23EB"""
+"""75C68C31DC5DFE98_56B6341BB43E8C1B_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC(=C)Br""",21,"""DE171294830C23EB"""
+"""5A781509028EEE5D_7C845492D87F7902_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OC[C@@H](C)N""",21,"""DE171294830C23EB"""
+"""8E8DB300BB2C4699_4DDF686219C4EE80_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OC[CH]=[C]=[CH2]""",21,"""DE171294830C23EB"""
+"""D4AA3A7D825AB048_BA077C4ED3D07ACD_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC#CBr""",21,"""DE171294830C23EB"""
+"""B29D04AAF3F04C37_3443457B0748E243_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC(C)Cl""",21,"""DE171294830C23EB"""
+"""45F652E903257A81_24FA2AF9B06EEDFE_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCCF""",21,"""DE171294830C23EB"""
+"""9253632A238B74BA_A0393340416C0E64_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC(N)=S""",21,"""DE171294830C23EB"""
+"""2632E8BCFAF99669_A1A1EEA63BA4D043_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCCS""",21,"""DE171294830C23EB"""
+"""4512A00F054612E0_DE50CEF4E16FD02D_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCCC""",21,"""DE171294830C23EB"""
+"""31E81BA015E9047E_5C320702233944D9_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCCN""",21,"""DE171294830C23EB"""
+"""7AA74F0567EFBCB4_FC3380E0D689856A_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCCBr""",21,"""DE171294830C23EB"""
+"""AF94C439876CEBA9_B9EFB457732F294A_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC(C)C""",21,"""DE171294830C23EB"""
+"""0DC20B0D586B3474_8BA56A9678BCB1FD_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC3CC3""",21,"""DE171294830C23EB"""
+"""0868591DC261B698_D52AD65803A062FA_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCC=C""",21,"""DE171294830C23EB"""
+"""7191BF2094E7FCEB_14227C03C5B26296_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCC#C""",21,"""DE171294830C23EB"""
+"""2E9C47A6A5A65B37_0E480FDF05B77859_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCCCl""",21,"""DE171294830C23EB"""
+"""932B1B5AC5F37FB8_A0B2814A46D05EF6_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCC#N""",21,"""DE171294830C23EB"""
+"""BD69F58224F8577C_DFC4DC113F7B56DE_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC(F)Br""",21,"""DE171294830C23EB"""
+"""6D5B6E5DD88F5846_68225C482AA79EEC_6031_DP""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCNN""",21,"""DE171294830C23EB"""
+"""365795B849118649_9751C2CFB1F0B1E7_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC(=C)F""",21,"""DE171294830C23EB"""
+"""BFA833DDBD37B4D5_939986D253194542_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCC=CBr""",21,"""DE171294830C23EB"""
+"""7B07234801F83780_015D2BDB255B3A57_6031_DP""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCCO""",21,"""DE171294830C23EB"""
+"""55486AFC1D3C43FD_EF4644C398861B70_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OCCOC""",21,"""DE171294830C23EB"""
+"""1E7117D0BF90CB23_BB42D363199305C4_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OC[C@@H]3CO3""",21,"""DE171294830C23EB"""
+"""689A0BEAE5A2BC25_5C4D82EA97574EE3_6031_UN""","""CC1=CSC(=N1)CNC2=CC(=CC=C2)C(=O)OC[C@H]3CO3""",21,"""DE171294830C23EB"""
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+"""74D0AD7F57CC5884_F1161AD111183821_6031_UN""","""CN1CCN(CC1)C2(CCCCC2)CC(=O)OCC(F)F""",21,"""E1691812E96CFE03"""
+"""A98E0F12A06F7C6C_49F3F6504595037A_6031_DP""","""CN1CCN(CC1)C2(CCCCC2)CC(=O)OCCNC""",21,"""E1691812E96CFE03"""
+"""074037F87C923983_4DD33B22A71A5814_6031_UN""","""CN1CCN(CC1)C2(CCCCC2)CC(=O)OC[C@H](C)N""",21,"""E1691812E96CFE03"""
+"""D5B62E2349E48347_91874AB4B3FA30D7_6031_UN""","""CN1CCN(CC1)C2(CCCCC2)CC(=O)OCC(C)S""",21,"""E1691812E96CFE03"""
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+"""A704880A877BCA56_469C17B8389E7EBE_6031_UN""","""CCCC1=NOC2=C1C(=CC(=N2)CC)C(=O)OC[C@@H](C)N""",21,"""E40F51BE63ED2457"""
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+"""130B7A3199ADB08C_0E5B0651E7A9E5FF_6031_UN""","""CCCC1=NOC2=C1C(=CC(=N2)CC)C(=O)OCC(C)Cl""",21,"""E40F51BE63ED2457"""
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+"""E8FEA3D4DE0020FC_C62BC3CA366882D6_6031_UN""","""CCCC1=NOC2=C1C(=CC(=N2)CC)C(=O)OCCCBr""",21,"""E40F51BE63ED2457"""
+"""CFAAFDC9D22C66A5_83F7F77D93CE2EF6_6031_UN""","""CCCC1=NOC2=C1C(=CC(=N2)CC)C(=O)OCC(C)C""",21,"""E40F51BE63ED2457"""
+"""EE32B888074E97AC_B1BD29BC985DB641_6031_UN""","""CCCC1=NOC2=C1C(=CC(=N2)CC)C(=O)OCC3CC3""",21,"""E40F51BE63ED2457"""
+"""5AF17176D4865F6A_EF329572E3416546_6031_UN""","""CCCC1=NOC2=C1C(=CC(=N2)CC)C(=O)OCCC=C""",21,"""E40F51BE63ED2457"""
+"""CBCC57D68BC7688E_2E3A3F292553652A_6031_UN""","""CCCC1=NOC2=C1C(=CC(=N2)CC)C(=O)OCCC#C""",21,"""E40F51BE63ED2457"""
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+"""3C4C6E76C9051EC3_3556CCF7691F54E2_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCCCCl""",21,"""E509D1BCEFA40F50"""
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+"""F8403D8DDFCFD093_533C9F60460FB257_6031_DP""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCCNN""",21,"""E509D1BCEFA40F50"""
+"""B086B9C5423CCDF5_AC4F01E7DD589D5C_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCC(=C)F""",21,"""E509D1BCEFA40F50"""
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+"""641AB869DBF8AA0A_3A43E8F349F316EC_6031_DP""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCCCO""",21,"""E509D1BCEFA40F50"""
+"""2E44D0800507E03E_D45887EBF42E37CB_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCCOC""",21,"""E509D1BCEFA40F50"""
+"""02990D3CFF8DA1B5_805C104B753B297F_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OC[C@@H]2CO2""",21,"""E509D1BCEFA40F50"""
+"""570C63A744DB76CE_675341C2FBFF6258_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OC[C@H]2CO2""",21,"""E509D1BCEFA40F50"""
+"""4187DCCA9ECB5083_896AC2CABA54313C_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCC2CO2""",21,"""E509D1BCEFA40F50"""
+"""8D354F3F85A31CD5_8D2AA41622BAE4EF_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCC(Cl)Cl""",21,"""E509D1BCEFA40F50"""
+"""4BEB35FC7953965D_DAD694046551D096_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCC(=C)Cl""",21,"""E509D1BCEFA40F50"""
+"""809E1B0A20334A34_BD392F1C3A906D2E_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCC(C)F""",21,"""E509D1BCEFA40F50"""
+"""37503BA69D461F6F_037526014C75FCC9_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCC=CCl""",21,"""E509D1BCEFA40F50"""
+"""32E10F7DE1084971_9DFD73437636EF72_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCC(C)Br""",21,"""E509D1BCEFA40F50"""
+"""1CCF83238CB2F8E3_485D15575B287830_6031_UN""","""COC1=C(C=CC(=C1)C(F)(F)F)C=CC(=O)OCCCI""",21,"""E509D1BCEFA40F50"""
+"""0D9016A0608181C8_E9008A7139EADDAC_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(C)=C)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""079032F3FE2F3975_F51EFA92E6640D0D_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(F)F)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""8760E1A5B2D149EA_4DFB1613B2E93656_6031_DP""","""C[Si]1(C)CCC(CC1)(C(=O)OCCNC)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""BACA0192FB98A2DC_49DBDB6150666D38_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OC[C@H](C)N)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""138E711C20C52CDE_958FAAF7448605FB_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(C)S)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""77EBCA8395C29914_E8AD5ECF104700F6_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCSC)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""8B391837E1A4DD9C_AB75541AC023F981_6031_DP""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(C)N)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""FD9EFF3BC0ACA5C4_FFCA7B90B7DF6C00_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC#CC)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""FD9B31E4BC15E8B6_6ABB4C3ECDCBDFDF_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCON)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""221C3E983CF16028_6DC0DEDE292264DF_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(=C)Br)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""8CD0BB90F4986E85_47F2BE57456391C6_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OC[C@@H](C)N)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""7E40C0022CADFBDF_76A982A784D80644_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OC[CH]=[C]=[CH2])C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""F96E5C48C1BEA84A_8171968B4ECC9209_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC#CBr)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""45F8FA4AF0C01396_0F35AFBE9A540A87_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(C)Cl)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""8E68E07AEA87C727_1F8CC03C2D72053A_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCCF)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""003D436629E3623C_9B4FD985DC70E6A0_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(N)=S)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""CF255E5CDC55D6F8_9AD70463A6B83887_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCCS)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""D73E5C3176EC3226_E52624317C7338E9_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCCC)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""57D6A7147D969814_6744EDC7BE25AC1D_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCCN)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""BD45D5356FC796AF_C7456A254B956DAE_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCCBr)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""1B497237296090C9_82995E92EE33C18E_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(C)C)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""2B076AB1069438D6_B0D38053E5A05939_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC2CC2)C3=CC=CC=C3""",21,"""E561F8511E10CB2F"""
+"""37582BDB71D96724_EE5C3C9D9EBC8A3E_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCC=C)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""0C0B89FF7D732E65_2F5496C658AE8A52_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCC#C)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""A0835ED696B1F5C3_353EE51A98AB909D_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCCCl)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""8813B108F88BBAC4_9BC46B8FDBCCB632_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCC#N)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""1CA319EA513A2D1D_E4B236D4A267BE1A_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(F)Br)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""905CFF6DD6C4D1D5_5354B68DB7BB7628_6031_DP""","""C[Si]1(C)CCC(CC1)(C(=O)OCCNN)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""951A7AAF72F45CA0_AC27280A2CEC5923_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(=C)F)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""A2FA2FBF6A0EDBBA_A8EF6C17CE05AD86_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC=CBr)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""7A5BE16CCDFD7AE2_3A2BC11EB847D293_6031_DP""","""C[Si]1(C)CCC(CC1)(C(=O)OCCCO)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""5F1A62F8912F8A8F_D430AE06059AF3B4_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCOC)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""FA62E267A9F4E36A_803439A6848FED00_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OC[C@@H]2CO2)C3=CC=CC=C3""",21,"""E561F8511E10CB2F"""
+"""5F4916B8E2E8FA74_673B682F0A4BA627_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OC[C@H]2CO2)C3=CC=CC=C3""",21,"""E561F8511E10CB2F"""
+"""B39028A0C70F1170_8902EB274BE0F543_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC2CO2)C3=CC=CC=C3""",21,"""E561F8511E10CB2F"""
+"""2D1D56076C06CF29_8D428DFBD30E2090_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(Cl)Cl)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""FE1654F097B58462_DABEBDE994E514E9_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(=C)Cl)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""7026C80FF1738061_BD5106F1CB24A951_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(C)F)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""6F7DD4C840C785D9_031D0FECBDC138B6_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC=CCl)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""6CB06F3ABD068E59_9D955AAE87822B0D_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCC(C)Br)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""CF376960A8E70617_48353CBAAA9CBC4F_6031_UN""","""C[Si]1(C)CCC(CC1)(C(=O)OCCCI)C2=CC=CC=C2""",21,"""E561F8511E10CB2F"""
+"""8B634E9B322325D3_EBBE1525CA99F5EB_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(C)=C""",21,"""E7DF6705ED63E368"""
+"""5E64D8997C54667B_F7A065C61517254A_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(F)F""",21,"""E7DF6705ED63E368"""
+"""A459B5A9A29C7710_4F458947419A1E11_6031_DP""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCNC""",21,"""E7DF6705ED63E368"""
+"""0578650806B01233_4B654435A315457F_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OC[C@H](C)N""",21,"""E7DF6705ED63E368"""
+"""28071CA8ABD95478_973135A3B7F52DBC_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(C)S""",21,"""E7DF6705ED63E368"""
+"""A274A0AC1B4F8FF5_EA13C19BE33428B1_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCSC""",21,"""E7DF6705ED63E368"""
+"""98A1D1F5255F7C3A_A9CBCB4E3350D1C6_6031_DP""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(C)N""",21,"""E7DF6705ED63E368"""
+"""521F599BFFBF24FF_FD74E4C444AC4447_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC#CC""",21,"""E7DF6705ED63E368"""
+"""B82A412E15305827_6805D36A3EB8F798_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCON""",21,"""E7DF6705ED63E368"""
+"""24379967465E2313_6F7E418ADA514C98_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(=C)Br""",21,"""E7DF6705ED63E368"""
+"""130523F1706D551F_454C2103B610B981_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OC[C@@H](C)N""",21,"""E7DF6705ED63E368"""
+"""594BB5C0BE4C4510_74171DF377AB2E03_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OC[CH]=[C]=[CH2]""",21,"""E7DF6705ED63E368"""
+"""297C5C468CB7A506_83CF09DFBDBFBA4E_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC#CBr""",21,"""E7DF6705ED63E368"""
+"""7234349F5D571968_0D8B30EA692722C0_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(C)Cl""",21,"""E7DF6705ED63E368"""
+"""B24613072DFF6F5E_1D325F68DE012D7D_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCCF""",21,"""E7DF6705ED63E368"""
+"""245886F6F610F5CF_99F146D12F03CEE7_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(N)=S""",21,"""E7DF6705ED63E368"""
+"""D4394C2125C39E1A_98699B3755CB10C0_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCCS""",21,"""E7DF6705ED63E368"""
+"""19D27666C9BC679E_E798BB658F0010AE_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCCC""",21,"""E7DF6705ED63E368"""
+"""1F11DCFD3F904CFB_65FA72934D56845A_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCCN""",21,"""E7DF6705ED63E368"""
+"""04DC072B9D746326_C5FBF571B8E645E9_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCCBr""",21,"""E7DF6705ED63E368"""
+"""6EF2298EE604ABB5_8027C1C61D40E9C9_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(C)C""",21,"""E7DF6705ED63E368"""
+"""9EBD4180C7E0717C_B26D1F0716D3717E_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC3CC3""",21,"""E7DF6705ED63E368"""
+"""7BC3894E3CC6832D_ECE2A3C96DCFA279_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCC=C""",21,"""E7DF6705ED63E368"""
+"""FC53111E58C46154_2DEA0992ABDDA215_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCC#C""",21,"""E7DF6705ED63E368"""
+"""FAC610746E94ABFE_37807A4E6BD8B8DA_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCCCl""",21,"""E7DF6705ED63E368"""
+"""18C7D6FDBA851500_997AF4DB28BF9E75_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCC#N""",21,"""E7DF6705ED63E368"""
+"""AFC742C7C49A2E0C_E60CA9805114965D_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(F)Br""",21,"""E7DF6705ED63E368"""
+"""862BA938873B21B0_51EA29D944C85E6F_6031_DP""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCNN""",21,"""E7DF6705ED63E368"""
+"""CF3ADD9CD3C1F212_AE99B75EDF9F7164_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(=C)F""",21,"""E7DF6705ED63E368"""
+"""AFC0FF96C4A833C8_AA51F3433D7685C1_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC=CBr""",21,"""E7DF6705ED63E368"""
+"""63C42BFDE8F7B9DF_38955E4A4B34FAD4_6031_DP""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCCO""",21,"""E7DF6705ED63E368"""
+"""C99311DEE8ED4E3B_D68E3152F6E9DBF3_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCOC""",21,"""E7DF6705ED63E368"""
+"""5B8C3DF1323CA873_828AA6F277FCC547_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OC[C@@H]3CO3""",21,"""E7DF6705ED63E368"""
+"""E2D291A6F8E6DEA6_6585F77BF9388E60_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OC[C@H]3CO3""",21,"""E7DF6705ED63E368"""
+"""D2AA1B36A4ED4090_8BBC7473B893DD04_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC3CO3""",21,"""E7DF6705ED63E368"""
+"""81638E29C5F94649_8FFC12AF207D08D7_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(Cl)Cl""",21,"""E7DF6705ED63E368"""
+"""0603B60F27A7FAA2_D80022BD67963CAE_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(=C)Cl""",21,"""E7DF6705ED63E368"""
+"""2D7026952065C907_BFEF99A538578116_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(C)F""",21,"""E7DF6705ED63E368"""
+"""5383596EAA6436E8_01A390B84EB210F1_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC=CCl""",21,"""E7DF6705ED63E368"""
+"""58D62DFDB2E349E9_9F2BC5FA74F1034A_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCC(C)Br""",21,"""E7DF6705ED63E368"""
+"""321DA60525E4A026_4A8BA3EE59EF9408_6031_UN""","""CC1=CC(=CC=C1)OC2=C(C=CC=C2)C(=O)OCCCI""",21,"""E7DF6705ED63E368"""
+"""2240CB22BC8FA7DF_E55F5AF66C9D41F1_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCC(C)=C""",21,"""E93E28D64B675772"""
+"""C04EF6A16BA5F60D_F9412A15B3139150_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCC(F)F""",21,"""E93E28D64B675772"""
+"""A05CA1BFD46A2F1E_41A4C694E79EAA0B_6031_DP""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCCNC""",21,"""E93E28D64B675772"""
+"""3D8CA1BD262E51FB_45840BE60511F165_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OC[C@H](C)N""",21,"""E93E28D64B675772"""
+"""1566D25E81DE23E0_99D07A7011F199A6_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCC(C)S""",21,"""E93E28D64B675772"""
+"""1F0ABEB311B86740_E4F28E4845309CAB_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCCSC""",21,"""E93E28D64B675772"""
+"""60FF244131C3ECF6_A72A849D955465DC_6031_DP""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCC(C)N""",21,"""E93E28D64B675772"""
+"""D4D1ED14530A40C6_F395AB17E2A8F05D_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCC#CC""",21,"""E93E28D64B675772"""
+"""30DDBB4C3D678361_66E49CB998BC4382_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCCON""",21,"""E93E28D64B675772"""
+"""5A0A94BA2469C731_619F0E597C55F882_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCC(=C)Br""",21,"""E93E28D64B675772"""
+"""DCF24132C785CC7E_4BAD6ED010140D9B_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OC[C@@H](C)N""",21,"""E93E28D64B675772"""
+"""A0AEC7A6675E01B5_7AF65220D1AF9A19_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OC[CH]=[C]=[CH2]""",21,"""E93E28D64B675772"""
+"""967DC176CE262382_8D2E460C1BBB0E54_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCC#CBr""",21,"""E93E28D64B675772"""
+"""9AB731A44602BF61_036A7F39CF2396DA_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCC(C)Cl""",21,"""E93E28D64B675772"""
+"""C0E1FEEAB28D5438_13D310BB78059967_6031_UN""","""COCC1CCN(C1)C2=CC=C(C=C2)C(=O)OCCCF""",21,"""E93E28D64B675772"""
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+"""A0BD6D71DDAB87E3_969FB27B7196D9AE_6031_UN""","""CC2=NC1=NC(=N[N]1C(=C2)C(=O)OCC(C)Br)C(F)(F)F""",21,"""EE6B1084E804398C"""
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+"""9E0DB52BF8FC0CB1_F925BE17EDCB4068_6004_UN""","""CCOC(=O)C(N)CC1=CN=C(C=C1)C2=C(C)C=CC=C2""",21,"""F2752BF97FA11BCC"""
+"""30712A685FB98C7C_B984D35025B4DA49_6004_UN""","""CCOC(=O)C(N)CC1=CN=C(C=C1)C2=C(SC=C2)C#N""",21,"""F2752BF97FA11BCC"""
+"""C85A6B4DC691ED08_4C788CA234CED98E_6004_UN""","""CCOC(=O)C(N)CC1=CN=C(C=C1)C2=C(C=NC=C2)F""",21,"""F2752BF97FA11BCC"""
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+"""7668BCF318EE9CEB_F970F02DC156C1B6_6004_UN""","""CCOC(=O)C(N)CC1=CN=C(C=C1)C2=C(OC=C2)C#N""",21,"""F2752BF97FA11BCC"""
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+"""023684C14F6EA693_7DB5BEFFDF8C543D_6004_UN""","""CCOC(=O)C(N)CC1=CN=C(C=C1)C2=C(C=CO2)C#N""",21,"""F2752BF97FA11BCC"""
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+"""2C1987DCCD944421_F8B94FA9BC47607B_6004_UN""","""CCOC(=O)C(N)CC1=CN=C(C=C1)C2=CC=C(C#N)O2""",21,"""F2752BF97FA11BCC"""
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+"""ADF5CDBF1F1C01AD_58B92053087FE749_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OC[C@H](C)N)OC""",21,"""F40303634609415E"""
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+"""7CD64AB1F07C3DCA_EEA880A2EFC6E671_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCC#CC)OC""",21,"""F40303634609415E"""
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+"""D3CACABAB717CC77_7CA225EC713BEEAE_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCC(=C)Br)OC""",21,"""F40303634609415E"""
+"""55A957E50B8FF3D2_569045651D7A1BB7_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OC[C@@H](C)N)OC""",21,"""F40303634609415E"""
+"""601D6F68F0BEEAF8_67CB7995DCC18C35_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OC[CH]=[C]=[CH2])OC""",21,"""F40303634609415E"""
+"""06D85CA72A079DAC_90136DB916D51878_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCC#CBr)OC""",21,"""F40303634609415E"""
+"""207BBDCEEC7EE006_1E57548CC24D80F6_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCC(C)Cl)OC""",21,"""F40303634609415E"""
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+"""A8AF9FD10AD9A8A0_A1B17B61BDB9D348_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCC2CC2)OC""",21,"""F40303634609415E"""
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+"""6A0573F66B278EAD_42364DBFEFA2FC59_6031_DP""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCCNN)OC""",21,"""F40303634609415E"""
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+"""478D891D1EFD1676_9156C294DC966771_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OC[C@@H]2CO2)OC""",21,"""F40303634609415E"""
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+"""01B2EB11C976035F_9C2076C98B17AAE1_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCC(Cl)Cl)OC""",21,"""F40303634609415E"""
+"""6DE83E6CE91B9191_CBDC46DBCCFC9E98_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCC(=C)Cl)OC""",21,"""F40303634609415E"""
+"""E142A06285C4C5A1_AC33FDC3933D2320_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCC(C)F)OC""",21,"""F40303634609415E"""
+"""3157F5BE61D2E3D8_127FF4DEE5D8B2C7_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCC=CCl)OC""",21,"""F40303634609415E"""
+"""334C5C392CAA4E48_8CF7A19CDF9BA17C_6031_UN""","""CCCOC1=C(C=C(C=C1)C=CC(=O)OCC(C)Br)OC""",21,"""F40303634609415E"""
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+"""8319989217147657_F8E680C33F0B1B7F_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(C)=C""",21,"""F487F2E318F10DFC"""
+"""5D1058DAE510DFE0_E4F8F020E085CBDE_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(F)F""",21,"""F487F2E318F10DFC"""
+"""1E88AC8D8C5543AB_5C1D1CA1B408F085_6031_DP""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCNC""",21,"""F487F2E318F10DFC"""
+"""B1425F4299DB1D80_583DD1D35687ABEB_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OC[C@H](C)N""",21,"""F487F2E318F10DFC"""
+"""099D29D1DA3C4831_8469A0454267C328_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(C)S""",21,"""F487F2E318F10DFC"""
+"""83E7E4EE17BDCE86_F94B547D16A6C625_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCSC""",21,"""F487F2E318F10DFC"""
+"""8ADA68349544AC79_BA935EA8C6C23F52_6031_DP""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(C)N""",21,"""F487F2E318F10DFC"""
+"""5C253938EE7C9B29_EE2C7122B13EAAD3_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC#CC""",21,"""F487F2E318F10DFC"""
+"""D4FEE4AC83D7E741_7B5D468CCB2A190C_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCON""",21,"""F487F2E318F10DFC"""
+"""7205838F75ED35DD_7C26D46C2FC3A20C_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(=C)Br""",21,"""F487F2E318F10DFC"""
+"""7F496C41DD29D3FE_5614B4E543825715_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OC[C@@H](C)N""",21,"""F487F2E318F10DFC"""
+"""201AAC94E4459E5E_674F88158239C097_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OC[CH]=[C]=[CH2]""",21,"""F487F2E318F10DFC"""
+"""2664A3A61C7000A9_90979C39482D54DA_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC#CBr""",21,"""F487F2E318F10DFC"""
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+"""E592CB8EF66BD432_0E6ACA8E2B93C3E9_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCF""",21,"""F487F2E318F10DFC"""
+"""512DA3628C74388B_8AA9D337DA912073_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(N)=S""",21,"""F487F2E318F10DFC"""
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+"""1658AC0E23E81B54_F4C02E837A92FE3A_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCC""",21,"""F487F2E318F10DFC"""
+"""70A57F14BEBCECCA_76A2E775B8C46ACE_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCN""",21,"""F487F2E318F10DFC"""
+"""5A800ABF3B4E744F_D6A360974D74AB7D_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCBr""",21,"""F487F2E318F10DFC"""
+"""CE5E1019818A7159_937F5420E8D2075D_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(C)C""",21,"""F487F2E318F10DFC"""
+"""A6DEB31C087A8F96_A1358AE1E3419FEA_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC3CC3""",21,"""F487F2E318F10DFC"""
+"""40B1D20614BB3C00_FFBA362F985D4CED_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCC=C""",21,"""F487F2E318F10DFC"""
+"""F2ACD51FDD267EE2_3EB29C745E4F4C81_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCC#C""",21,"""F487F2E318F10DFC"""
+"""1296C02444D781D6_24D8EFA89E4A564E_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCCl""",21,"""F487F2E318F10DFC"""
+"""48083BC9B688347E_8A22613DDD2D70E1_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCC#N""",21,"""F487F2E318F10DFC"""
+"""4DC018F75C1CABCC_F5543C66A48678C9_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(F)Br""",21,"""F487F2E318F10DFC"""
+"""DB5D7B5C4B118966_42B2BC3FB15AB0FB_6031_DP""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCNN""",21,"""F487F2E318F10DFC"""
+"""3205910011F89D87_BDC122B82A0D9FF0_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(=C)F""",21,"""F487F2E318F10DFC"""
+"""B46087B19DF46462_B90966A5C8E46B55_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC=CBr""",21,"""F487F2E318F10DFC"""
+"""50B94A23B3410DE2_2BCDCBACBEA61440_6031_DP""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCO""",21,"""F487F2E318F10DFC"""
+"""C52BEFDE70345370_C5D6A4B4037B3567_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCOC""",21,"""F487F2E318F10DFC"""
+"""EBBB2070B00C87F2_91D23314826E2BD3_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OC[C@@H]3CO3""",21,"""F487F2E318F10DFC"""
+"""B1A545CE4253DABC_76DD629D0CAA60F4_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OC[C@H]3CO3""",21,"""F487F2E318F10DFC"""
+"""AB0550F0064E84BF_98E4E1954D013390_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC3CO3""",21,"""F487F2E318F10DFC"""
+"""E1CD6CBF8F7D7146_9CA48749D5EFE643_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(Cl)Cl""",21,"""F487F2E318F10DFC"""
+"""68C51BDDB16A27A0_CB58B75B9204D23A_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(=C)Cl""",21,"""F487F2E318F10DFC"""
+"""C26C71278D7E92B6_ACB70C43CDC56F82_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(C)F""",21,"""F487F2E318F10DFC"""
+"""2E0265A0889FBDAD_12FB055EBB20FE65_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC=CCl""",21,"""F487F2E318F10DFC"""
+"""3ED818F62E01AD11_8C73501C8163EDDE_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(C)Br""",21,"""F487F2E318F10DFC"""
+"""B5017348DF69AEB9_59D33608AC7D7A9C_6031_UN""","""CC(C)C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCI""",21,"""F487F2E318F10DFC"""
+"""FECD4796D0D9A3C5_F9330C415231B2BC_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC(C)=C""",21,"""F5527E6175CBA43F"""
+"""60AEA11489F1A2BF_E52D7CA28DBF621D_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC(F)F""",21,"""F5527E6175CBA43F"""
+"""853E749F439FB3AA_5DC89023D9325946_6031_DP""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCNC""",21,"""F5527E6175CBA43F"""
+"""586A7C0BA6CFE340_59E85D513BBD0228_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OC[C@H](C)N""",21,"""F5527E6175CBA43F"""
+"""0C3D49F1C3ED6FB8_85BC2CC72F5D6AEB_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC(C)S""",21,"""F5527E6175CBA43F"""
+"""31DB24FA4618A21D_F89ED8FF7B9C6FE6_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCSC""",21,"""F5527E6175CBA43F"""
+"""E0D6EB9216336D1C_BB46D22AABF89691_6031_DP""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC(C)N""",21,"""F5527E6175CBA43F"""
+"""A08DF115D6D0A1E2_EFF9FDA0DC040310_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC#CC""",21,"""F5527E6175CBA43F"""
+"""54555F0B175FC30D_7A88CA0EA610B0CF_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCON""",21,"""F5527E6175CBA43F"""
+"""D01B55321FE02B6B_7DF358EE42F90BCF_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC(=C)Br""",21,"""F5527E6175CBA43F"""
+"""1E4C25AC4EE614DC_57C138672EB8FED6_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OC[C@@H](C)N""",21,"""F5527E6175CBA43F"""
+"""C1F3ED8D8540D514_669A0497EF036954_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OC[CH]=[C]=[CH2]""",21,"""F5527E6175CBA43F"""
+"""9D524506E8551553_914210BB2517FD19_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC#CBr""",21,"""F5527E6175CBA43F"""
+"""E56EEA67E714177C_1F06298EF18F6597_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC(C)Cl""",21,"""F5527E6175CBA43F"""
+"""F255D58B94BFEB6D_0FBF460C46A96A2A_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCCF""",21,"""F5527E6175CBA43F"""
+"""12DAB7A2605EB90C_8B7C5FB5B7AB89B0_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC(N)=S""",21,"""F5527E6175CBA43F"""
+"""7CD98FC056D7778B_8AE48253CD635797_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCCS""",21,"""F5527E6175CBA43F"""
+"""777B0E6E2BE3711C_F515A20117A857F9_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCCC""",21,"""F5527E6175CBA43F"""
+"""FC896A36D26A7765_77776BF7D5FEC30D_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCCN""",21,"""F5527E6175CBA43F"""
+"""13D64E5EAF9CE152_D776EC15204E02BE_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCCBr""",21,"""F5527E6175CBA43F"""
+"""433C96710DF74C67_92AAD8A285E8AE9E_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC(C)C""",21,"""F5527E6175CBA43F"""
+"""13139F935C38C068_A0E006638E7B3629_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC3CC3""",21,"""F5527E6175CBA43F"""
+"""AC3173061169A842_FE6FBAADF567E52E_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCC=C""",21,"""F5527E6175CBA43F"""
+"""822D4DA67657B53A_3F6710F63375E542_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCC#C""",21,"""F5527E6175CBA43F"""
+"""A660D6DA2063ACA2_250D632AF370FF8D_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCCCl""",21,"""F5527E6175CBA43F"""
+"""E4543D2F764BFFCD_8BF7EDBFB017D922_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCC#N""",21,"""F5527E6175CBA43F"""
+"""0B4553B603435AB0_F481B0E4C9BCD10A_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC(F)Br""",21,"""F5527E6175CBA43F"""
+"""AC3BF947AA2EAC01_436730BDDC601938_6031_DP""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCNN""",21,"""F5527E6175CBA43F"""
+"""8004F77ABCB30606_BC14AE3A47373633_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC(=C)F""",21,"""F5527E6175CBA43F"""
+"""312BD698D0099DD7_B8DCEA27A5DEC296_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCC=CBr""",21,"""F5527E6175CBA43F"""
+"""BBCABD4AC5B03622_2A18472ED39CBD83_6031_DP""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCCO""",21,"""F5527E6175CBA43F"""
+"""DF7CC5B5AB4EA56C_C40328366E419CA4_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OCCOC""",21,"""F5527E6175CBA43F"""
+"""A7ED0BE5B665CBDE_9007BF96EF548210_6031_UN""","""NC(CC1=CC2=C(C=C1)OCCCO2)C(=O)OC[C@@H]3CO3""",21,"""F5527E6175CBA43F"""
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+"""FDEA57DC18C59628_504DAF14CBE80134_6031_DP""","""COCC1=NC(=C(S1)C2=CC=CC=C2)C(=O)OCCNC""",21,"""F8D741566711FC4D"""
+"""B6B6D1370E07385D_546D626629675A5A_6031_UN""","""COCC1=NC(=C(S1)C2=CC=CC=C2)C(=O)OC[C@H](C)N""",21,"""F8D741566711FC4D"""
+"""00E96B0DFC80F331_883913F03D873299_6031_UN""","""COCC1=NC(=C(S1)C2=CC=CC=C2)C(=O)OCC(C)S""",21,"""F8D741566711FC4D"""
+"""AD3077E241F69257_F51BE7C869463794_6031_UN""","""COCC1=NC(=C(S1)C2=CC=CC=C2)C(=O)OCCSC""",21,"""F8D741566711FC4D"""
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+"""57028706DD3F3EAB_F0D438863BAB7D85_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCC(C)=C)C3""",21,"""FCB54AA61C516B06"""
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+"""6EE3F5640AB9C108_500F69965227CD11_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OC[C@H](C)N)C3""",21,"""FCB54AA61C516B06"""
+"""D05204FBF43587BE_8C5B180046C7A5D2_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCC(C)S)C3""",21,"""FCB54AA61C516B06"""
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+"""F74460A402D1CD42_E61EC967B59ECC29_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCC#CC)C3""",21,"""FCB54AA61C516B06"""
+"""953E44476170BA7E_736FFEC9CF8A7FF6_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCCON)C3""",21,"""FCB54AA61C516B06"""
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+"""738F16C0C552A6F3_5E260CA0472231EF_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OC[C@@H](C)N)C3""",21,"""FCB54AA61C516B06"""
+"""F8AFDE42136B0362_6F7D30508699A66D_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OC[CH]=[C]=[CH2])C3""",21,"""FCB54AA61C516B06"""
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+"""19E2263693B12530_16E11D499815AAAE_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCC(C)Cl)C3""",21,"""FCB54AA61C516B06"""
+"""DA57CC4038D08B44_065872CB2F33A513_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCCCF)C3""",21,"""FCB54AA61C516B06"""
+"""CC24065516E0C346_829B6B72DE314689_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCC(N)=S)C3""",21,"""FCB54AA61C516B06"""
+"""4BD52F1D6ACD2338_8303B694A4F998AE_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCCCS)C3""",21,"""FCB54AA61C516B06"""
+"""04322160ABDB3B9D_FCF296C67E3298C0_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCCCC)C3""",21,"""FCB54AA61C516B06"""
+"""4D9A92F9D24B1B83_7E905F30BC640C34_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCCCN)C3""",21,"""FCB54AA61C516B06"""
+"""21898C74085697FC_DE91D8D249D4CD87_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCCCBr)C3""",21,"""FCB54AA61C516B06"""
+"""C71BC8BF9C6068D0_9B4DEC65EC7261A7_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCC(C)C)C3""",21,"""FCB54AA61C516B06"""
+"""F8FB8DAA3EB1EDBD_A90732A4E7E1F910_6031_UN""","""CC4CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCC3CC3)C4""",21,"""FCB54AA61C516B06"""
+"""89FC3BEAA79839E9_F7888E6A9CFD2A17_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCCC=C)C3""",21,"""FCB54AA61C516B06"""
+"""6AAE6E9E6E3328DA_368024315AEF2A7B_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCCC#C)C3""",21,"""FCB54AA61C516B06"""
+"""730C10A5CC95E64A_2CEA57ED9AEA30B4_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCCCCl)C3""",21,"""FCB54AA61C516B06"""
+"""62F2AEE1301C20C2_8210D978D98D161B_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCCC#N)C3""",21,"""FCB54AA61C516B06"""
+"""BF44112AAB328F4D_FD668423A0261E33_6031_UN""","""CC3CCC1=C(C2=C([NH]1)C(=CC=C2)C(=O)OCC(F)Br)C3""",21,"""FCB54AA61C516B06"""
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+"""EDDA288AB2B67816_9744E380185BD9C6_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=C(C=CC=C2)Cl)CC(Cl)Cl""",21,"""FF67962AD5453279"""
+"""73E24533080BA3E1_C0B8D3925FB0EDBF_6031_UN""","""O(C(=O)C=CC1=CC=C(S1)C2=C(C=CC=C2)Cl)CC(=C)Cl""",21,"""FF67962AD5453279"""
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+"""0FD94C3D0422F658_DA23515221F8DDAE_6036_UN""","""CC(CC1CCCCCN1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""0160B4643C8C8A4E"""
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+"""0A9CFD14C6217B3D_715E95132129045A_6036_UN""","""CC(CC1CCCCCN1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""0160B4643C8C8A4E"""
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+"""E4C0BF9C1320201D_A9F84C0580D0CF3B_6036_UN""","""CC(CC1CCCCCN1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""0160B4643C8C8A4E"""
+"""5F371D7C0B1D18CB_408E762291FE0564_6036_UN""","""CC(CC1CCCCCN1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""0160B4643C8C8A4E"""
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+"""EC1F54F418B42BF4_CEB80B8FF1DDA9A7_6036_UN""","""CC(CC1CCCCCN1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""0160B4643C8C8A4E"""
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+"""9D3EABE7068752BA_869DD4D3E41675CB_6036_UN""","""CC(CC1CCCCCN1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""0160B4643C8C8A4E"""
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+"""0ADB9607D05B28DB_14842788E57A0A62_6036_UN""","""CC(CC1CCCCCN1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""0160B4643C8C8A4E"""
+"""0B1A290371237F62_B026A150BB16E319_6036_UN""","""CC(CC1CCCCCN1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""0160B4643C8C8A4E"""
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+"""1CC65D5CB95BB569_F684DC22C62EBF5B_2267_UN""","""C(#CC[N]1C=NC=C1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""016E0C343F913E42"""
+"""FF6CFAAA6C8D16ED_6857557429D9E808_2267_UN""","""C(#CC[N]1C=NC=C1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""016E0C343F913E42"""
+"""934C6BD9A3120120_8CA9A637CBE9F5AD_2267_UN""","""C(#CC[N]1C=NC=C1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""016E0C343F913E42"""
+"""FC7833A3CA00C77A_EB9F50D978777626_2267_UN""","""C(#CC[N]1C=NC=C1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""016E0C343F913E42"""
+"""2CA570A92433CEE9_601EFB2BFE65BF37_2267_UN""","""C(#CC[N]1C=NC=C1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""016E0C343F913E42"""
+"""4599DCC6E5F689EC_9095E9AC48215762_2267_UN""","""C(#CC[N]1C=NC=C1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""016E0C343F913E42"""
+"""9AF90BEEF3C4E8E7_509AE871C2F30BF9_2267_UN""","""C(#CC[N]1C=NC=C1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""016E0C343F913E42"""
+"""1D35E65319F994BE_17FF7209B8632C95_2267_UN""","""C(#CC[N]1C=NC=C1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""016E0C343F913E42"""
+"""A1405DF73AC8B256_18D222DC96C9AF79_2267_UN""","""C(#CC[N]1C=NC=C1)C2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""016E0C343F913E42"""
+"""080E5813ADC19CAC_7E2E1C1737DCC21F_2267_UN""","""C(#CC[N]1C=NC=C1)C2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""016E0C343F913E42"""
+"""F74B19568924034E_D4FAAC50B91FD8B0_2267_UN""","""C(#CC[N]1C=NC=C1)C2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""016E0C343F913E42"""
+"""6A2AB762666EA33E_347EFF5DF1FD806E_2267_UN""","""C(#CC[N]1C=NC=C1)C2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""016E0C343F913E42"""
+"""A6318AF9A37537A4_515530AB1A6E0667_2267_UN""","""C(#CC[N]1C=NC=C1)C2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""016E0C343F913E42"""
+"""77BEF771B30B15FE_937F0415F1FECC35_2267_UN""","""C(#CC[N]1C=NC=C1)C3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""016E0C343F913E42"""
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+"""DB884317E7F8DE16_7C83FF2907F0A3D4_2267_UN""","""C(#CC[N]1C=NC=C1)C3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""016E0C343F913E42"""
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+"""B70AB6E6C42796ED_7B064F764A6AF081_2267_UN""","""C(#CC[N]1C=NC=C1)C2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""016E0C343F913E42"""
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+"""704D2035DC7B3B9A_D0E55AD7E59F23D5_6036_UN""","""C(CCNC1=CC=CC=C1)N(C)[S](=O)(=O)C2CCCNC2""",21,"""01E54C888D469E04"""
+"""80E7DB246732A766_E6E766FDD7FE6F67_6036_UN""","""C(CCNC1=CC=CC=C1)N(C)[S](=O)(=O)CC2CCCN2""",21,"""01E54C888D469E04"""
+"""DC63742D911E11D7_C23825407C451F71_6036_UN""","""C(CCNC1=CC=CC=C1)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""01E54C888D469E04"""
+"""B507F404ECB6EF87_0D1C10543D18D6D1_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C)(=O)=O)C2CCCNC2""",21,"""01E54C888D469E04"""
+"""90627B004802CADA_D85B17CDCE9E6B9B_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""01E54C888D469E04"""
+"""7F83D82EE26B94CF_601D2368584E16E0_6036_UN""","""C(CCNC1=CC=CC=C1)N(CC)[S](=O)(=O)C2CCNC2""",21,"""01E54C888D469E04"""
+"""A524A40F8A2A4164_A5BEAD52E48E3919_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""01E54C888D469E04"""
+"""F44B9D2A3B535D43_00E53836A66B3EEE_6036_UN""","""C(CCNC1=CC=CC=C1)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""01E54C888D469E04"""
+"""2AECB3B510B0F718_0E744F7C9F0D4D61_6036_UN""","""C(CCNC1=CC=CC=C1)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""01E54C888D469E04"""
+"""9F99C0EFDE2ED1F1_E0ED224D2832EB61_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C)(=O)=O)CCNC2CC2""",21,"""01E54C888D469E04"""
+"""436F9990C285C45A_5F716732E12668C9_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""01E54C888D469E04"""
+"""FD7126A1A1CBBA8A_E8FF9741A35A8EC0_6036_UN""","""C(CCNC1=CC=CC=C1)N(C)[S](=O)(=O)C2CCNCC2""",21,"""01E54C888D469E04"""
+"""F3CF9B3C3CD077A4_466DF401794D816F_6036_UN""","""C(CCNC1=CC=CC=C1)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""01E54C888D469E04"""
+"""8F84D8EACE6EC304_5E4925ED4B884DD8_6036_UN""","""C(CCNC1=CC=CC=C1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""01E54C888D469E04"""
+"""21CC722D28500995_BE056CBB162ACEB4_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""01E54C888D469E04"""
+"""6CD3EE929D76B383_F26BD1B82A2C9290_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C)(=O)=O)C2CCNCC2""",21,"""01E54C888D469E04"""
+"""635F71A01CAF55BF_8D7004F9B5085FFE_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""01E54C888D469E04"""
+"""618989BE2704DF38_5D0F57FBEF277718_6036_UN""","""C(CCNC1=CC=CC=C1)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""01E54C888D469E04"""
+"""E881877567553B6F_8F3E84A9878BD710_6036_UN""","""C(CCNC1=CC=CC=C1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""01E54C888D469E04"""
+"""8255BABE08BE0A19_346F5D328F1CF854_6036_UN""","""C(CCNC1=CC=CC=C1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""01E54C888D469E04"""
+"""E82B34638815D155_C6CE0621C707266E_6036_UN""","""C(CCNC1=CC=CC=C1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""01E54C888D469E04"""
+"""A619291E3AFAD134_E6DA12A8C7C76652_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C)(=O)=O)CC2CNCC2""",21,"""01E54C888D469E04"""
+"""4F676EA9C09321A4_DAA6A9BE9032C9E4_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""01E54C888D469E04"""
+"""91D7C860DE0DF2F9_D3EEB427ED34B89B_6036_UN""","""C(CCNC1=CC=CC=C1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""01E54C888D469E04"""
+"""CACEF259E934BD58_71DB6DFF90E31010_6036_UN""","""C(CCNC1=CC=CC=C1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""01E54C888D469E04"""
+"""02CB1DBBDB305F97_60CFBEDC83962324_6036_UN""","""C(CCNC1=CC=CC=C1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""01E54C888D469E04"""
+"""B620FA0D99C507FD_957980F0790DCD1F_6036_UN""","""C(CCNC1=CC=CC=C1)N(CCCN)[S](=O)(=O)C2CC2""",21,"""01E54C888D469E04"""
+"""78FE893F2E6196BC_A97DB4E9311ADB71_6036_UN""","""C(CCNC1=CC=CC=C1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""01E54C888D469E04"""
+"""95EB2351275AECC1_400B8ECE2034112E_6036_UN""","""C(CCNC1=CC=CC=C1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""01E54C888D469E04"""
+"""928E4E6B2A34C7EA_B30B2423BA2BFEFA_6036_UN""","""C(CCNC1=CC=CC=C1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""01E54C888D469E04"""
+"""701BB137D6AACE07_BA6534C0433E6145_6036_UN""","""C(CCNC1=CC=CC=C1)N2CCCCNCC[S]2(=O)=O""",21,"""01E54C888D469E04"""
+"""A0189BFCF305FC29_CE3DF3634017BDED_6036_UN""","""C(CCNC1=CC=CC=C1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""01E54C888D469E04"""
+"""37C49CF2357BDADE_21E60377967B729B_6036_UN""","""C(CCNC1=CC=CC=C1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""01E54C888D469E04"""
+"""7A58AC709BFC198D_86182C3F55DC6181_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""01E54C888D469E04"""
+"""92F2C73C47CEE057_BE5FDD6E8D6D738E_6036_UN""","""C(CCNC1=CC=CC=C1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""01E54C888D469E04"""
+"""0E52A74D91361E61_1401DF6454B01E28_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""01E54C888D469E04"""
+"""7DD713A9A9EF3C7C_B0A359BC0ADCF753_6036_UN""","""C(CCNC1=CC=CC=C1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""01E54C888D469E04"""
+"""00C202367F331092_A0EF87C053DB3CB6_6036_UN""","""C(CCNC1=CC=CC=C1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""01E54C888D469E04"""
+"""1323276806E1EDD5_B09D6519D1DDFAB8_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC(C(OC)=O)N""",21,"""02D52D0E33ED28B1"""
+"""DDEE3F52FD98D34B_CE856AEEE7F8D8A2_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC3CCNCC3""",21,"""02D52D0E33ED28B1"""
+"""A37BDF9F8F286F1A_221610C6E6B3A2AC_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC3CCCNC3""",21,"""02D52D0E33ED28B1"""
+"""9F7A66405F464EF4_BFCCEF4989B8A7BB_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC3NCCNC3""",21,"""02D52D0E33ED28B1"""
+"""922194284A340E71_5B905DF431ECDEA5_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC(CC=CC)N""",21,"""02D52D0E33ED28B1"""
+"""CA5CAE3DC6BBB869_19FA7F3789BC813F_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC(CC(C)C)N""",21,"""02D52D0E33ED28B1"""
+"""9089F92FD5C7E57C_D92CD6636DF9344E_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC3(N)CCCC3""",21,"""02D52D0E33ED28B1"""
+"""3C408DE97F0BFBA0_5A95587E0F8AC0FF_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OC[C@@H]3CCCNC3""",21,"""02D52D0E33ED28B1"""
+"""E5A3A5B7DE3B760C_301263AB1E83B041_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OC[C@@H]3CCCCN3""",21,"""02D52D0E33ED28B1"""
+"""EC98CDDE7C9A5AA2_73F32EAB35EF2AA2_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC3OCCNC3""",21,"""02D52D0E33ED28B1"""
+"""201CC835C0C277DF_B29651E4AC0C9277_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCCC3(CNC3)N""",21,"""02D52D0E33ED28B1"""
+"""A91E2213DA795A3F_F09092D61DCDA08E_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC(N)CC(F)F""",21,"""02D52D0E33ED28B1"""
+"""CF1176BFF948E19A_92DBF1679D805BE7_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OC[C@@H](C(OC)=O)N""",21,"""02D52D0E33ED28B1"""
+"""268B0E9FEBECED05_74B41A36AFCBB334_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC3COCCN3""",21,"""02D52D0E33ED28B1"""
+"""347D366076BD42CA_CE2A0263EC0719D8_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC(CCN)(C)C""",21,"""02D52D0E33ED28B1"""
+"""0CC8E43C7FA46E04_4529B5CF8816EA5A_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC3(CCNC3)C""",21,"""02D52D0E33ED28B1"""
+"""593E40F1426B05F2_F5D05F7D499960F6_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC34CC(N)(C3)C4""",21,"""02D52D0E33ED28B1"""
+"""013F41E328B9D27D_B88E979939871289_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCCCNC3CC3""",21,"""02D52D0E33ED28B1"""
+"""7E8BFA2991394E33_9A3863D1677CAE14_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC(=C3CNC3)F""",21,"""02D52D0E33ED28B1"""
+"""70F98B539247E1A4_C9E8830DB8980A9B_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC[C@H]3CCCN3""",21,"""02D52D0E33ED28B1"""
+"""252605665C8268B9_CAB5E5CC8BD103B1_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OC[C@H]3CC[C@@H](N)C3""",21,"""02D52D0E33ED28B1"""
+"""C4EA65F243605D0E_974367F3A50BB02D_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OC[C@H]3COC[C@H]3N""",21,"""02D52D0E33ED28B1"""
+"""12335A9A6965C9BF_D464834192D8E79E_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OC[C@H]3CCC[C@H]3N""",21,"""02D52D0E33ED28B1"""
+"""FA45F9576F8C407E_F04EF06D9FCF48C6_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC3C(CN3)(C)C""",21,"""02D52D0E33ED28B1"""
+"""472F8CA98668B136_8C035C11CBC06573_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCCCNC(C)C""",21,"""02D52D0E33ED28B1"""
+"""6D158690E735BD15_24D842FDD3213293_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCCC3(CN)CC3""",21,"""02D52D0E33ED28B1"""
+"""A16BBC2849F806F8_376C674E7D326CF9_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC(C(C)C)ON""",21,"""02D52D0E33ED28B1"""
+"""8308E8520E9BF173_1FF09D4E152821BF_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC(C(C)C)CN""",21,"""02D52D0E33ED28B1"""
+"""FCA3DD34FC5C6677_2FC28CF7E645F792_6031_DP""","""CC2(C)C1OCCCC1C2(N)C(=O)OCC3=CNCCO3""",21,"""02D52D0E33ED28B1"""
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+"""063B240CBC3D48F5_EA9E055DA2984632_7019_UN""","""CN1CCC(CC1)C=CC2=C(C=C(OC)C=C2CCl)OC""",21,"""0773A672451E0A92"""
+"""CF0FA68AB2460E7D_6858A93A74392A7D_7019_UN""","""CN1CCC(CC1)C=CC2=CC(=C(OC(F)(F)F)C=C2)Cl""",21,"""0773A672451E0A92"""
+"""4CE17B28B247102C_3F798D414C4F5963_7019_UN""","""CN1CCC(CC1)C=CC2=C(Cl)C=CC=C2[N]3C=CN=C3""",21,"""0773A672451E0A92"""
+"""AAC2874E2D9AE189_17010B3BA45B68BC_7019_UN""","""CN1CCC(CC1)C=CC3=CC(=C2OCOCC2=C3)CCl""",21,"""0773A672451E0A92"""
+"""8FE5F3752C22B58B_DF3988091647F5B2_7019_UN""","""CN1CCC(CC1)C=CC2=C(Cl)C=CC=C2[N]3C=CC=N3""",21,"""0773A672451E0A92"""
+"""BAC5AAE292193797_F060AABAE4AF084C_2267_UN""","""O[P](=O)(O)OCC#CC1=CC=C(C(CCC(O)=O)=O)C=C1""",21,"""078A7AAC1D108955"""
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+"""607326688DA858B0_84DAE765ECCF19CC_6031_DP""","""O(C(=O)[C@@H]1CC[C@H](N1)C2=CC=CC=C2)CCCNC(C)C""",21,"""0A0C967A14E2540E"""
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+"""7961832B724C2BE0_72790563C3EC8C94_6031_DP""","""O(C(=O)[C@@H]1CC[C@H](N1)C2=CC=CC=C2)CCC3CC(N)C3""",21,"""0A0C967A14E2540E"""
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+"""C659B52371024945_050226D2901B71EE_6031_DP""","""O(C(=O)[C@@H]1CC[C@H](N1)C2=CC=CC=C2)CC3(CNC3)C#N""",21,"""0A0C967A14E2540E"""
+"""9E54B9B149A60561_106AA74A9870F5F8_6031_DP""","""O(C(=O)[C@@H]1CC[C@H](N1)C2=CC=CC=C2)C[C@@H]3C[C@H](N)C=C3""",21,"""0A0C967A14E2540E"""
+"""17486AF5548BD5A9_596007A044ACDB9C_6031_DP""","""O(C(=O)[C@@H]1CC[C@H](N1)C2=CC=CC=C2)C[C@H]3CCCNC3""",21,"""0A0C967A14E2540E"""
+"""99BF27EB9090E251_F01C83DA86557426_6031_DP""","""O(C(=O)[C@@H]1CC[C@H](N1)C2=CC=CC=C2)CC3CC(NC)C3""",21,"""0A0C967A14E2540E"""
+"""CD77168DDB0FEE10_A0A373602A3A2FEB_6031_DP""","""O(C(=O)[C@@H]1CC[C@H](N1)C2=CC=CC=C2)CCC3CCNC3""",21,"""0A0C967A14E2540E"""
+"""AE65ACCD1C2B2D2D_4BF83EF8DE5797B9_6031_DP""","""O(C(=O)[C@@H]1CC[C@H](N1)C2=CC=CC=C2)C[C@@H]3OCCNC3""",21,"""0A0C967A14E2540E"""
+"""4C7FE8799942F867_FBCDD70409A7A3F9_2267_UN""","""CC(C)(C)NCC#CC1=CC=C(C(CCC(O)=O)=O)C=C1""",21,"""0C270712F01822E0"""
+"""7EF6D57E9B41D4A1_651E5E52E650F4AA_2267_UN""","""CC(C)(C)NCC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O""",21,"""0C270712F01822E0"""
+"""E7A3041DAB86FB29_81E0AD110460E90F_2267_UN""","""CC(C)(C)NCC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""0C270712F01822E0"""
+"""792DD6CF2BAA9E89_E6D65BFFB7FE6A84_2267_UN""","""CC(C)(C)NCC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""0C270712F01822E0"""
+"""C5E831C8509C8D34_6D57F00D31ECA395_2267_UN""","""CC(C)(C)NCC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""0C270712F01822E0"""
+"""56628F02785C088B_9DDCE28A87A84BC0_2267_UN""","""CC(C)(C)NCC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""0C270712F01822E0"""
+"""736A6DE974629216_5DD3E3570D7A175B_2267_UN""","""CC(C)(C)NCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""0C270712F01822E0"""
+"""8AD068F7ED43625F_1AB6792F77EA3037_2267_UN""","""CC(C)(C)NCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""0C270712F01822E0"""
+"""D1C4FE77C4ACA082_159B29FA5940B3DB_2267_UN""","""CC(C)(C)NCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""0C270712F01822E0"""
+"""81E931EF19FDB7F5_73671731F855DEBD_2267_UN""","""CC(C)(C)NCC#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""0C270712F01822E0"""
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+"""FB9580C929019822_39C1830879128DD8_2267_UN""","""OC(=O)[C@@H]1C[C@@H]1C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""0CD17061B77E33F4"""
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+"""B9765156946235F4_BD37CBB9D8069F00_2267_UN""","""OC(=O)[C@@H]1C[C@@H]1C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""0CD17061B77E33F4"""
+"""1784885C1B5133DB_963866AD2778D523_2267_UN""","""OC(=O)[C@@H]1C[C@@H]1C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""0CD17061B77E33F4"""
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+"""DEA087CD4208F823_971A611C3E9948FC_2267_UN""","""C(#CC1=NC=CN=C1)C2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""0DF377D0AE9FAE2B"""
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+"""90D5C0AA45991FE5_3B67AB8EEEC10DEF_2267_UN""","""C(#CC1=NC=CN=C1)C2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""0DF377D0AE9FAE2B"""
+"""7703E4186C6AEFB2_1FBDAF54B86F0667_2267_UN""","""C(#CC1=NC=CN=C1)C2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""0DF377D0AE9FAE2B"""
+"""01421E373E8A5F1D_68D512467FBA6C10_2267_UN""","""C(#CC1=NC=CN=C1)C2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""0DF377D0AE9FAE2B"""
+"""0CAA073C5342672E_BE9EF664B765B521_2267_UN""","""C(#CC1=NC=CN=C1)C2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""0DF377D0AE9FAE2B"""
+"""9AE9E38F00DCA937_9A01098C8F9B6F9A_2267_UN""","""C(#CC1=NC=CN=C1)C2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""0DF377D0AE9FAE2B"""
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+"""F93C8B483201D462_DC05F11FC2BA6FFD_6031_DP""","""O(C(=O)CC(CCC1=CC=CC=C1)N)CC(CCN)(C)C""",21,"""10FADE721D505E94"""
+"""B32E3807BBA548E0_570646B3A6AB9C7F_6031_DP""","""O(C(=O)CC(CCC1=CC=CC=C1)N)CC2(CCNC2)C""",21,"""10FADE721D505E94"""
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+"""582B1999ED119B01_0327303398DC437F_2267_UN""","""C(#CC1CNCCC1)C3=CC=C(CC2(C)NCCC2)C=C3""",21,"""117FC2E6793D88E7"""
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+"""8BB1F68D8F0FD072_6D31DB8DE7AB8D30_2267_UN""","""C(#CC1CNCCC1)C2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""117FC2E6793D88E7"""
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+"""7E184553400867B0_DE2ED6F08BBB8509_2267_UN""","""C(#CC1CNCCC1)C3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""117FC2E6793D88E7"""
+"""93075492C56B9081_27EB1EB839632B23_2267_UN""","""C(#CC1CNCCC1)C2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""117FC2E6793D88E7"""
+"""F461433C14E4DFA1_03311A626FCD20AB_2267_UN""","""C(#CC1CNCCC1)C2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""117FC2E6793D88E7"""
+"""19F927BCB0A742B6_7459A770A8184ADC_2267_UN""","""C(#CC1CNCCC1)C2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""117FC2E6793D88E7"""
+"""B89E97E8427F9CC9_A212435260C793ED_2267_UN""","""C(#CC1CNCCC1)C2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""117FC2E6793D88E7"""
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+"""8C31420744B54C77_1B760D986B0EC1C3_6036_UN""","""NC(CCN(C(C)(C)C)[S](=O)(=O)CCN)C1=CC=CC=C1""",21,"""14E70E6C794512A6"""
+"""7FA145C6FCDE74A8_F5EF60A9DC3167C3_6036_UN""","""NC(CCN([S](C)(=O)=O)CCNC1CC1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""0C6DA1622A40D3F1_4A7325D61525E46B_6036_UN""","""NC(CCN([S](C)(=O)=O)C(=O)CN=[N]#N)C1=CC=CC=C1""",21,"""14E70E6C794512A6"""
+"""DD109E0F8F9C1748_FDFDD5A557590262_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1CCNCC1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
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+"""AA7E13AA9DC90061_4B4B6709BF8BC17A_6036_UN""","""NC(CCN1[S](=O)(=O)C2=C(C1)C=CC=C2)C3=CC=CC=C3""",21,"""14E70E6C794512A6"""
+"""DC47668138B929D5_AB072E5FE2294216_6036_UN""","""NC(CCN([S](C)(=O)=O)CC1=CC=NO1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""AB76AD77CAD66BEE_E769935CDE2F1E32_6036_UN""","""NC(CCN([S](C)(=O)=O)C1CCNCC1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""4699842FC288ED8B_9872461D410BD35C_6036_UN""","""NC(CCN([S](C)(=O)=O)C1=NC=CC=C1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""52B5851EB6BE9BE2_480D151F1B24FBBA_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1=CN=CC=C1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""BD1F170FB5EDD465_9A3CC64D73885BB2_6036_UN""","""NC(CCN(C(C)(C)C(=N)N)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""14E70E6C794512A6"""
+"""96FAC283594D52E5_216D1FD67B1F74F6_6036_UN""","""NC(CCN(C)[S](=O)(=O)C1=C[N](C)C=N1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""7B03383059E7E08C_D3CC44C53304AACC_6036_UN""","""NC(CCN1CCCC(C(C)C)[S]1(=O)=O)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""7A0A6E287C63A3F0_F3D8504C33C4EAF0_6036_UN""","""NC(CCN([S](C)(=O)=O)CC1CNCC1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""35340A01111F6386_CFA4EB5A64314546_6036_UN""","""NC(CCN([S](C)(=O)=O)[C@@H]1CNCCC1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""4C1152656C7A9164_C6ECF6C319373439_6036_UN""","""NC(CCN(CCCCl)[S](=O)(=O)C1CC1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""B7C9CBE8F9B869A6_64D92F1B64E09CB2_6036_UN""","""NC(CCN1C(=O)C2=C([S]1(=O)=O)C=CS2)C3=CC=CC=C3""",21,"""14E70E6C794512A6"""
+"""86364B437E3FA84C_75CDFC387795AF86_6036_UN""","""NC(CCN(C(C(C)(C)N)=O)[S](=O)(=O)C)C1=CC=CC=C1""",21,"""14E70E6C794512A6"""
+"""5D22761B05200AB7_807BC2148D0E41BD_6036_UN""","""NC(CCN(CCCN)[S](=O)(=O)C1CC1)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""D5B8B3EDF42A5232_BC7FF60DC51957D3_6036_UN""","""NC(CCN1CCCC(CC=C)[S]1(=O)=O)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""85C8E7FF4F3D0079_5509CC2AD4379D8C_6036_UN""","""NC(CCN(CCCN)[S](=O)(=O)C(F)F)C1=CC=CC=C1""",21,"""14E70E6C794512A6"""
+"""571DDBDD826B5536_A60966C74E287258_6036_UN""","""NC(CCN1[S](C2(CC1CI)CC2)(=O)=O)C3=CC=CC=C3""",21,"""14E70E6C794512A6"""
+"""4BCBD477888A2973_AF677624B73DEDE7_6036_UN""","""NC(CCN1CCCCNCC[S]1(=O)=O)C2=CC=CC=C2""",21,"""14E70E6C794512A6"""
+"""02C50385C3670724_DB3FB187B414314F_6036_UN""","""NC(CCN1[S](=O)(=O)C2(C1)CCOCC2)C3=CC=CC=C3""",21,"""14E70E6C794512A6"""
+"""413D2802148A35CB_34E441936278FE39_6036_UN""","""NC(CCN1C(CN)CC2([S]1(=O)=O)CC2)C3=CC=CC=C3""",21,"""14E70E6C794512A6"""
+"""1B759ABA6D58E13F_931A6EDBA1DFED23_6036_UN""","""NC(CCN([S](=O)(=O)C1CC1)C2CNC2)C3=CC=CC=C3""",21,"""14E70E6C794512A6"""
+"""5DF93727112EDC56_AB5D9F8A796EFF2C_6036_UN""","""NC(CCN1CC2(C[S]1(=O)=O)CCCC2)C3=CC=CC=C3""",21,"""14E70E6C794512A6"""
+"""CFA1D22A3CF9523E_01039D80A0B3928A_6036_UN""","""NC(CCN([S](=O)(=O)C1CNC1)C2CC2)C3=CC=CC=C3""",21,"""14E70E6C794512A6"""
+"""D18D4601DE5F2AA6_A5A11B58FEDF7BF1_6036_UN""","""NC(CCN([S](C)(=O)=O)CC[S](=O)(=O)Cl)C1=CC=CC=C1""",21,"""14E70E6C794512A6"""
+"""F18B23DE2A06605B_B5EDC524A7D8B014_6036_UN""","""NC(CCN(CCC)[S](=O)(=O)C(F)(F)F)C1=CC=CC=C1""",21,"""14E70E6C794512A6"""
+"""785B5E58BBF4370D_FE53E1083F43CDE0_6036_UN""","""C(CCCN1CCNCC1)N([S](CC)(=O)=O)CC(=O)OC""",21,"""1587A9C04651536F"""
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+"""51EECC9082C00A9A_C303C57BECA2ED17_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OC[C@H]2CCC[C@H]2N)N""",21,"""15B26B344D972238"""
+"""642C41B58501FCD3_E729B657E1B5424F_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OCC2C(CN2)(C)C)N""",21,"""15B26B344D972238"""
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+"""6AD6F6A6FABD1D1E_33BF04C7AD5B381A_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OCCC2(CN)CC2)N""",21,"""15B26B344D972238"""
+"""2AA6505717EEDD10_200B217403486670_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OCC(C(C)C)ON)N""",21,"""15B26B344D972238"""
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+"""E99B4D7EE3DD53F1_F416BFD8D66B4EF9_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OCCCC(CC)N)N""",21,"""15B26B344D972238"""
+"""CDDE08E3871266B5_E2E394B7628B9AEC_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OCC2(CN)COC2)N""",21,"""15B26B344D972238"""
+"""6C52F4E0B339545C_C9FD182A2C512E2C_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OCCCCCCN)N""",21,"""15B26B344D972238"""
+"""AB2F299FDC97EB9C_C2684587966638FA_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OCC2[C@@H]3CNC[C@H]23)N""",21,"""15B26B344D972238"""
+"""98541662B031E4A2_1ABCDB9CC96E07D8_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OCC2(CNC2)C#N)N""",21,"""15B26B344D972238"""
+"""BF2158E029859045_0FD45A04C10583CE_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OC[C@@H]2C[C@H](N)C=C2)N""",21,"""15B26B344D972238"""
+"""F2F4DBF5B10B445E_46DEFAEE1DD9ADAA_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OC[C@H]2CCCNC2)N""",21,"""15B26B344D972238"""
+"""800CDACB6F054AC4_EFA27E94DF200210_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OCC2CC(NC)C2)N""",21,"""15B26B344D972238"""
+"""17F1EFDEEEBA8473_BF1D8E2E734F59DD_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OCCC2CCNC2)N""",21,"""15B26B344D972238"""
+"""95BB17097154687C_5446C3B68722E18F_6031_DP""","""COC1=CC=C(C=C1)C(CC(=O)OC[C@@H]2OCCNC2)N""",21,"""15B26B344D972238"""
+"""0473215427C9B2EA_E125B6DACD391B37_2267_UN""","""C[N]2C=C(C#CC1=CC=C(C(CCC(O)=O)=O)C=C1)C=N2""",21,"""16CF66CC34869A2E"""
+"""EE722BDD50053F47_7FF63F8C22CE4C64_2267_UN""","""C[N]2C=C(C#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O)C=N2""",21,"""16CF66CC34869A2E"""
+"""B22874A7F3F52ED2_9B08CCCFC0FE51C1_2267_UN""","""C[N]3C=C(C#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O)C=N3""",21,"""16CF66CC34869A2E"""
+"""4F4CC0B51035B68D_FC3E3A217360D24A_2267_UN""","""C[N]3C=C(C#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2)C=N3""",21,"""16CF66CC34869A2E"""
+"""0E1D8A021EC2E189_77BF91D3F5721B5B_2267_UN""","""C[N]3C=C(C#CC2=CC(=C1C=CC=CC1=C2)C(O)=O)C=N3""",21,"""16CF66CC34869A2E"""
+"""6D0AB5ECEA27050A_873483544336F30E_2267_UN""","""C[N]3C=C(C#CC2=C(C(O)=O)C=C1C=CC=CC1=C2)C=N3""",21,"""16CF66CC34869A2E"""
+"""F97E87F579E35F88_473B8289C9E4AF95_2267_UN""","""C[N]3C=C(C#CC1=CC=C(C=C1)C(=O)C2CCCO2)C=N3""",21,"""16CF66CC34869A2E"""
+"""5A2DAF6434154E58_005E18F1B37488F9_2267_UN""","""C[N]2C=C(C#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F)C=N2""",21,"""16CF66CC34869A2E"""
+"""0C15838462FD7184_0F7348249DDE0B15_2267_UN""","""C[N]2C=C(C#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F)C=N2""",21,"""16CF66CC34869A2E"""
+"""70C8E60B65F7FCB0_698F76EF3CCB6673_2267_UN""","""C[N]2C=C(C#CC1=C(C(NCC(O)=O)=O)C=CC=C1)C=N2""",21,"""16CF66CC34869A2E"""
+"""51211846EFBD6849_C35BC6A8B2087CDC_2267_UN""","""C[N]2C=C(C#CC1=N[N](CC[S](CC)(=O)=O)C=C1C)C=N2""",21,"""16CF66CC34869A2E"""
+"""0A2AAE6A99EA386B_23DF95A5FAEA2402_2267_UN""","""C[N]3C=C(C#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2)C=N3""",21,"""16CF66CC34869A2E"""
+"""63C7815373E22FBF_46F45A531179A20B_2267_UN""","""C[N]2C=C(C#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F)C=N2""",21,"""16CF66CC34869A2E"""
+"""A1AFB14A9E299854_84DE6EEDFAE96859_2267_UN""","""C[N]3C=C(C#CC2=C1CCC(C(OC)=O)CC1=N[NH]2)C=N3""",21,"""16CF66CC34869A2E"""
+"""8A793F12EC2FD237_3A1351045CE27FD6_2267_UN""","""C[N]2C=C(C#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O)C=N2""",21,"""16CF66CC34869A2E"""
+"""8F3C787983FD5AA9_12F8404C46A714DB_2267_UN""","""C[N]2C=C(C#CC1=C(C(OCC)=O)C=N[N]1C(C)C)C=N2""",21,"""16CF66CC34869A2E"""
+"""10DF7F6306369FA8_D187B6A5442FCFE5_2267_UN""","""C[N]2C=C(C#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N)C=N2""",21,"""16CF66CC34869A2E"""
+"""9CFB96C8F2BEA133_04979419D56751B6_2267_UN""","""C[N]3C=C(C#CC2=CC=C(CC1(C)NCCC1)C=C2)C=N3""",21,"""16CF66CC34869A2E"""
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+"""FEEE0BBC0AACC872_CBA842B9F15F607F_6036_UN""","""CC(CN(CCCCl)[S](=O)(=O)C1CC1)N2CCCNCC2""",21,"""19A3BA16912D46E0"""
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+"""6DC09602C54E21DC_8D3F766E656615FB_6036_UN""","""CC(CN(CCCN)[S](=O)(=O)C1CC1)N2CCCNCC2""",21,"""19A3BA16912D46E0"""
+"""06354355A88C1D22_B13B42772D710395_6036_UN""","""CC(CN1CCCC(CC=C)[S]1(=O)=O)N2CCCNCC2""",21,"""19A3BA16912D46E0"""
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+"""361E5F4ED6DD0DD3_9E165D2AD733DFDE_6036_UN""","""CCN(CC)CCC(N)CN([S](=O)(=O)C1CC1)C2CNC2""",21,"""19EB3D9D0FA9205B"""
+"""6285BE2FD27DCB11_A651AC7B0F82CDD1_6036_UN""","""CCN(CC)CCC(N)CN1CC2(C[S]1(=O)=O)CCCC2""",21,"""19EB3D9D0FA9205B"""
+"""0DD9303E241945C3_0C0FAE71D65FA077_6036_UN""","""CCN(CC)CCC(N)CN([S](=O)(=O)C1CNC1)C2CC2""",21,"""19EB3D9D0FA9205B"""
+"""A1D3D563870B07E6_A8AD28A98833490C_6036_UN""","""CCN(CC)CCC(N)CN([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""19EB3D9D0FA9205B"""
+"""FBF970B28220127E_B8E1F6D5D13482E9_6036_UN""","""CCN(CC)CCC(N)CN(CCC)[S](=O)(=O)C(F)(F)F""",21,"""19EB3D9D0FA9205B"""
+"""0C2472EEF04380D3_A94ECFDC70B363CE_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC(C(OC)=O)N""",21,"""1B0687CB9283B1C7"""
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+"""CAFE05A676893D16_4243F731908247D3_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC(CC=CC)N""",21,"""1B0687CB9283B1C7"""
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+"""BBE3F4CEDE458977_C0FF7CA6CC97AD38_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3(N)CCCC3""",21,"""1B0687CB9283B1C7"""
+"""B74DCA0F4AD67BF7_4346F2BBAEE45989_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)C[C@@H]3CCCNC3""",21,"""1B0687CB9283B1C7"""
+"""996AF329A1E6A18C_29C1C96EBFED2937_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)C[C@@H]3CCCCN3""",21,"""1B0687CB9283B1C7"""
+"""CD34748683D2458B_6A20846E9481B3D4_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3OCCNC3""",21,"""1B0687CB9283B1C7"""
+"""5D30EEBF80DDE0EF_AB45FB210D620B01_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CCC3(CNC3)N""",21,"""1B0687CB9283B1C7"""
+"""E425147734BB2B54_E9433813BCA339F8_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC(N)CC(F)F""",21,"""1B0687CB9283B1C7"""
+"""0B6394BE8A73AA8A_8B085BA23CEEC291_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)C[C@@H](C(OC)=O)N""",21,"""1B0687CB9283B1C7"""
+"""B414D19051E0522F_6D67B0F30EA52A42_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3COCCN3""",21,"""1B0687CB9283B1C7"""
+"""33F364D7663000AD_D7F9A8A64D6980AE_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC(CCN)(C)C""",21,"""1B0687CB9283B1C7"""
+"""BB16D1602B6F7352_5CFA1F0A2978732C_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3(CCNC3)C""",21,"""1B0687CB9283B1C7"""
+"""3EF5C47960AB8EBB_EC03F5B8E8F7F980_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC34CC(N)(C3)C4""",21,"""1B0687CB9283B1C7"""
+"""DEC53A44F4A0BE95_A15D3D5C98E98BFF_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CCCNC3CC3""",21,"""1B0687CB9283B1C7"""
+"""8838637F6F89571E_83EBC914C6123762_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC(=C3CNC3)F""",21,"""1B0687CB9283B1C7"""
+"""C09D36EF7EAF3C8A_D03B29C819F693ED_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC[C@H]3CCCN3""",21,"""1B0687CB9283B1C7"""
+"""197CB17F1A74F333_D3664F092ABF9AC7_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)C[C@H]3CC[C@@H](N)C3""",21,"""1B0687CB9283B1C7"""
+"""D396DE384756B0CB_8E90CD360465295B_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)C[C@H]3COC[C@H]3N""",21,"""1B0687CB9283B1C7"""
+"""156EA094BD0D7CFF_CDB7298433B67EE8_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)C[C@H]3CCC[C@H]3N""",21,"""1B0687CB9283B1C7"""
+"""F56B345DFD7C2DF8_E99D5AA83EA1D1B0_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3C(CN3)(C)C""",21,"""1B0687CB9283B1C7"""
+"""0E5B52D71E9E2285_95D0F6D46AAEFC05_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CCCNC(C)C""",21,"""1B0687CB9283B1C7"""
+"""AE9204241F15988D_3D0BE838724FABE5_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CCC3(CN)CC3""",21,"""1B0687CB9283B1C7"""
+"""A7779AD1EB2EAA02_2EBFCD8BDC5CF58F_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC(C(C)C)ON""",21,"""1B0687CB9283B1C7"""
+"""B144A36B468FFCFD_0623378BB446B8C9_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC(C(C)C)CN""",21,"""1B0687CB9283B1C7"""
+"""AAB608E2311040C0_36112632472B6EE4_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3=CNCCO3""",21,"""1B0687CB9283B1C7"""
+"""43CE5E0456C018FF_0E4EC9A99FF6EA5C_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3=CNCCC3""",21,"""1B0687CB9283B1C7"""
+"""34527303DA6A692E_637314D2458D695D_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CCC3CC(N)C3""",21,"""1B0687CB9283B1C7"""
+"""E3277CABAA3EA8BB_05A6D7E48856781E_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)C[C@@H]3COCCN3""",21,"""1B0687CB9283B1C7"""
+"""B53AB00DEF4EE378_FAA25327097FDD06_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CCCC(CC)N""",21,"""1B0687CB9283B1C7"""
+"""01CC4C5464B04987_EC577848BD9F0913_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3(CN)COC3""",21,"""1B0687CB9283B1C7"""
+"""48FEDDE636C0C0A6_C749F4D5F345BDD3_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CCCCCCN""",21,"""1B0687CB9283B1C7"""
+"""F47C045A0B7D5A05_CCDCA9784972AB05_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3[C@@H]4CNC[C@H]34""",21,"""1B0687CB9283B1C7"""
+"""5BC2C75677F677E1_14083763167A9427_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3(CNC3)C#N""",21,"""1B0687CB9283B1C7"""
+"""63F28C34236B857F_0160B6FB1E111031_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)C[C@@H]3C[C@H](N)C=C3""",21,"""1B0687CB9283B1C7"""
+"""4D3E2F7E645B9D17_486A1611C2CD3E55_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)C[C@H]3CCCNC3""",21,"""1B0687CB9283B1C7"""
+"""FA5363EDA7B5B6AD_E116926B003491EF_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CC3CC(NC)C3""",21,"""1B0687CB9283B1C7"""
+"""FCC7BF06CD2BE23B_B1A962D1AC5BCA22_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)CCC3CCNC3""",21,"""1B0687CB9283B1C7"""
+"""72BC6B04E0A98EE9_5AF22F4958367270_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCCNC2)C[C@@H]3OCCNC3""",21,"""1B0687CB9283B1C7"""
+"""2A5D32E301D72ABD_F7D57613C6D7A132_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](CC)(=O)=O)CC(=O)OC""",21,"""1C013EDBBFC53FBD"""
+"""2BE4916C61FF6AA5_D488C3B7791449AF_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""1C013EDBBFC53FBD"""
+"""1B3E5C6611D1901C_FEFFECCEAB9F5409_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""1C013EDBBFC53FBD"""
+"""D708AEAA16FDEF4A_AC4AFB276707E196_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""1C013EDBBFC53FBD"""
+"""2D06EC3AE06D23DD_CD012884D71C826C_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2CCCNC2""",21,"""1C013EDBBFC53FBD"""
+"""51EF2D11036F9F78_FB0314AEE57DCEDE_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)CC2CCCN2""",21,"""1C013EDBBFC53FBD"""
+"""916BBFF3F81141E6_DFDC57134EC6BEC8_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""1C013EDBBFC53FBD"""
+"""03B73943B8E09185_10F862070F9B7768_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2CCCNC2""",21,"""1C013EDBBFC53FBD"""
+"""D0A4D6704FDB6E32_C5BF659EFC1DCA22_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""1C013EDBBFC53FBD"""
+"""181BB88BFD5B0787_7DF9513B6ACDB759_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(CC)[S](=O)(=O)C2CCNC2""",21,"""1C013EDBBFC53FBD"""
+"""D5C4E68198925150_B85ADF01D60D98A0_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""1C013EDBBFC53FBD"""
+"""1E9518B4B96FE99D_1D014A6594E89F57_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""1C013EDBBFC53FBD"""
+"""F61D8A7391A7B151_13903D2FAD8EECD8_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""1C013EDBBFC53FBD"""
+"""668EBF25065809AB_FD09501E1AB14AD8_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CCNC2CC2""",21,"""1C013EDBBFC53FBD"""
+"""F32DB8A472BB361F_42951561D3A5C970_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""1C013EDBBFC53FBD"""
+"""45DD629E5C612747_F51BE51291D92F79_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2CCNCC2""",21,"""1C013EDBBFC53FBD"""
+"""694A81C1F09A93A9_5B8986524BCE20D6_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""1C013EDBBFC53FBD"""
+"""D125D4E5A00FF7C2_43AD57BE790BEC61_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""1C013EDBBFC53FBD"""
+"""7C84F16EDA6227E4_A3E11EE824A96F0D_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""1C013EDBBFC53FBD"""
+"""CE9E045FBF6D157B_EF8FA3EB18AF3329_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2CCNCC2""",21,"""1C013EDBBFC53FBD"""
+"""EDDA45094D806ED6_909476AA878BFE47_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""1C013EDBBFC53FBD"""
+"""9A9CDECE5490CB34_40EB25A8DDA4D6A1_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""1C013EDBBFC53FBD"""
+"""43FF764C642CF764_92DAF6FAB50876A9_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""1C013EDBBFC53FBD"""
+"""0E3EBA61BED42C21_298B2F61BD9F59ED_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""1C013EDBBFC53FBD"""
+"""3958D54B53CEB48D_DB2A7472F58487D7_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""1C013EDBBFC53FBD"""
+"""B991A91F1F5A0F4F_FB3E60FBF544C7EB_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CC2CNCC2""",21,"""1C013EDBBFC53FBD"""
+"""8D9D6D662F5CCA9F_C742DBEDA2B1685D_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""1C013EDBBFC53FBD"""
+"""E56DFD2FCCDEBD57_CE0AC674DFB71922_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""1C013EDBBFC53FBD"""
+"""ADA0142FD66AF0C8_6C3F1FACA260B1A9_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""1C013EDBBFC53FBD"""
+"""67069CC23EBBF01D_7D2BCC8FB115829D_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""1C013EDBBFC53FBD"""
+"""E43C7A8CE4D23C6D_889DF2A34B8E6CA6_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(CCCN)[S](=O)(=O)C2CC2""",21,"""1C013EDBBFC53FBD"""
+"""811131E3DCB31B61_B499C6BA03997AC8_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2CCCC(CC=C)[S]2(=O)=O""",21,"""1C013EDBBFC53FBD"""
+"""F5CB8CE77101052C_5DEFFC9D12B7B097_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(CCCN)[S](=O)(=O)C(F)F""",21,"""1C013EDBBFC53FBD"""
+"""7607D25824244D37_AEEF567088A85F43_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""1C013EDBBFC53FBD"""
+"""A3E5A1CEADC1C78A_A781469371BDC0FC_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2CCCCNCC[S]2(=O)=O""",21,"""1C013EDBBFC53FBD"""
+"""A674B9C698C15A2C_D3D9813072941C54_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""1C013EDBBFC53FBD"""
+"""88E59C471CF1FBBD_3C027124A4F8D322_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""1C013EDBBFC53FBD"""
+"""D08524B0EF7E7A17_9BFC5E6C675FC038_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""1C013EDBBFC53FBD"""
+"""7795B455AA3AFF39_A3BBAF3DBFEED237_6036_UN""","""C(COC1=CC=C(C=C1)Br)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""1C013EDBBFC53FBD"""
+"""C316FF9E001C1D68_09E5AD376633BF91_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""1C013EDBBFC53FBD"""
+"""8604DB75287BFE62_AD472BEF385F56EA_6036_UN""","""C(COC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""1C013EDBBFC53FBD"""
+"""46D9892FA6149825_BD0BF59361589D0F_6036_UN""","""C(COC1=CC=C(C=C1)Br)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""1C013EDBBFC53FBD"""
+"""05A7DDE7D44BE5F4_F702973A29BE0983_6036_UN""","""CNC1CCN(CCN([S](CC)(=O)=O)CC(=O)OC)CC1""",21,"""1CD6DFF250AC970C"""
+"""E00F90154182F136_D45F229E967DE11E_6036_UN""","""CNC1CCN(CCN([C@H](C(OC)=O)C)[S](=O)(=O)C)CC1""",21,"""1CD6DFF250AC970C"""
+"""726CECAFAE892556_FE280DE744F6FCB8_6036_UN""","""CNC2CCN(CCN(C)[S](=O)(=O)C1=CC=C(Br)S1)CC2""",21,"""1CD6DFF250AC970C"""
+"""57415B88B657F43E_AC9D1A0E886E4927_6036_UN""","""CNC3CCN(CCN1C2=C(C[S]1(=O)=O)C=CC=C2)CC3""",21,"""1CD6DFF250AC970C"""
+"""787212CB05ED5765_CDD6C9AD38752ADD_6036_UN""","""CNC2CCN(CCN(C)[S](=O)(=O)C1CCCNC1)CC2""",21,"""1CD6DFF250AC970C"""
+"""A90DD96C072B09D8_FBD4F5870A14666F_6036_UN""","""CNC2CCN(CCN(C)[S](=O)(=O)CC1CCCN1)CC2""",21,"""1CD6DFF250AC970C"""
+"""67A164721769DC7B_DF0BB63AA1AF1679_6036_UN""","""CNC2CCN(CCN(C)[S](=O)(=O)C1=CC=C(Cl)S1)CC2""",21,"""1CD6DFF250AC970C"""
+"""980970421A442373_102F832EE0F2DFD9_6036_UN""","""CNC2CCN(CCN([S](C)(=O)=O)C1CCCNC1)CC2""",21,"""1CD6DFF250AC970C"""
+"""52E59960D82DEE56_C56884B713746293_6036_UN""","""CNC2CCN(CCN([S](C)(=O)=O)C1=NN=C(N)S1)CC2""",21,"""1CD6DFF250AC970C"""
+"""FEAA058E9B730F40_7D2EB01285A41FE8_6036_UN""","""CNC2CCN(CCN(CC)[S](=O)(=O)C1CCNC1)CC2""",21,"""1CD6DFF250AC970C"""
+"""4EA17DC3F0646B1E_B88D3E2839643011_6036_UN""","""CNC1CCN(CCN([S](C(C)(C)C)(=O)=O)CC=C)CC1""",21,"""1CD6DFF250AC970C"""
+"""7D4162A4FFCC1532_1DD6AB4C7B8137E6_6036_UN""","""CNC1CCN(CCN(C)[S](=O)(=O)CC[S](=O)(=O)C)CC1""",21,"""1CD6DFF250AC970C"""
+"""0AFD09437E532CA3_1347DC0642E74469_6036_UN""","""CNC1CCN(CCN(C(C)(C)C)[S](=O)(=O)CCN)CC1""",21,"""1CD6DFF250AC970C"""
+"""78A84A3AE4E73C04_FDDEB137F5D8E269_6036_UN""","""CNC2CCN(CCN([S](C)(=O)=O)CCNC1CC1)CC2""",21,"""1CD6DFF250AC970C"""
+"""AFB0CE42A3E28DCE_4242F4483CCC61C1_6036_UN""","""CNC1CCN(CCN([S](C)(=O)=O)C(=O)CN=[N]#N)CC1""",21,"""1CD6DFF250AC970C"""
+"""CF92CC70EA83563F_F5CC043B7EB087C8_6036_UN""","""CNC2CCN(CCN(C)[S](=O)(=O)C1CCNCC1)CC2""",21,"""1CD6DFF250AC970C"""
+"""7A7B82DECC9460AB_5B5E677BA4A78867_6036_UN""","""CNC2CCN(CCN1[S](CCC1C(OC)=O)(=O)=O)CC2""",21,"""1CD6DFF250AC970C"""
+"""31952C9E028E15E0_437AB697966244D0_6036_UN""","""CNC3CCN(CCN1[S](=O)(=O)C2=C(C1)C=CC=C2)CC3""",21,"""1CD6DFF250AC970C"""
+"""6ADE328ED7D80FEA_A336FFC1CBC0C7BC_6036_UN""","""CNC2CCN(CCN([S](C)(=O)=O)CC1=CC=NO1)CC2""",21,"""1CD6DFF250AC970C"""
+"""5B7FDD2D79A3F0DB_EF5842C2F7C69B98_6036_UN""","""CNC2CCN(CCN([S](C)(=O)=O)C1CCNCC1)CC2""",21,"""1CD6DFF250AC970C"""
+"""63C9D893EDDFADB6_9043978368E256F6_6036_UN""","""CNC2CCN(CCN([S](C)(=O)=O)C1=NC=CC=C1)CC2""",21,"""1CD6DFF250AC970C"""
+"""126C847CED62CA39_403CC48132CD7E10_6036_UN""","""CNC2CCN(CCN(C)[S](=O)(=O)C1=CN=CC=C1)CC2""",21,"""1CD6DFF250AC970C"""
+"""C8411CA423D48900_920D17D35A61DE18_6036_UN""","""CNC1CCN(CCN(C(C)(C)C(=N)N)[S](=O)(=O)C)CC1""",21,"""1CD6DFF250AC970C"""
+"""2FAE6301DB65FEE1_295CCE4852F6F15C_6036_UN""","""CNC2CCN(CCN(C)[S](=O)(=O)C1=C[N](C)C=N1)CC2""",21,"""1CD6DFF250AC970C"""
+"""D6B0E0DD05D4064F_DBFD955B1AED2F66_6036_UN""","""CNC2CCN(CCN1CCCC(C(C)C)[S]1(=O)=O)CC2""",21,"""1CD6DFF250AC970C"""
+"""598D9F3E8DB87F5E_FBE981D21A2D6F5A_6036_UN""","""CNC2CCN(CCN([S](C)(=O)=O)CC1CNCC1)CC2""",21,"""1CD6DFF250AC970C"""
+"""A141F9A8A9668DCA_C7953AC44DD8C0EC_6036_UN""","""CNC2CCN(CCN([S](C)(=O)=O)[C@@H]1CNCCC1)CC2""",21,"""1CD6DFF250AC970C"""
+"""4BAF331FB9596F8A_CEDD275D30DEB193_6036_UN""","""CNC2CCN(CCN(CCCCl)[S](=O)(=O)C1CC1)CC2""",21,"""1CD6DFF250AC970C"""
+"""F2C47DB85A657A52_6CE8FE854D091918_6036_UN""","""CNC3CCN(CCN1C(=O)C2=C([S]1(=O)=O)C=CS2)CC3""",21,"""1CD6DFF250AC970C"""
+"""EE9A9971E9C7883D_7DFC2DA65E7C2A2C_6036_UN""","""CNC1CCN(CCN(C(C(C)(C)N)=O)[S](=O)(=O)C)CC1""",21,"""1CD6DFF250AC970C"""
+"""98230102235667E7_884A138AA4E7C417_6036_UN""","""CNC2CCN(CCN(CCCN)[S](=O)(=O)C1CC1)CC2""",21,"""1CD6DFF250AC970C"""
+"""B3E8029E4D3555E4_B44E2793ECF0D279_6036_UN""","""CNC2CCN(CCN1CCCC(CC=C)[S]1(=O)=O)CC2""",21,"""1CD6DFF250AC970C"""
+"""38205CAE4C313D0A_5D381DB4FDDE1826_6036_UN""","""CNC1CCN(CCN(CCCN)[S](=O)(=O)C(F)F)CC1""",21,"""1CD6DFF250AC970C"""
+"""16610C27E554B24B_AE38B75967C1F7F2_6036_UN""","""CNC3CCN(CCN1[S](C2(CC1CI)CC2)(=O)=O)CC3""",21,"""1CD6DFF250AC970C"""
+"""94B2A84731EF963E_A756A7BA9ED4684D_6036_UN""","""CNC2CCN(CCN1CCCCNCC[S]1(=O)=O)CC2""",21,"""1CD6DFF250AC970C"""
+"""5E9A2FE573DEEC4D_D30E60199DFDB4E5_6036_UN""","""CNC3CCN(CCN1[S](=O)(=O)C2(C1)CCOCC2)CC3""",21,"""1CD6DFF250AC970C"""
+"""F5EAF057F34A4DBD_3CD5900D4B917B93_6036_UN""","""CNC3CCN(CCN1C(CN)CC2([S]1(=O)=O)CC2)CC3""",21,"""1CD6DFF250AC970C"""
+"""0B344DB9871E7FB5_9B2BBF4588366889_6036_UN""","""CNC3CCN(CCN([S](=O)(=O)C1CC1)C2CNC2)CC3""",21,"""1CD6DFF250AC970C"""
+"""A35DB7B6D632C9C6_A36C4E1450877A86_6036_UN""","""CNC3CCN(CCN1CC2(C[S]1(=O)=O)CCCC2)CC3""",21,"""1CD6DFF250AC970C"""
+"""0B7F5FB9DC96F890_09324C1E895A1720_6036_UN""","""CNC3CCN(CCN([S](=O)(=O)C1CNC1)C2CC2)CC3""",21,"""1CD6DFF250AC970C"""
+"""68F67B60585E2018_AD90CAC6D736FE5B_6036_UN""","""CNC1CCN(CCN([S](C)(=O)=O)CC[S](=O)(=O)Cl)CC1""",21,"""1CD6DFF250AC970C"""
+"""9B5AE728DB3DFF35_BDDC14BA8E3135BE_6036_UN""","""CNC1CCN(CCN(CCC)[S](=O)(=O)C(F)(F)F)CC1""",21,"""1CD6DFF250AC970C"""
+"""12FE13D08C185B88_EA3F6F0A40B4B8E1_2267_UN""","""CC(C)N(C)CC#CC1=CC=C(C(CCC(O)=O)=O)C=C1""",21,"""1DD5BF1CB90B39F8"""
+"""C9C94BAD39BC1F8A_74ECE65CAF43EFB2_2267_UN""","""CC(C)N(C)CC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O""",21,"""1DD5BF1CB90B39F8"""
+"""B7D2011BF3DCD97D_9012151F4D73F217_2267_UN""","""CC(C)N(C)CC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""1DD5BF1CB90B39F8"""
+"""BDD52E652274B510_F724E3F1FEED719C_2267_UN""","""CC(C)N(C)CC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""1DD5BF1CB90B39F8"""
+"""14B98AE9686CBD67_7CA5480378FFB88D_2267_UN""","""CC(C)N(C)CC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""1DD5BF1CB90B39F8"""
+"""266E40DFE0D0A1FF_8C2E5A84CEBB50D8_2267_UN""","""CC(C)N(C)CC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""1DD5BF1CB90B39F8"""
+"""136040CA8390C2EA_4C215B5944690C43_2267_UN""","""CC(C)N(C)CC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""1DD5BF1CB90B39F8"""
+"""9764B309D6E8428D_0B44C1213EF92B2F_2267_UN""","""CC(C)N(C)CC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""1DD5BF1CB90B39F8"""
+"""5B783EC3AE274E0B_046991F41053A8C3_2267_UN""","""CC(C)N(C)CC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""1DD5BF1CB90B39F8"""
+"""EB644A87DB907630_6295AF3FB146C5A5_2267_UN""","""CC(C)N(C)CC#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""1DD5BF1CB90B39F8"""
+"""F851F7CD5BCDFE7B_C8411F783F85DF0A_2267_UN""","""CC(C)N(C)CC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""1DD5BF1CB90B39F8"""
+"""74054E9B71476031_28C54C75776787D4_2267_UN""","""CC(C)N(C)CC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""1DD5BF1CB90B39F8"""
+"""864060FB92E05A75_4DEE83839CF401DD_2267_UN""","""CC(C)N(C)CC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""1DD5BF1CB90B39F8"""
+"""0D3525AE79CABA97_8FC4B73D7764CB8F_2267_UN""","""CC(C)N(C)CC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2""",21,"""1DD5BF1CB90B39F8"""
+"""CD4F46AC1EF4648A_310988D4D16FDC00_2267_UN""","""CC(C)N(C)CC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""1DD5BF1CB90B39F8"""
+"""5511F00A75F4B1C1_19E2999CCB2AB70D_2267_UN""","""CC(C)N(C)CC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""1DD5BF1CB90B39F8"""
+"""CBDFC4EFBBB985F8_DA9D6F75C9A26C33_2267_UN""","""CC(C)N(C)CC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""1DD5BF1CB90B39F8"""
+"""47AC17E33604E6E9_0F8D4DC958EAF260_2267_UN""","""CC(C)N(C)CC#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""1DD5BF1CB90B39F8"""
+"""FA9FE1CC030A400D_AC3304C4D673950C_2267_UN""","""CC(C)N(C)CC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""1DD5BF1CB90B39F8"""
+"""804E6D82E84E7D59_873CA9D0290DDF2F_2267_UN""","""CC(C)N(C)CC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""1DD5BF1CB90B39F8"""
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+"""D97A4C3F7C4D654C_A60B3A7DFE0C224C_6036_UN""","""CC3(C)OCC(N)(CN([S](=O)(=O)C1CC1)C2CNC2)CO3""",21,"""21F65ACA2696DDC9"""
+"""2AF76719A6F4E94A_9E4CCB2C26BD3043_6036_UN""","""CC3(C)OCC(N)(CN1CC2(C[S]1(=O)=O)CCCC2)CO3""",21,"""21F65ACA2696DDC9"""
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+"""2146579F8921DBA9_CCF2829649DACEBC_2267_UN""","""CC(C)OC(=O)C#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""2603DE7B0E3C86D8"""
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+"""A1D051ED0B317635_3FBFF093A76417E3_2267_UN""","""CC(C)OC(=O)C#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""2603DE7B0E3C86D8"""
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+"""841A59BA37FBDEB5_13132D12C05038F4_2267_UN""","""CC(C)OC(=O)C#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""2603DE7B0E3C86D8"""
+"""729DBDEC786B5EAC_7638E2E42BC3BEFD_2267_UN""","""CC(C)OC(=O)C#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""2603DE7B0E3C86D8"""
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+"""7B6D42C6E94631E2_E14B0E127E95D313_2267_UN""","""CC(C)OC(=O)C#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""2603DE7B0E3C86D8"""
+"""F461D6A89B67F099_345B2CAEEFDD4D40_2267_UN""","""CC(C)OC(=O)C#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""2603DE7B0E3C86D8"""
+"""9421AAF3C710B71D_97E565A361442A2C_2267_UN""","""CC(C)OC(=O)C#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""2603DE7B0E3C86D8"""
+"""E6BBB6A0033ACB42_BCEAC8B79E3A600F_2267_UN""","""CC(C)OC(=O)C#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""2603DE7B0E3C86D8"""
+"""54A3E0F1667E760D_5067B994EE0249D2_2267_UN""","""CC(C)OC(=O)C#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""2603DE7B0E3C86D8"""
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+"""3394B2A7AC40473B_0CB636CDF2EFF210_2267_UN""","""CC(C)OC(=O)C#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""2603DE7B0E3C86D8"""
+"""9FA09D2F852E9C8B_86DB07C2F5617944_2267_UN""","""CC(C)OC(=O)C#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""2603DE7B0E3C86D8"""
+"""D45BFE4AEBCA9C59_5A4DC71090AA830F_2267_UN""","""CC(C)OC(=O)C#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""2603DE7B0E3C86D8"""
+"""EDC41D0A2598FCE6_EC5F5316944DECA3_2267_UN""","""CC(C)OC(=O)C#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""2603DE7B0E3C86D8"""
+"""962B5818177AC7D3_E952CA6DFCBA8B36_2267_UN""","""CC(C)OC(=O)C#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""2603DE7B0E3C86D8"""
+"""193488E02F92FEFF_109702254E62251C_2267_UN""","""CC(C)OC(=O)C#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""2603DE7B0E3C86D8"""
+"""5666B4220E7532BE_344D06FF18CC2E94_2267_UN""","""CC(C)OC(=O)C#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""2603DE7B0E3C86D8"""
+"""37EC3AB54DD8ECA7_4325BBEDDF1944E3_2267_UN""","""CC(C)OC(=O)C#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""2603DE7B0E3C86D8"""
+"""81ED1B98E35B5998_956E5FCF17C69DD2_2267_UN""","""CC(C)OC(=O)C#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""2603DE7B0E3C86D8"""
+"""0E53EF1E00070BD9_B1F1A0272F384769_2267_UN""","""CC(C)OC(=O)C#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""2603DE7B0E3C86D8"""
+"""C56056B8C988AF21_3EE157BBEEB426E0_2267_UN""","""CC(C)OC(=O)C#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""2603DE7B0E3C86D8"""
+"""201C3E8B0F5D7CAD_77F47A0A611C39F3_2267_UN""","""CC(C)OC(=O)C#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""2603DE7B0E3C86D8"""
+"""FC82FF61CCBAE3BD_ABD040685E9B0779_2267_UN""","""CC(C)OC(=O)C#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""2603DE7B0E3C86D8"""
+"""AC397B821876590A_6462549E4903EAC8_2267_UN""","""CC(C)OC(=O)C#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""2603DE7B0E3C86D8"""
+"""C2790EBDF3FA9E9F_2048A33BDE2D3E1E_2267_UN""","""CC(C)OC(=O)C#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""2603DE7B0E3C86D8"""
+"""163F8BD20F5F2F1E_5BEE2D66365D1B4E_2267_UN""","""CC(C)OC(=O)C#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""2603DE7B0E3C86D8"""
+"""888C49FB7216CE67_694895FE4DB23314_2267_UN""","""CC(C)OC(=O)C#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""2603DE7B0E3C86D8"""
+"""7577EC827715C6DE_5C6B9D397BC7481B_2267_UN""","""CC(C)OC(=O)C#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""2603DE7B0E3C86D8"""
+"""3534431D8CCE9D0F_04D95763BB9BBD0E_2267_UN""","""CC(C)OC(=O)C#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""2603DE7B0E3C86D8"""
+"""B17F45A9343C53BA_5CBF200DA5C94497_2267_UN""","""CC(C)OC(=O)C#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""2603DE7B0E3C86D8"""
+"""BBFFA282A866A58F_CF9612D959EA08DB_7019_UN""","""C[N]3C=C(CC=CC1=CSC(=N1)C2=CC=C(Cl)C=C2)N=N3""",21,"""268BCBB0334EBBA2"""
+"""DF18842197ADACB5_F763A8A81CBE90EB_7019_UN""","""C[N]3C=C(CC=CC2=CC1=CC=CC(=C1N=C2Cl)C)N=N3""",21,"""268BCBB0334EBBA2"""
+"""EB4A6B77670D6FD8_907B5DB4A228EA08_7019_UN""","""C[N]3C=C(CC=CC2=CC1=C(C=C(C)C=C1)N=C2Cl)N=N3""",21,"""268BCBB0334EBBA2"""
+"""16E42FF877C7C47C_F3D451DD0994C69C_7019_UN""","""C[N]3C=C(CC=CC2=CC=C(C1=CC=C(Cl)C=C1)O2)N=N3""",21,"""268BCBB0334EBBA2"""
+"""50DBA559EA9E7185_EBDC9D19BDC52F10_7019_UN""","""C[N]3C=C(CC=CC2=CC(=C1OCCCOC1=C2)Cl)N=N3""",21,"""268BCBB0334EBBA2"""
+"""4448336D3CB6761A_3C5075D50E019475_7019_UN""","""C[N]3C=C(CC=CC1=C(Cl)N=C(S1)N2CCCCC2)N=N3""",21,"""268BCBB0334EBBA2"""
+"""6334CC53A63D1927_5A1DDF55275D4EC5_7019_UN""","""C[N]3C=C(CC=CC2=CC1=C(C=CC(=C1)C)N=C2Cl)N=N3""",21,"""268BCBB0334EBBA2"""
+"""D6A8A458B39BCC67_2F5ADC4243AFED51_7019_UN""","""C[N]3C=C(CC=CC2=CC=C(C1=CC=C(Cl)C=C1)S2)N=N3""",21,"""268BCBB0334EBBA2"""
+"""6CB45EC58B2FDF2D_F1CAC0E84426D59D_7019_UN""","""C[N]3C=C(CC=CC2=C[N](C1=CC=C(Cl)C=C1)N=C2)N=N3""",21,"""268BCBB0334EBBA2"""
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+"""BBD61827EDFD84A4_9F1430D7DA9B246F_7019_UN""","""CC(C)(CCC=CC2=CC1=C([N](N=C1C)C)N=C2Cl)C#N""",21,"""26B0B2AA0791F4BA"""
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+"""9515C76A3452704F_A1FB8E17853071B8_7019_UN""","""CC(C)(CCC=CC1=C([S](CC)(=O)=O)C(=CC=C1)Cl)C#N""",21,"""26B0B2AA0791F4BA"""
+"""7281B24E80D1DB66_36F555C2DAF02290_7019_UN""","""CC(C)(CCC=CC1=C(C=CC(=C1)Cl)OCC2CC2)C#N""",21,"""26B0B2AA0791F4BA"""
+"""FDF199B4CA9D9A63_A2CD0CA1D346E8A5_7019_UN""","""CC(C)(CCC=CC1=C[NH]N=C1C2=CC=C(Cl)C=C2)C#N""",21,"""26B0B2AA0791F4BA"""
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+"""6A56EF5ACC36FF8E_5FE2596F952D5908_6031_DP""","""O(C(=O)CC(N)C1=CC(=CC(=C1)Cl)Cl)CCC2CC(N)C2""",21,"""2797CA7642238192"""
+"""F996C5EB6BF0711D_39379A5958F6484B_6031_DP""","""O(C(=O)CC(N)C1=CC(=CC(=C1)Cl)Cl)C[C@@H]2COCCN2""",21,"""2797CA7642238192"""
+"""7E28117FB823246B_C6331E9AD9DFED53_6031_DP""","""O(C(=O)CC(N)C1=CC(=CC(=C1)Cl)Cl)CCCC(CC)N""",21,"""2797CA7642238192"""
+"""182752073631BC53_D0C635F56D3F3946_6031_DP""","""O(C(=O)CC(N)C1=CC(=CC(=C1)Cl)Cl)CC2(CN)COC2""",21,"""2797CA7642238192"""
+"""A678D10079DC7F14_FBD8B96823E58D86_6031_DP""","""O(C(=O)CC(N)C1=CC(=CC(=C1)Cl)Cl)CCCCCCN""",21,"""2797CA7642238192"""
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+"""6F22EFD246C90993_2729E19F73E014E3_6031_DP""","""O(C(=O)C1=CSC(=N1)C2CCNCC2)CC3(CNC3)C#N""",21,"""28275137F7193103"""
+"""162CD46008243851_324160077B8B90F5_6031_DP""","""O(C(=O)C1=CSC(=N1)C2CCNCC2)C[C@@H]3C[C@H](N)C=C3""",21,"""28275137F7193103"""
+"""49AF62950E609815_7B4BC0EDA757BE91_6031_DP""","""O(C(=O)C1=CSC(=N1)C2CCNCC2)C[C@H]3CCCNC3""",21,"""28275137F7193103"""
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+"""A00B40421BAD5529_C25D6CE0E801E6B4_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](CC)(=O)=O)CC(=O)OC""",21,"""298924289113783B"""
+"""520B724893C9D72F_E100D94457C20E29_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""298924289113783B"""
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+"""5D5503060FD0D4FC_99C2E1D449D1A610_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""298924289113783B"""
+"""C3EC052F30A59A5A_F8893277F9CAC5EA_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(C)[S](=O)(=O)C2CCCNC2""",21,"""298924289113783B"""
+"""BB55C398CE12027B_CE8B0E5DCBAB8958_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(C)[S](=O)(=O)CC2CCCN2""",21,"""298924289113783B"""
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+"""193D1A67A986F3D7_257078F4214D30EE_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C)(=O)=O)C2CCCNC2""",21,"""298924289113783B"""
+"""72C8BEA1F08E89A1_F0377F6DD2CB8DA4_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""298924289113783B"""
+"""323801291BEE2532_48714BC8441BF0DF_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(CC)[S](=O)(=O)C2CCNC2""",21,"""298924289113783B"""
+"""2FC363334A10AA11_8DD2C5F2F8DBDF26_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""298924289113783B"""
+"""C398EB2DA6ED6878_28895096BA3ED8D1_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""298924289113783B"""
+"""65CE4453C75CB3A7_261827DC8358AB5E_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""298924289113783B"""
+"""0D00C4FFB8510825_C8814AED34670D5E_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C)(=O)=O)CCNC2CC2""",21,"""298924289113783B"""
+"""DEDAD8CBFF49A32E_771D0F92FD738EF6_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""298924289113783B"""
+"""2DBF417479CCCA7D_C093FFE1BF0F68FF_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(C)[S](=O)(=O)C2CCNCC2""",21,"""298924289113783B"""
+"""99A2F33CA9F670E0_6E019CA165186750_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""298924289113783B"""
+"""44C7E21261AB8BEB_76254D4D57DDABE7_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""298924289113783B"""
+"""DBB519F4822D65C3_9669041B0A7F288B_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""298924289113783B"""
+"""FFB3C38ECB47DBC8_DA07B918367974AF_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C)(=O)=O)C2CCNCC2""",21,"""298924289113783B"""
+"""EC4CCD7308A184EB_A51C6C59A95DB9C1_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""298924289113783B"""
+"""1971D920C7268A93_75633F5BF3729127_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""298924289113783B"""
+"""213F814DD77A74DA_A752EC099BDE312F_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""298924289113783B"""
+"""92275F0DEA9F693F_1C03359293491E6B_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""298924289113783B"""
+"""DF78D945CABCA16E_EEA26E81DB52C051_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""298924289113783B"""
+"""DD3A4D7732E8D4B8_CEB67A08DB92806D_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C)(=O)=O)CC2CNCC2""",21,"""298924289113783B"""
+"""79B2BE886488F497_F2CAC11E8C672FDB_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""298924289113783B"""
+"""9D5A410622DD58E4_FB82DC87F1615EA4_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""298924289113783B"""
+"""ACBF9D64FD7BAF3E_59B7055F8CB6F62F_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""298924289113783B"""
+"""CDE4923200AEE085_48A3D67C9FC3C51B_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""298924289113783B"""
+"""D690B0CF834FADDF_BD15E85065582B20_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(CCCN)[S](=O)(=O)C2CC2""",21,"""298924289113783B"""
+"""12C808C43A1AF0B0_8111DC492D4F3D4E_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2CCCC(CC=C)[S]2(=O)=O""",21,"""298924289113783B"""
+"""A60252DDFB39AD82_6867E66E3C61F711_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(CCCN)[S](=O)(=O)C(F)F""",21,"""298924289113783B"""
+"""D1EF5F48DE6D1931_9B674C83A67E18C5_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""298924289113783B"""
+"""27C12DD949A3B269_92095C605F6B877A_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2CCCCNCC[S]2(=O)=O""",21,"""298924289113783B"""
+"""CC2C4BADBFB4C738_E6519BC35C425BD2_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""298924289113783B"""
+"""BF6022AF7EE19A1E_098A6BD78A2E94A4_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""298924289113783B"""
+"""0C83BFF9AA98D625_AE74449F498987BE_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""298924289113783B"""
+"""6F8BDDC61614FB82_9633B5CE913895B1_6036_UN""","""CC(C1=CC=C(C=C1)CN)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""298924289113783B"""
+"""39F0373C261B24A3_3C6DB7C448E5F817_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""298924289113783B"""
+"""1A22CF1E755B75BD_98CF311C1689116C_6036_UN""","""CC(C1=CC=C(C=C1)CN)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""298924289113783B"""
+"""F3550E5E8C368BDD_8883EF604F8EDA89_6036_UN""","""CC(C1=CC=C(C=C1)CN)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""298924289113783B"""
+"""21BFAA51488E1180_DB7AE2D761EB8D6A_2267_UN""","""C(#CCOC1COC1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""2C9032C198540C73"""
+"""EECB4D509517A271_45A96B818E1CDA39_2267_UN""","""C(#CCOC1COC1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""2C9032C198540C73"""
+"""AAA80F0400C03579_A15798C26C2CC79C_2267_UN""","""C(#CCOC1COC1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""2C9032C198540C73"""
+"""4402B3FEBA0BAB7D_C6616E2CDFB24417_2267_UN""","""C(#CCOC1COC1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""2C9032C198540C73"""
+"""03B2818AC4805613_4DE0C5DE59A08D06_2267_UN""","""C(#CCOC1COC1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""2C9032C198540C73"""
+"""58E1DE1DC597FA96_BD6BD759EFE46553_2267_UN""","""C(#CCOC1COC1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""2C9032C198540C73"""
+"""988165723B7B03F1_7D64D684653639C8_2267_UN""","""C(#CCOC1COC1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""2C9032C198540C73"""
+"""67AEE800FB850872_3A014CFC1FA61EA4_2267_UN""","""C(#CCOC1COC1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""2C9032C198540C73"""
+"""D1F6382EE3C4A7DB_352C1C29310C9D48_2267_UN""","""C(#CCOC1COC1)C2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""2C9032C198540C73"""
+"""56D70B1EF61D8C25_53D022E29019F02E_2267_UN""","""C(#CCOC1COC1)C2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""2C9032C198540C73"""
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+"""ECD1F62E401449EE_DF494729A9E101FE_6036_UN""","""NCCN1CCC(CC1)CN([S](C)(=O)=O)C2CCNCC2""",21,"""2CC7DA190E8B0D6A"""
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+"""0B098CCFFF5C05FA_F7843F2F13FF5A8A_6036_UN""","""NCCN1CCC(CC1)CN([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""2CC7DA190E8B0D6A"""
+"""53435A8A9E9C71FB_FECC22B66EF92BF5_6036_UN""","""NCCN1CCC(CC1)CN(CCCCl)[S](=O)(=O)C2CC2""",21,"""2CC7DA190E8B0D6A"""
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+"""7A038207BD6887CB_0CC495E615B6E1F5_6036_UN""","""NCCN1CCC(CC1)CN2C(CN)CC3([S]2(=O)=O)CC3""",21,"""2CC7DA190E8B0D6A"""
+"""CD52C4553B13CCA3_AB3ABAAED611F2EF_6036_UN""","""NCCN1CCC(CC1)CN([S](=O)(=O)C2CC2)C3CNC3""",21,"""2CC7DA190E8B0D6A"""
+"""489DA7ADDDDB3338_937D4BFF0EA0E0E0_6036_UN""","""NCCN1CCC(CC1)CN2CC3(C[S]2(=O)=O)CCCC3""",21,"""2CC7DA190E8B0D6A"""
+"""F8A2201308018FF4_392349F5D77D8D46_6036_UN""","""NCCN1CCC(CC1)CN([S](=O)(=O)C2CNC2)C3CC3""",21,"""2CC7DA190E8B0D6A"""
+"""275CAF7614EFC761_9D81CF2D8911643D_6036_UN""","""NCCN1CCC(CC1)CN([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""2CC7DA190E8B0D6A"""
+"""9C68FFDF5B5A0ED8_8DCD1151D016AFD8_6036_UN""","""NCCN1CCC(CC1)CN(CCC)[S](=O)(=O)C(F)(F)F""",21,"""2CC7DA190E8B0D6A"""
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+"""A5562F9F31E7F574_E1B7A0BBAACBBBA6_7019_UN""","""C(CC1CCNC1=O)=CC3=CC(=C2OCCCOC2=C3)Cl""",21,"""2CE0F61224402F14"""
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+"""C5F68E410680F1C0_3CA5117AF921F93E_7019_UN""","""C(CC1CCNC1=O)=CC2=C(C=CC(=C2)Cl)OCC3CC3""",21,"""2CE0F61224402F14"""
+"""BB55CEA00C8AADEB_A89D4819F097330B_7019_UN""","""C(CC1CCNC1=O)=CC2=C[NH]N=C2C3=CC=C(Cl)C=C3""",21,"""2CE0F61224402F14"""
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+"""FEF0DFA0F90D851D_DB3883FD78A3275E_7019_UN""","""C(CC1CCNC1=O)=CC3=CN=C(C2=CC=CC(=C2)Cl)S3""",21,"""2CE0F61224402F14"""
+"""8D5827E5C3BF2FDB_337361054F7A5EFC_7019_UN""","""C(CC1CCNC1=O)=CC2=CC(=C(OC(C)C)C=C2Cl)Cl""",21,"""2CE0F61224402F14"""
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+"""B3E8CE678AF867D5_368AA16CB0A412FB_2267_UN""","""CC(C)(C#CC1=CC(=CC=C1)CC2=CC=CC=C2)C3CC3""",21,"""2E6828AC502CB2C3"""
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+"""C9A3B0F5DAB2B8D0_A3BBB6BF008B3362_2267_UN""","""CC(C)(C#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O)C2CC2""",21,"""2E6828AC502CB2C3"""
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+"""D83782C58C67B299_282355EC803D0A05_2267_UN""","""CC(C)(C#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O)C3CC3""",21,"""2E6828AC502CB2C3"""
+"""7FB99D198A53C1AA_5385DBB1684D2F55_2267_UN""","""CC(C)(C#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2)C3CC3""",21,"""2E6828AC502CB2C3"""
+"""EE43FA46EA3C7778_6123632913A2070F_2267_UN""","""CC(C)(C#CC1=CC=C(CCCCC(O)=O)C=C1)C2CC2""",21,"""2E6828AC502CB2C3"""
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+"""BCA206FA3F81518B_54D4D6DAFBD9708C_2267_UN""","""CC(C)(C#CC2=NC1=C(OC)C=CC(=C1S2)OC)C3CC3""",21,"""2E6828AC502CB2C3"""
+"""C0E2CD49240ADDE8_9CFC72775CFE82DE_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC(C(OC)=O)N""",21,"""2EB43A60BECE50D7"""
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+"""6D7E7E7C0B643552_93ADF827049BDFDD_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC3NCCNC3""",21,"""2EB43A60BECE50D7"""
+"""C518460175DCDE1B_77F14A9ABCCFA6C3_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC(CC=CC)N""",21,"""2EB43A60BECE50D7"""
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+"""019BBCE18E1C5BF2_76F44F1082A9B899_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OC[C@@H]3CCCNC3""",21,"""2EB43A60BECE50D7"""
+"""8EB0E08A75F59D52_1C7374C593A0C827_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OC[C@@H]3CCCCN3""",21,"""2EB43A60BECE50D7"""
+"""114AA25CE69390CB_5F9239C5B8CC52C4_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC3OCCNC3""",21,"""2EB43A60BECE50D7"""
+"""0CFF517B8368B9E9_9EF7468A212FEA11_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCCC3(CNC3)N""",21,"""2EB43A60BECE50D7"""
+"""5210942269B4AD90_DCF185B890EED8E8_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC(N)CC(F)F""",21,"""2EB43A60BECE50D7"""
+"""6F0C94D6182A14AB_BEBAE60910A32381_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OC[C@@H](C(OC)=O)N""",21,"""2EB43A60BECE50D7"""
+"""A9A1E8F0DCA04427_58D50D5822E8CB52_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC3COCCN3""",21,"""2EB43A60BECE50D7"""
+"""B6E3C87896663FF9_E24B150D612461BE_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC(CCN)(C)C""",21,"""2EB43A60BECE50D7"""
+"""D4CD004AB695A660_6948A2A10535923C_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC3(CCNC3)C""",21,"""2EB43A60BECE50D7"""
+"""66373CC3D31F065C_D9B14813C4BA1890_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC34CC(N)(C3)C4""",21,"""2EB43A60BECE50D7"""
+"""16A3C0F300582E19_94EF80F7B4A46AEF_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCCCNC3CC3""",21,"""2EB43A60BECE50D7"""
+"""6574DD2D0326D303_B65974BFEA5FD672_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC(=C3CNC3)F""",21,"""2EB43A60BECE50D7"""
+"""CD0209FB32042AF6_E589946335BB72FD_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC[C@H]3CCCN3""",21,"""2EB43A60BECE50D7"""
+"""D5107497BE4AF02A_E6D4F2A206F27BD7_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OC[C@H]3CC[C@@H](N)C3""",21,"""2EB43A60BECE50D7"""
+"""D83C3863FB0A64BB_BB22709D2828C84B_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OC[C@H]3COC[C@H]3N""",21,"""2EB43A60BECE50D7"""
+"""890BD78906A794F9_F805942F1FFB9FF8_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OC[C@H]3CCC[C@H]3N""",21,"""2EB43A60BECE50D7"""
+"""8F79CB00FB348941_DC2FE70312EC30A0_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC3C(CN3)(C)C""",21,"""2EB43A60BECE50D7"""
+"""F705DD51CC227F2A_A0624B7F46E31D15_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCCCNC(C)C""",21,"""2EB43A60BECE50D7"""
+"""30B7FC41DD77C50C_08B955935E024AF5_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCCC3(CN)CC3""",21,"""2EB43A60BECE50D7"""
+"""73B350A7545E9FFE_1B0D7020F011149F_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC(C(C)C)ON""",21,"""2EB43A60BECE50D7"""
+"""4A5F4E59723EDB2B_33918A20980B59D9_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC(C(C)C)CN""",21,"""2EB43A60BECE50D7"""
+"""CC796339AEB761EB_03A39B996B668FF4_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC3=CNCCO3""",21,"""2EB43A60BECE50D7"""
+"""F58CFB0DA30D0210_3BFC7402B3BB0B4C_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC3=CNCCC3""",21,"""2EB43A60BECE50D7"""
+"""CB42E596086A6BA0_56C1A97969C0884D_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCCC3CC(N)C3""",21,"""2EB43A60BECE50D7"""
+"""1840BB4D131FC138_30146A4FA41B990E_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OC[C@@H]3COCCN3""",21,"""2EB43A60BECE50D7"""
+"""D85AFECC9BCBE4F9_CF10EE8C25323C16_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCCCC(CC)N""",21,"""2EB43A60BECE50D7"""
+"""DF0FB22E4787AD05_D9E5C5E391D2E803_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC3(CN)COC3""",21,"""2EB43A60BECE50D7"""
+"""BCFE9A96BA9021F7_F2FB497EDF085CC3_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCCCCCCN""",21,"""2EB43A60BECE50D7"""
+"""9D9B92307E502293_F96E14D3653F4A15_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC3[C@@H]4CNC[C@H]34""",21,"""2EB43A60BECE50D7"""
+"""FAC83CCC80E28FB0_21BA8AC83A377537_6031_DP""","""CC1=C(N=N[N]1C2CCNC2)C(=O)OCC3(CNC3)C#N""",21,"""2EB43A60BECE50D7"""
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+"""AC24B321F4AAA20B_D9270FF3DCCCE270_2267_UN""","""COCC(N)CC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""33D6531E9B2AAA14"""
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+"""385E3577B8F58FDF_A93F45D20B2C4CC3_2267_UN""","""COCC(N)CC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""33D6531E9B2AAA14"""
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+"""8846C90D2440A755_4F984A7505BCAFC3_2267_UN""","""COCC(N)CC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""33D6531E9B2AAA14"""
+"""DB353972F011D3C4_F98ADE73015BC06F_2267_UN""","""COCC(N)CC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""33D6531E9B2AAA14"""
+"""0B324447C5B384D0_FC87470869ACA7FA_2267_UN""","""COCC(N)CC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""33D6531E9B2AAA14"""
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+"""43C858D1274A3BD9_21988B9A8DDA0258_2267_UN""","""COCC(N)CC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""33D6531E9B2AAA14"""
+"""0EC01E17D71857A5_56F036884A0F682F_2267_UN""","""COCC(N)CC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""33D6531E9B2AAA14"""
+"""09B8983B3D9C2A53_80BBD2AA82D0B11E_2267_UN""","""COCC(N)CC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""33D6531E9B2AAA14"""
+"""27547B2FF8713E41_A4242D42BA2E6BA5_2267_UN""","""COCC(N)CC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""33D6531E9B2AAA14"""
+"""C1494C86502778FB_2B34DADE7BA20A2C_2267_UN""","""COCC(N)CC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""33D6531E9B2AAA14"""
+"""95730E70F00CC69D_6221F76FF40A153F_2267_UN""","""COCC(N)CC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""33D6531E9B2AAA14"""
+"""0414C2DFE2E3EABB_BE05CD0DCB8D2BB5_2267_UN""","""COCC(N)CC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""33D6531E9B2AAA14"""
+"""945F427AF8D637B9_71B7D9FBDC15C604_2267_UN""","""COCC(N)CC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""33D6531E9B2AAA14"""
+"""9D6624C3CAC1C1DA_359D2E5E4B3B12D2_2267_UN""","""COCC(N)CC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""33D6531E9B2AAA14"""
+"""96BCF6263C7A7E5E_4E3BA003A34B3782_2267_UN""","""COCC(N)CC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""33D6531E9B2AAA14"""
+"""5548974D995AF664_7C9D189BD8A41FD8_2267_UN""","""COCC(N)CC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""33D6531E9B2AAA14"""
+"""418F15731C4AFD53_49BE105CEED164D7_2267_UN""","""COCC(N)CC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""33D6531E9B2AAA14"""
+"""158DCDBAB8A067D2_110CDA062E8D91C2_2267_UN""","""COCC(N)CC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""33D6531E9B2AAA14"""
+"""F6B1F3EA14D51F3C_496AAD6830DF685B_2267_UN""","""COCC(N)CC#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""33D6531E9B2AAA14"""
+"""E2D36411E6B6A3CA_84964B5CDBE7443E_6031_DP""","""CNC(C(=O)OCC(C(OC)=O)N)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
+"""C722FB2A07EF05D5_FA8E44ABEDC26624_6031_DP""","""CNC(C(=O)OCC1CCNCC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""315828326F0E83A8_161D3E83EC891C2A_6031_DP""","""CNC(C(=O)OCC1CCCNC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""395BDC31D7279229_8BC7C10C8382193D_6031_DP""","""CNC(C(=O)OCC1NCCNC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""F62ED489AF2E5E2E_6F9B73B13BD66023_6031_DP""","""CNC(C(=O)OCC(CC=CC)N)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
+"""17AAF16C710F4DA8_2DF1517283863FB9_6031_DP""","""CNC(C(=O)OCC(CC(C)C)N)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
+"""B9FA767E86CF6837_ED27F82667C38AC8_6031_DP""","""CNC(C(=O)OCC1(N)CCCC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""CB3983AA0550092A_6E9E763B05B07E79_6031_DP""","""CNC(C(=O)OC[C@@H]1CCCNC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""7F38A2694B566373_04194DEE14B90EC7_6031_DP""","""CNC(C(=O)OC[C@@H]1CCCCN1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""AAF1BCA0CE7622DA_47F800EE3FD59424_6031_DP""","""CNC(C(=O)OCC1OCCNC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""027A12BAF5263194_869D7FA1A6362CF1_6031_DP""","""CNC(C(=O)OCCC1(CNC1)N)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""0D9212011B04B6A8_C49BBC9317F71E08_6031_DP""","""CNC(C(=O)OCC(N)CC(F)F)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
+"""FE0FC13658B25AB2_A6D0DF2297BAE561_6031_DP""","""CNC(C(=O)OC[C@@H](C(OC)=O)N)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
+"""F162CEC66225FC7E_40BF3473A5F10DB2_6031_DP""","""CNC(C(=O)OCC1COCCN1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""5B43F4D1F953F9F6_FA212C26E63DA75E_6031_DP""","""CNC(C(=O)OCC(CCN)(C)C)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
+"""8FEA8A5EC0809704_71229B8A822C54DC_6031_DP""","""CNC(C(=O)OCC1(CCNC1)C)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""A9B1090B82D045D7_C1DB713843A3DE70_6031_DP""","""CNC(C(=O)OCC12CC(N)(C1)C2)C3=C(C(=CC=C3)Cl)Cl""",21,"""36DE034B39D79637"""
+"""1C382D28ADFC7FB6_8C85B9DC33BDAC0F_6031_DP""","""CNC(C(=O)OCCCNC1CC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""F1F72C4FD709B28B_AE334D946D461092_6031_DP""","""CNC(C(=O)OCC(=C1CNC1)F)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""39240D588F72A540_FDE3AD48B2A2B41D_6031_DP""","""CNC(C(=O)OCC[C@H]1CCCN1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""A7966A8468E14517_FEBECB8981EBBD37_6031_DP""","""CNC(C(=O)OC[C@H]1CC[C@@H](N)C1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""CD8E055F686E0DD3_A34849B6AF310EAB_6031_DP""","""CNC(C(=O)OC[C@H]1COC[C@H]1N)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""6F5A8A3EC564CCF9_E06FAD0498E25918_6031_DP""","""CNC(C(=O)OC[C@H]1CCC[C@H]1N)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""052093C3C77EB6B3_C445DE2895F5F640_6031_DP""","""CNC(C(=O)OCC1C(CN1)(C)C)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""E2D98A6AAE0757FC_B8087254C1FADBF5_6031_DP""","""CNC(C(=O)OCCCNC(C)C)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
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+"""C5D68923B1B96060_0367490B7708D27F_6031_DP""","""CNC(C(=O)OCC(C(C)C)ON)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
+"""20FEBE82798AA9D5_2BFBB30B1F129F39_6031_DP""","""CNC(C(=O)OCC(C(C)C)CN)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
+"""64E4C27B23DEC463_1BC9A2B2EC7F4914_6031_DP""","""CNC(C(=O)OCC1=CNCCO1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""0B0F2926972CE37D_23964D2934A2CDAC_6031_DP""","""CNC(C(=O)OCC1=CNCCC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""99965F245B09127C_4EAB9052EED94EAD_6031_DP""","""CNC(C(=O)OCCC1CC(N)C1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""3F1CFCFE8A8B601A_287E536423025FEE_6031_DP""","""CNC(C(=O)OC[C@@H]1COCCN1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""8B105231F0C76088_D77AD7A7A22BFAF6_6031_DP""","""CNC(C(=O)OCCCC(CC)N)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
+"""C4DAF61ADFBDC021_C18FFCC816CB2EE3_6031_DP""","""CNC(C(=O)OCC1(CN)COC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""7101C5A5C0C23C65_EA91705558119A23_6031_DP""","""CNC(C(=O)OCCCCCCN)C1=C(C(=CC=C1)Cl)Cl""",21,"""36DE034B39D79637"""
+"""F4A7BF9DE6DC61F9_E1042DF8E2268CF5_6031_DP""","""CNC(C(=O)OCC1[C@@H]2CNC[C@H]12)C3=C(C(=CC=C3)Cl)Cl""",21,"""36DE034B39D79637"""
+"""B51DBDAC875B4DC1_39D0B3E3BD2EB3D7_6031_DP""","""CNC(C(=O)OCC1(CNC1)C#N)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""C4256C036BCE5998_2CB8327BB54537C1_6031_DP""","""CNC(C(=O)OC[C@@H]1C[C@H](N)C=C1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""30D368798A8DEA8B_65B29291699919A5_6031_DP""","""CNC(C(=O)OC[C@H]1CCCNC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""D37C4C7F06950D4A_CCCE16EBAB60B61F_6031_DP""","""CNC(C(=O)OCC1CC(NC)C1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""5A65CBAAD5CF31C9_9C71E651070FEDD2_6031_DP""","""CNC(C(=O)OCCC1CCNC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""E32A71A216660859_772AABC9F3625580_6031_DP""","""CNC(C(=O)OC[C@@H]1OCCNC1)C2=C(C(=CC=C2)Cl)Cl""",21,"""36DE034B39D79637"""
+"""F8F5DDC5361FF2E1_DC553204D627415C_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](CC)(=O)=O)CC(=O)OC""",21,"""37817ACCAF35DFD3"""
+"""E5DEEBA73E0DE7BC_FF0887A069E4A9C1_6036_UN""","""NC1=C(C=CN=C1)NCCN([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""37817ACCAF35DFD3"""
+"""D3ECB610805841D4_D57FA8D9BB6FB467_6036_UN""","""NC1=C(C=CN=C1)NCCN(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""37817ACCAF35DFD3"""
+"""C449338ED4E43D88_87CABF3077F701F8_6036_UN""","""NC1=C(C=CN=C1)NCCN2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""37817ACCAF35DFD3"""
+"""0C395E63C31F25A5_E6816C93C7EC6202_6036_UN""","""NC1=C(C=CN=C1)NCCN(C)[S](=O)(=O)C2CCCNC2""",21,"""37817ACCAF35DFD3"""
+"""CA22F0D867D7C43D_D08350B9F58D2EB0_6036_UN""","""NC1=C(C=CN=C1)NCCN(C)[S](=O)(=O)CC2CCCN2""",21,"""37817ACCAF35DFD3"""
+"""4E409477FA782B41_F45C13045E365EA6_6036_UN""","""NC1=C(C=CN=C1)NCCN(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""37817ACCAF35DFD3"""
+"""61A7DEE4E3D21665_3B7826101F6B9706_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C)(=O)=O)C2CCCNC2""",21,"""37817ACCAF35DFD3"""
+"""FFF6FC6C3554CA8D_EE3F2189ECED2A4C_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""37817ACCAF35DFD3"""
+"""002232DEAC66023E_5679152C7A3D5737_6036_UN""","""NC1=C(C=CN=C1)NCCN(CC)[S](=O)(=O)C2CCNC2""",21,"""37817ACCAF35DFD3"""
+"""F938C7CC5D53A39D_93DA9B16C6FD78CE_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C(C)(C)C)(=O)=O)CC=C""",21,"""37817ACCAF35DFD3"""
+"""F5955502F3C1304A_36810E7284187F39_6036_UN""","""NC1=C(C=CN=C1)NCCN(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""37817ACCAF35DFD3"""
+"""B2244BE378909920_38107938BD7E0CB6_6036_UN""","""NC1=C(C=CN=C1)NCCN(C(C)(C)C)[S](=O)(=O)CCN""",21,"""37817ACCAF35DFD3"""
+"""970386F8B512CCD5_D68914090A41AAB6_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C)(=O)=O)CCNC2CC2""",21,"""37817ACCAF35DFD3"""
+"""ABD07C724A5430AA_69155176C355291E_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""37817ACCAF35DFD3"""
+"""41FE5F5ADF2E52E4_DE9BA1058129CF17_6036_UN""","""NC1=C(C=CN=C1)NCCN(C)[S](=O)(=O)C2CCNCC2""",21,"""37817ACCAF35DFD3"""
+"""93D2D587C634E377_7009C2455B3EC0B8_6036_UN""","""NC1=C(C=CN=C1)NCCN2[S](CCC2C(OC)=O)(=O)=O""",21,"""37817ACCAF35DFD3"""
+"""4C58DCC29F84A37B_682D13A969FB0C0F_6036_UN""","""NC1=C(C=CN=C1)NCCN2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""37817ACCAF35DFD3"""
+"""415E1446FA5A704E_88615AFF34598F63_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C)(=O)=O)CC2=CC=NO2""",21,"""37817ACCAF35DFD3"""
+"""A491CF8798410A72_C40FE7FC085FD347_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C)(=O)=O)C2CCNCC2""",21,"""37817ACCAF35DFD3"""
+"""652F9EF619899A0D_BB1432BD977B1E29_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C)(=O)=O)C2=NC=CC=C2""",21,"""37817ACCAF35DFD3"""
+"""7C06987FD9966F35_6B6B61BFCD5436CF_6036_UN""","""NC1=C(C=CN=C1)NCCN(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""37817ACCAF35DFD3"""
+"""7CD5ED9AE0DB1140_B95AB2EDA5F896C7_6036_UN""","""NC1=C(C=CN=C1)NCCN(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""37817ACCAF35DFD3"""
+"""AFAAAB3F180E1A3C_020B6B76AD6FB983_6036_UN""","""NC1=C(C=CN=C1)NCCN(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""37817ACCAF35DFD3"""
+"""78DC5EBF732587A9_F0AA3065E57467B9_6036_UN""","""NC1=C(C=CN=C1)NCCN2CCCC(C(C)C)[S]2(=O)=O""",21,"""37817ACCAF35DFD3"""
+"""E7A6E7B7BEE0DE62_D0BE24ECE5B42785_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C)(=O)=O)CC2CNCC2""",21,"""37817ACCAF35DFD3"""
+"""EB6A0D92B1934577_ECC29FFAB2418833_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""37817ACCAF35DFD3"""
+"""BA385CCA35082A67_E58A8263CF47F94C_6036_UN""","""NC1=C(C=CN=C1)NCCN(CCCCl)[S](=O)(=O)C2CC2""",21,"""37817ACCAF35DFD3"""
+"""B60F8942C2A02C9B_47BF5BBBB29051C7_6036_UN""","""NC1=C(C=CN=C1)NCCN2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""37817ACCAF35DFD3"""
+"""C9170D961287B314_56AB8898A1E562F3_6036_UN""","""NC1=C(C=CN=C1)NCCN(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""37817ACCAF35DFD3"""
+"""BE40FE6F5C64405E_A31DB6B45B7E8CC8_6036_UN""","""NC1=C(C=CN=C1)NCCN(CCCN)[S](=O)(=O)C2CC2""",21,"""37817ACCAF35DFD3"""
+"""53D8BA8E33118C6F_9F1982AD13699AA6_6036_UN""","""NC1=C(C=CN=C1)NCCN2CCCC(CC=C)[S]2(=O)=O""",21,"""37817ACCAF35DFD3"""
+"""4C653EBC4D5A9DC3_766FB88A024750F9_6036_UN""","""NC1=C(C=CN=C1)NCCN(CCCN)[S](=O)(=O)C(F)F""",21,"""37817ACCAF35DFD3"""
+"""B41C1111698727CB_856F12679858BF2D_6036_UN""","""NC1=C(C=CN=C1)NCCN2[S](C3(CC2CI)CC3)(=O)=O""",21,"""37817ACCAF35DFD3"""
+"""9B86A2DA6975E44D_8C010284614D2092_6036_UN""","""NC1=C(C=CN=C1)NCCN2CCCCNCC[S]2(=O)=O""",21,"""37817ACCAF35DFD3"""
+"""8469D604C1A38E2F_F859C5276264FC3A_6036_UN""","""NC1=C(C=CN=C1)NCCN2[S](=O)(=O)C3(C2)CCOCC3""",21,"""37817ACCAF35DFD3"""
+"""B30E845FCCE1DB38_17823533B408334C_6036_UN""","""NC1=C(C=CN=C1)NCCN2C(CN)CC3([S]2(=O)=O)CC3""",21,"""37817ACCAF35DFD3"""
+"""C4415A0A824E49D6_B07C1A7B77AF2056_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](=O)(=O)C2CC2)C3CNC3""",21,"""37817ACCAF35DFD3"""
+"""8E1E1BC733395D5C_883BEB2AAF1E3259_6036_UN""","""NC1=C(C=CN=C1)NCCN2CC3(C[S]2(=O)=O)CCCC3""",21,"""37817ACCAF35DFD3"""
+"""D5A9DD41C33D73F3_2265E92076C35FFF_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](=O)(=O)C2CNC2)C3CC3""",21,"""37817ACCAF35DFD3"""
+"""3F447332C28AF524_86C76FF828AFB684_6036_UN""","""NC1=C(C=CN=C1)NCCN([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""37817ACCAF35DFD3"""
+"""FD921DD02CCE4621_968BB18471A87D61_6036_UN""","""NC1=C(C=CN=C1)NCCN(CCC)[S](=O)(=O)C(F)(F)F""",21,"""37817ACCAF35DFD3"""
+"""4F9746E6F0372CF6_85EBFA3FB2D32703_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)OCCNC2)CC(C(OC)=O)N""",21,"""37A3B22850E3F50A"""
+"""061C61288F827B23_FBF3F5C884F60519_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)OCCNC2)CC3CCNCC3""",21,"""37A3B22850E3F50A"""
+"""024A4B722705BCE8_17608FE085BD7F17_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)OCCNC2)CC3CCCNC3""",21,"""37A3B22850E3F50A"""
+"""40416552BA2A6208_8ABA706FEAB67A00_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)OCCNC2)CC3NCCNC3""",21,"""37A3B22850E3F50A"""
+"""6BA10CFC6B1FB7AC_6EE6C2D252E2031E_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)OCCNC2)CC(CC=CC)N""",21,"""37A3B22850E3F50A"""
+"""5BD97C4A8AC7EE84_2C8CE011EAB25C84_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)OCCNC2)CC(CC(C)C)N""",21,"""37A3B22850E3F50A"""
+"""1B4B4D2FB3EC6244_EC5A49450EF7E9F5_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)OCCNC2)CC3(N)CCCC3""",21,"""37A3B22850E3F50A"""
+"""AFB29749B11BD24E_6FE3C7586C841D44_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)OCCNC2)C[C@@H]3CCCNC3""",21,"""37A3B22850E3F50A"""
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+"""E89107C46E22689B_0D4408E019309A72_6036_UN""","""NCCCN1CCC(CC1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""38CE195A1B6AFC22"""
+"""C7C580B8DDA1B5C9_FFE553F3512B4448_6036_UN""","""NCCCN1CCC(CC1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""38CE195A1B6AFC22"""
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+"""6444E5CA91C2820D_E38DFC6C061EABC2_6036_UN""","""NCCCN1CCC(CC1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""38CE195A1B6AFC22"""
+"""D45D94EEF8FE1297_EAC5E1F57B18DABD_6036_UN""","""NCCCN1CCC(CC1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""38CE195A1B6AFC22"""
+"""0825841056DFBE51_48F0382D06CF7236_6036_UN""","""NCCCN1CCC(CC1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""38CE195A1B6AFC22"""
+"""AF0CC0DE19F89A89_59E4EB0E15BA4102_6036_UN""","""NCCCN1CCC(CC1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""38CE195A1B6AFC22"""
+"""9E2E5CEAB702A6EE_AC52D522EF21AF39_6036_UN""","""NCCCN1CCC(CC1)N(CCCN)[S](=O)(=O)C2CC2""",21,"""38CE195A1B6AFC22"""
+"""A7C4B1D37E7D8BF7_9056E13BA736B957_6036_UN""","""NCCCN1CCC(CC1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""38CE195A1B6AFC22"""
+"""8A20DBE282BCA1B4_7920DB1CB6187308_6036_UN""","""NCCCN1CCC(CC1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""38CE195A1B6AFC22"""
+"""EE52E17E20F38C9B_8A2071F12C079CDC_6036_UN""","""NCCCN1CCC(CC1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""38CE195A1B6AFC22"""
+"""D600A48EF7DD97D2_834E6112D5120363_6036_UN""","""NCCCN1CCC(CC1)N2CCCCNCC[S]2(=O)=O""",21,"""38CE195A1B6AFC22"""
+"""4DCC55EBFC449B94_F716A6B1D63BDFCB_6036_UN""","""NCCCN1CCC(CC1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""38CE195A1B6AFC22"""
+"""80FFEE7990BF2EE6_18CD56A5005710BD_6036_UN""","""NCCCN1CCC(CC1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""38CE195A1B6AFC22"""
+"""70E1CDB226387DEA_BF3379EDC3F003A7_6036_UN""","""NCCCN1CCC(CC1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""38CE195A1B6AFC22"""
+"""413F2CA1E9AD1470_877488BC1B4111A8_6036_UN""","""NCCCN1CCC(CC1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""38CE195A1B6AFC22"""
+"""9A2106EF660434EE_2D2A8AB6C29C7C0E_6036_UN""","""NCCCN1CCC(CC1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""38CE195A1B6AFC22"""
+"""FFDBA8BD89E8D7A7_89880C6E9CF09575_6036_UN""","""NCCCN1CCC(CC1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""38CE195A1B6AFC22"""
+"""DC496E4E30457E78_99C4D212C5F75E90_6036_UN""","""NCCCN1CCC(CC1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""38CE195A1B6AFC22"""
+"""99F4EF27AFF11DD3_D0424C7475129C7A_7019_UN""","""CC1=C(C=CC=N1)C=CC2=CSC(=N2)C3=CC=C(Cl)C=C3""",21,"""395F951D1FB62F03"""
+"""C0B363516C6608D0_E8B7F6053046044A_7019_UN""","""CC1=C(C=CC=N1)C=CC3=CC2=CC=CC(=C2N=C3Cl)C""",21,"""395F951D1FB62F03"""
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+"""C36629DAAF627DA7_EC000F70256C523D_7019_UN""","""CC1=C(C=CC=N1)C=CC3=CC=C(C2=CC=C(Cl)C=C2)O3""",21,"""395F951D1FB62F03"""
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+"""7D93D729A2847FC8_23842B7822F900D4_7019_UN""","""CC1=C(C=CC=N1)C=CC2=C(Cl)N=C(S2)N3CCCCC3""",21,"""395F951D1FB62F03"""
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+"""632385C180ADD253_0727D06655B0E474_7019_UN""","""CC1=C(C=CC=N1)C=CC3=CC=C(C2=CC=CC(=C2)Cl)S3""",21,"""395F951D1FB62F03"""
+"""2ADF1619A0BEFD30_0D4126E96503DFB3_7019_UN""","""CC1=C(C=CC=N1)C=CC2=C(OC(F)F)C(=CC(=C2)Cl)Cl""",21,"""395F951D1FB62F03"""
+"""A617EF90033F60D0_13D8068C00EE4465_7019_UN""","""CC1=C(C=CC=N1)C=CC2=CC(=C(OCC)C(=C2)Cl)OC""",21,"""395F951D1FB62F03"""
+"""07ABAECECAFD1A59_80FB1760C2BCFFD6_7019_UN""","""CC1=C(C=CC=N1)C=CC3=CC2=C([N](N=C2C)C)N=C3Cl""",21,"""395F951D1FB62F03"""
+"""DF70881D683FD43C_66486E10308A5BB8_7019_UN""","""CC1=C(C=CC=N1)C=CC2=C[NH]N=C2C3=CC=CC(=C3)Cl""",21,"""395F951D1FB62F03"""
+"""2ECB362F07C59FFC_A9764F8BB6DFB5BE_7019_UN""","""CC1=C(C=CC=N1)C=CC2=C(Cl)C=CC=C2N3CCCC3""",21,"""395F951D1FB62F03"""
+"""CF63DD9C837A9D3F_BB54C271910B814F_7019_UN""","""CC1=C(C=CC=N1)C=CC3=CC(=C2C=CC=CC2=C3O)Cl""",21,"""395F951D1FB62F03"""
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+"""AFE7D926BCAA07CE_BD222B16CB61331C_7019_UN""","""CC1=C(C=CC=N1)C=CC2=C[NH]N=C2C3=CC=C(Cl)C=C3""",21,"""395F951D1FB62F03"""
+"""E5533EEECF1D8506_5F7AD189A6571B15_7019_UN""","""CC1=C(C=CC=N1)C=CC2=CC(=C(C(=C2)Cl)OC)OCC""",21,"""395F951D1FB62F03"""
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+"""B1F850F01926744D_CE87E0F243552749_7019_UN""","""CC1=C(C=CC=N1)C=CC3=CN=C(C2=CC=CC(=C2)Cl)S3""",21,"""395F951D1FB62F03"""
+"""A60BC6BC0CD0E0FF_26CC020A748C5EEB_7019_UN""","""CC1=C(C=CC=N1)C=CC2=CC(=C(OC(C)C)C=C2Cl)Cl""",21,"""395F951D1FB62F03"""
+"""EF0BAD746CE3D92C_CE7D73B54853FF3D_7019_DP""","""CC1=C(C=CC=N1)C=CC3=C(N=C(N2CCNCC2)S3)Cl""",21,"""395F951D1FB62F03"""
+"""2661986D6299B9CF_E36C1AC69C7A787E_7019_UN""","""CC1=C(C=CC=N1)C=CC3=CC2=C(C=CC(=C2)F)N=C3Cl""",21,"""395F951D1FB62F03"""
+"""5621CC6F279B58C5_2428C13F2A615957_7019_UN""","""CC1=C(C=CC=N1)C=CC3=CC2=C(C=C(F)C=C2)N=C3Cl""",21,"""395F951D1FB62F03"""
+"""D58147725AA05D64_36BE796493B77AC2_7019_UN""","""CC1=C(C=CC=N1)C=CC3=CC=C(C2=C(Cl)C=CC=C2)S3""",21,"""395F951D1FB62F03"""
+"""9C9A3CFA80985719_4D37E509F1F934AB_7019_UN""","""CC1=C(C=CC=N1)C=CC2=C(Cl)N=C(S2)N3CCOCC3""",21,"""395F951D1FB62F03"""
+"""F7170C61CCDCD909_35D7BC3F7F8A0002_7019_UN""","""CC1=C(C=CC=N1)C=CC2=C[NH]C3=CC(=C(OC)C=C23)Cl""",21,"""395F951D1FB62F03"""
+"""A1036D192DD733C4_4584EBFEE765B5E9_7019_UN""","""CC1=C(C=CC=N1)C=CC2=C(Cl)[N](N=C2)C3=CC=CC=C3""",21,"""395F951D1FB62F03"""
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+"""41B678D090987FB4_DB3B063D980E0F0E_6036_UN""","""COC(CNCCCN(C)[S](=O)(=O)C1=CC=C(Br)S1)OC""",21,"""39C5D4288C5464BA"""
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+"""7DA66315AED576FD_E8C5C277E48DD96B_6036_UN""","""COC(CNCCCN(C)[S](=O)(=O)C1CCCNC1)OC""",21,"""39C5D4288C5464BA"""
+"""B535FEF896556300_DEC7FE5DD6EC95D9_6036_UN""","""COC(CNCCCN(C)[S](=O)(=O)CC1CCCN1)OC""",21,"""39C5D4288C5464BA"""
+"""A989CE1013110D9B_FA18BDE07D57E5CF_6036_UN""","""COC(CNCCCN(C)[S](=O)(=O)C1=CC=C(Cl)S1)OC""",21,"""39C5D4288C5464BA"""
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+"""B32E581E3FC8F633_E07B8F6DCF8C9125_6036_UN""","""COC(CNCCCN([S](C)(=O)=O)C1=NN=C(N)S1)OC""",21,"""39C5D4288C5464BA"""
+"""62320B362A4A2F7E_583DBBC8595CEC5E_6036_UN""","""COC(CNCCCN(CC)[S](=O)(=O)C1CCNC1)OC""",21,"""39C5D4288C5464BA"""
+"""1C611DB5BC4D02AC_9D9E35F2E59CC3A7_6036_UN""","""COC(CNCCCN([S](C(C)(C)C)(=O)=O)CC=C)OC""",21,"""39C5D4288C5464BA"""
+"""0D2F3757C58B35D8_38C5A096A779C450_6036_UN""","""COC(CNCCCN(C)[S](=O)(=O)CC[S](=O)(=O)C)OC""",21,"""39C5D4288C5464BA"""
+"""8105E12FCF129BFF_3654D7DC9E1FB7DF_6036_UN""","""COC(CNCCCN(C(C)(C)C)[S](=O)(=O)CCN)OC""",21,"""39C5D4288C5464BA"""
+"""81B8DF894C0F96D7_D8CDBAED292011DF_6036_UN""","""COC(CNCCCN([S](C)(=O)=O)CCNC1CC1)OC""",21,"""39C5D4288C5464BA"""
+"""91AC0C48AAA04914_6751FF92E0349277_6036_UN""","""COC(CNCCCN([S](C)(=O)=O)C(=O)CN=[N]#N)OC""",21,"""39C5D4288C5464BA"""
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+"""0855FA4FA082888C_7E4D6CA1785F7BD1_6036_UN""","""COC(CNCCCN1[S](CCC1C(OC)=O)(=O)=O)OC""",21,"""39C5D4288C5464BA"""
+"""874ADB03020D18D3_6669BD4D4A9AB766_6036_UN""","""COC(CNCCCN1[S](=O)(=O)C2=C(C1)C=CC=C2)OC""",21,"""39C5D4288C5464BA"""
+"""C1A63170BA58E5EC_8625F41B1738340A_6036_UN""","""COC(CNCCCN([S](C)(=O)=O)CC1=CC=NO1)OC""",21,"""39C5D4288C5464BA"""
+"""CC4012D839FE57AB_CA4B49182B3E682E_6036_UN""","""COC(CNCCCN([S](C)(=O)=O)C1CCNCC1)OC""",21,"""39C5D4288C5464BA"""
+"""84E773EFDC3542C2_B5509C59B41AA540_6036_UN""","""COC(CNCCCN([S](C)(=O)=O)C1=NC=CC=C1)OC""",21,"""39C5D4288C5464BA"""
+"""F69BED47EFAC0AD6_652FCF5BEE358DA6_6036_UN""","""COC(CNCCCN(C)[S](=O)(=O)C1=CN=CC=C1)OC""",21,"""39C5D4288C5464BA"""
+"""D647AB2AA7812556_B71E1C0986992DAE_6036_UN""","""COC(CNCCCN(C(C)(C)C(=N)N)[S](=O)(=O)C)OC""",21,"""39C5D4288C5464BA"""
+"""D221107E1D522A0B_0C4FC5928E0E02EA_6036_UN""","""COC(CNCCCN(C)[S](=O)(=O)C1=C[N](C)C=N1)OC""",21,"""39C5D4288C5464BA"""
+"""CCC8925FB53BFDA9_FEEE9E81C615DCD0_6036_UN""","""COC(CNCCCN1CCCC(C(C)C)[S]1(=O)=O)OC""",21,"""39C5D4288C5464BA"""
+"""B4AB16FE61001179_DEFA8A08C6D59CEC_6036_UN""","""COC(CNCCCN([S](C)(=O)=O)CC1CNCC1)OC""",21,"""39C5D4288C5464BA"""
+"""AAE4C392147098BE_E286311E9120335A_6036_UN""","""COC(CNCCCN([S](C)(=O)=O)[C@@H]1CNCCC1)OC""",21,"""39C5D4288C5464BA"""
+"""10A4A6BC2A136DEF_EBCE2C87EC264225_6036_UN""","""COC(CNCCCN(CCCCl)[S](=O)(=O)C1CC1)OC""",21,"""39C5D4288C5464BA"""
+"""E823CF1C6076EC4A_49FBF55F91F1EAAE_6036_UN""","""COC(CNCCCN1C(=O)C2=C([S]1(=O)=O)C=CS2)OC""",21,"""39C5D4288C5464BA"""
+"""A64060A1D1DFA360_58EF267C8284D99A_6036_UN""","""COC(CNCCCN(C(C(C)(C)N)=O)[S](=O)(=O)C)OC""",21,"""39C5D4288C5464BA"""
+"""DE214A2D9CB48BCD_AD591850781F37A1_6036_UN""","""COC(CNCCCN(CCCN)[S](=O)(=O)C1CC1)OC""",21,"""39C5D4288C5464BA"""
+"""91C7932F22F3E0ED_915D2C49300821CF_6036_UN""","""COC(CNCCCN1CCCC(CC=C)[S]1(=O)=O)OC""",21,"""39C5D4288C5464BA"""
+"""6557520EB9DF04DE_782B166E2126EB90_6036_UN""","""COC(CNCCCN(CCCN)[S](=O)(=O)C(F)F)OC""",21,"""39C5D4288C5464BA"""
+"""A16B36AB4B41D12D_8B2BBC83BB390444_6036_UN""","""COC(CNCCCN1[S](C2(CC1CI)CC2)(=O)=O)OC""",21,"""39C5D4288C5464BA"""
+"""B70A552052C889FD_8245AC60422C9BFB_6036_UN""","""COC(CNCCCN1CCCCNCC[S]1(=O)=O)OC""",21,"""39C5D4288C5464BA"""
+"""522A99F27381AEEA_F61D6BC341054753_6036_UN""","""COC(CNCCCN1[S](=O)(=O)C2(C1)CCOCC2)OC""",21,"""39C5D4288C5464BA"""
+"""9583DB7DF6D0E90B_19C69BD797698825_6036_UN""","""COC(CNCCCN1C(CN)CC2([S]1(=O)=O)CC2)OC""",21,"""39C5D4288C5464BA"""
+"""709A7145E77115AB_BE38B49F54CE9B3F_6036_UN""","""COC(CNCCCN([S](=O)(=O)C1CC1)C2CNC2)OC""",21,"""39C5D4288C5464BA"""
+"""7FE0C39BFCE4CD87_867F45CE8C7F8930_6036_UN""","""COC(CNCCCN1CC2(C[S]1(=O)=O)CCCC2)OC""",21,"""39C5D4288C5464BA"""
+"""7BAF656E76B022C4_2C2147C455A2E496_6036_UN""","""COC(CNCCCN([S](=O)(=O)C1CNC1)C2CC2)OC""",21,"""39C5D4288C5464BA"""
+"""F19BEF526D58A7BC_8883C11C0BCE0DED_6036_UN""","""COC(CNCCCN([S](C)(=O)=O)CC[S](=O)(=O)Cl)OC""",21,"""39C5D4288C5464BA"""
+"""44E168EE1A0B2626_98CF1F6052C9C608_6036_UN""","""COC(CNCCCN(CCC)[S](=O)(=O)C(F)(F)F)OC""",21,"""39C5D4288C5464BA"""
+"""7867A9EA570334B2_D0E901BFBE084392_7019_UN""","""C(C1(CCCC1)C#N)=CC2=CSC(=N2)C3=CC=C(Cl)C=C3""",21,"""39F4D8D6D4ACF0EB"""
+"""BE92167149FCE603_E81CBBCEFB5CDBA2_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC2=CC=CC(=C2N=C3Cl)C""",21,"""39F4D8D6D4ACF0EB"""
+"""F5AE039C6DC7F896_8F044ED245CAA141_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC2=C(C=C(C)C=C2)N=C3Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""CC21545C478E2B1B_ECAB42BBEE768DD5_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC=C(C2=CC=C(Cl)C=C2)O3""",21,"""39F4D8D6D4ACF0EB"""
+"""1891B6EE18DE008F_F4A38E7F5A276459_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC(=C2OCCCOC2=C3)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""B78DFF89BDCA2933_232F66B3E9E3DF3C_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(Cl)N=C(S2)N3CCCCC3""",21,"""39F4D8D6D4ACF0EB"""
+"""08223C0F9B1A9F7D_4562CC33C0BF058C_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC2=C(C=CC(=C2)C)N=C3Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""66DAD72C98ACA311_3025CF24A44DA618_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC=C(C2=CC=C(Cl)C=C2)S3""",21,"""39F4D8D6D4ACF0EB"""
+"""609E203878A4A423_EEB5D38EA3C49ED4_7019_UN""","""C(C1(CCCC1)C#N)=CC3=C[N](C2=CC=C(Cl)C=C2)N=C3""",21,"""39F4D8D6D4ACF0EB"""
+"""7E9F35C4AD1D76B4_F7985FF5BC81252A_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC2=C(C(=CC(=C2)Cl)Cl)OC3""",21,"""39F4D8D6D4ACF0EB"""
+"""FB70E13530B2E8EA_078C9DAD9EAA3B9C_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC=C(C2=CC=CC(=C2)Cl)S3""",21,"""39F4D8D6D4ACF0EB"""
+"""375CAF76DDB19F08_0DEA6B22AE19005B_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(OC(F)F)C(=CC(=C2)Cl)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""38345ADC78192FAC_13734B47CBF49B8D_7019_UN""","""C(C1(CCCC1)C#N)=CC2=CC(=C(OCC)C(=C2)Cl)OC""",21,"""39F4D8D6D4ACF0EB"""
+"""52D79F01CDCBE7C1_80505AAB09A6203E_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC2=C([N](N=C2C)C)N=C3Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""E8F2B2C70F40384B_66E323DBFB908450_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C[NH]N=C2C3=CC=CC(=C3)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""369F7C1D68DC9333_A9DD02407DC56A56_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(Cl)C=CC=C2N3CCCC3""",21,"""39F4D8D6D4ACF0EB"""
+"""2AAFA2368B8F575C_BBFF8FBA5A115EA7_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC(=C2C=CC=CC2=C3O)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""3550F8706A9DF09E_BEBFE46B560D75E9_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C([S](CC)(=O)=O)C(=CC=C2)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""ED075CCDEF8DD837_29B13FBE09CD26C1_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(C=CC(=C2)Cl)OCC3CC3""",21,"""39F4D8D6D4ACF0EB"""
+"""D3A1534A25DB6E43_BD8966DD007BECF4_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C[NH]N=C2C3=CC=C(Cl)C=C3""",21,"""39F4D8D6D4ACF0EB"""
+"""C4E1DDCB55C4704F_5FD19C426D4DC4FD_7019_UN""","""C(C1(CCCC1)C#N)=CC2=CC(=C(C(=C2)Cl)OC)OCC""",21,"""39F4D8D6D4ACF0EB"""
+"""2F8C0D6489543E87_F79E6643C8884FE2_7019_UN""","""C(C1(CCCC1)C#N)=CC3=N[N](C2=CC=C(Cl)C=C2)N=C3""",21,"""39F4D8D6D4ACF0EB"""
+"""CB9F417328F8FF18_CE2CAD39884FF8A1_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CN=C(C2=CC=CC(=C2)Cl)S3""",21,"""39F4D8D6D4ACF0EB"""
+"""E9452CF06649B1EB_26674FC1BF968103_7019_UN""","""C(C1(CCCC1)C#N)=CC2=CC(=C(OC(C)C)C=C2Cl)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""F19B22647EB0DCAF_CED63E7E834920D5_7019_DP""","""C(C1(CCCC1)C#N)=CC3=C(N=C(N2CCNCC2)S3)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""A8475FFDF2ED0270_E3C7570D5760A796_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC2=C(C=CC(=C2)F)N=C3Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""17F94E1463C2EC82_24838CF4E17B86BF_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC2=C(C=C(F)C=C2)N=C3Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""4A4AB62B8999C1C8_361534AF58ADA52A_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC=C(C2=C(Cl)C=CC=C2)S3""",21,"""39F4D8D6D4ACF0EB"""
+"""1B7F37D65138AF11_4D9CA8C23AE3EB43_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(Cl)N=C(S2)N3CCOCC3""",21,"""39F4D8D6D4ACF0EB"""
+"""4AC5C71349D1E529_357CF1F4B490DFEA_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C[NH]C3=CC(=C(OC)C=C23)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""61EFA3E7AE84A936_452FA6352C7F6A01_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(Cl)[N](N=C2)C3=CC=CC=C3""",21,"""39F4D8D6D4ACF0EB"""
+"""894893DD06E08DB1_8320A8DDCEFD80D0_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(Cl)[NH]C3=C2C=C(C(=C3)Cl)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""F049803A8EA33A1C_DE8AC58CBDA6E0C2_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(C=C(Cl)C=C2)[N]3C=NC=N3""",21,"""39F4D8D6D4ACF0EB"""
+"""0915D5FF1C0115C9_6ADCBB1121DAA87A_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC=C(C2=C(Cl)C=CC=C2)O3""",21,"""39F4D8D6D4ACF0EB"""
+"""F9F215336C8B766F_56F6A5661C09F7C3_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CN=C(C2=CC=C(Cl)C=C2)S3""",21,"""39F4D8D6D4ACF0EB"""
+"""F79C18E2E4AB3A51_CAD8989CB352274E_7019_UN""","""C(C1(CCCC1)C#N)=CC3=C[N](C2=CC=CC(=C2)Cl)N=C3""",21,"""39F4D8D6D4ACF0EB"""
+"""4EC80A3035E39DC8_329B7B08DB7B42F0_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(C(=C(F)C=C2)C(F)(F)F)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""6268E68D77F74635_D4197BF9332ABC4B_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(C=C(OC)C=C2CCl)OC""",21,"""39F4D8D6D4ACF0EB"""
+"""67C901E11D49F41B_56DFD79EE58BD004_7019_UN""","""C(C1(CCCC1)C#N)=CC2=CC(=C(OC(F)(F)F)C=C2)Cl""",21,"""39F4D8D6D4ACF0EB"""
+"""64D0320BCF97D095_01FEF3E5DDFDA31A_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(Cl)C=CC=C2[N]3C=CN=C3""",21,"""39F4D8D6D4ACF0EB"""
+"""D73C6954736E2DA1_2986759F35E992C5_7019_UN""","""C(C1(CCCC1)C#N)=CC3=CC(=C2OCOCC2=C3)CCl""",21,"""39F4D8D6D4ACF0EB"""
+"""595B56B7A89FCE7B_E1BEF6AD87F50FCB_7019_UN""","""C(C1(CCCC1)C#N)=CC2=C(Cl)C=CC=C2[N]3C=CC=N3""",21,"""39F4D8D6D4ACF0EB"""
+"""51973BFB46294058_CDC112B7B4B146E3_2267_UN""","""C(#CCNCC1CC1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""3A2BC2A14D0EC7FA"""
+"""43E51BCFF4E68FBE_53129BE15B4611B0_2267_UN""","""C(#CCNCC1CC1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""3A2BC2A14D0EC7FA"""
+"""0CE50EE8F25FF7D0_B7EC68A2B9760C15_2267_UN""","""C(#CCNCC1CC1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""3A2BC2A14D0EC7FA"""
+"""070D337B6453AE4A_D0DA9E4C0AE88F9E_2267_UN""","""C(#CCNCC1CC1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""3A2BC2A14D0EC7FA"""
+"""1DDB963E85DEFBF3_5B5B35BE8CFA468F_2267_UN""","""C(#CCNCC1CC1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""3A2BC2A14D0EC7FA"""
+"""90BD3E1154F383B9_ABD027393ABEAEDA_2267_UN""","""C(#CCNCC1CC1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""3A2BC2A14D0EC7FA"""
+"""D2E6B8AA8C29B5DB_6BDF26E4B06CF241_2267_UN""","""C(#CCNCC1CC1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""3A2BC2A14D0EC7FA"""
+"""D028C476814E4E8E_2CBABC9CCAFCD52D_2267_UN""","""C(#CCNCC1CC1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""3A2BC2A14D0EC7FA"""
+"""CFD825977C2F2D34_2397EC49E45656C1_2267_UN""","""C(#CCNCC1CC1)C2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""3A2BC2A14D0EC7FA"""
+"""748486D198AD8E65_456BD28245433BA7_2267_UN""","""C(#CCNCC1CC1)C2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""3A2BC2A14D0EC7FA"""
+"""944D687562A5138C_EFBF62C5CB802108_2267_UN""","""C(#CCNCC1CC1)C2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""3A2BC2A14D0EC7FA"""
+"""BA57877C217888D8_0F3B31C8836279D6_2267_UN""","""C(#CCNCC1CC1)C2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""3A2BC2A14D0EC7FA"""
+"""7F8FBFF533B6F391_6A10FE3E68F1FFDF_2267_UN""","""C(#CCNCC1CC1)C2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""3A2BC2A14D0EC7FA"""
+"""70A41C44298E2BEA_A83ACA808361358D_2267_UN""","""C(#CCNCC1CC1)C3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""3A2BC2A14D0EC7FA"""
+"""4D42D4BDAD81FEED_16F7F569256A2202_2267_UN""","""C(#CCNCC1CC1)C2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""3A2BC2A14D0EC7FA"""
+"""B8F4989EC2320596_3E1CE4213F2F490F_2267_UN""","""C(#CCNCC1CC1)C2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""3A2BC2A14D0EC7FA"""
+"""8DCDDAFE2B104ADF_FD6312C83DA79231_2267_UN""","""C(#CCNCC1CC1)C2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""3A2BC2A14D0EC7FA"""
+"""25545157593E37F3_28733074ACEF0C62_2267_UN""","""C(#CCNCC1CC1)C3=CC=C(CC2(C)NCCC2)C=C3""",21,"""3A2BC2A14D0EC7FA"""
+"""F463AC3317FD10F3_8BCD797922766B0E_2267_UN""","""C(#CCNCC1CC1)C2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""3A2BC2A14D0EC7FA"""
+"""DC33A9E617E00F8C_A0C2D46DDD08212D_2267_UN""","""C(#CCNCC1CC1)C2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""3A2BC2A14D0EC7FA"""
+"""D735183583F04E05_4C4FA54EAD3008F0_2267_UN""","""C(#CCNCC1CC1)C2=CC=C(C=C2)C3NCCNC3=O""",21,"""3A2BC2A14D0EC7FA"""
+"""F47605887C199F0A_B6F2BE72931874F6_2267_UN""","""C(#CCNCC1CC1)C2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""3A2BC2A14D0EC7FA"""
+"""B1AA75C71C966BC3_109E2A17B1DDB332_2267_UN""","""C(#CCNCC1CC1)C(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""3A2BC2A14D0EC7FA"""
+"""CFA899EFB010D860_9AF31B18B6533866_2267_UN""","""C(#CCNCC1CC1)C2=C[N](CC(OCC)OCC)N=C2""",21,"""3A2BC2A14D0EC7FA"""
+"""9EF9F5472589D9E7_4665DBCAD398C22D_2267_UN""","""C(#CCNCC1CC1)C2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""3A2BC2A14D0EC7FA"""
+"""E34EDD966ED11B8D_F0774FCCD77FAD81_2267_UN""","""C(#CCNCC1CC1)C2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""3A2BC2A14D0EC7FA"""
+"""DD215F733DE1145B_F57AD6B7BF88CA14_2267_UN""","""C(#CCNCC1CC1)C3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""3A2BC2A14D0EC7FA"""
+"""FC3AFBAB6C094D1E_0CBF1EFF0D50643E_2267_UN""","""C(#CCNCC1CC1)C2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""3A2BC2A14D0EC7FA"""
+"""ADA2C5CC99B32774_28651A255BFE6FB6_2267_UN""","""C(#CCNCC1CC1)C2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""3A2BC2A14D0EC7FA"""
+"""808324E38AE5CAB3_5F0DA7379C2B05C1_2267_UN""","""C(#CCNCC1CC1)C2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""3A2BC2A14D0EC7FA"""
+"""FD6B2A6D7922E18F_8946431554F4DCF0_2267_UN""","""C(#CCNCC1CC1)C2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""3A2BC2A14D0EC7FA"""
+"""38BAD2192EBA15AF_ADD9BCFD6C0A064B_2267_UN""","""C(#CCNCC1CC1)C2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""3A2BC2A14D0EC7FA"""
+"""F06DEF753FCE59EB_22C94B61AD8667C2_2267_UN""","""C(#CCNCC1CC1)C2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""3A2BC2A14D0EC7FA"""
+"""B739630FA8772DA9_6BDC66D0222E78D1_2267_UN""","""C(#CCNCC1CC1)C2=CC=C(C=C2)CN3CCCCC3""",21,"""3A2BC2A14D0EC7FA"""
+"""589D6D928502B729_B7F85CB21DA9465B_2267_UN""","""C(#CCNCC1CC1)C2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""3A2BC2A14D0EC7FA"""
+"""5F4C553C278B0EFD_784A48440A31ABEA_2267_UN""","""C(#CCNCC1CC1)C2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""3A2BC2A14D0EC7FA"""
+"""2E1897094CC7D039_3C60BFE19D1F7F3C_2267_UN""","""C(#CCNCC1CC1)C2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""3A2BC2A14D0EC7FA"""
+"""43E7DB4E512EAFFB_47C631BC756F5A6C_2267_UN""","""C(#CCNCC1CC1)C3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""3A2BC2A14D0EC7FA"""
+"""864418D2A30C4DA0_756089240E807236_2267_UN""","""C(#CCNCC1CC1)C2=CC=C(CCCCC(O)=O)C=C2""",21,"""3A2BC2A14D0EC7FA"""
+"""74CD580DDD749603_404381E338F50939_2267_UN""","""C(#CCNCC1CC1)C2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""3A2BC2A14D0EC7FA"""
+"""8087045301AD5E00_18F14BB9F8A9FC2C_2267_UN""","""C(#CCNCC1CC1)C2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""3A2BC2A14D0EC7FA"""
+"""D4E120812A78F239_40973CD7E6FB05B5_2267_UN""","""C(#CCNCC1CC1)C3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""3A2BC2A14D0EC7FA"""
+"""D0D3A4A5DE8774D1_D25D4450D436F649_7019_UN""","""FC1=CC(=CC=C1)C=CC2=CSC(=N2)C3=CC=C(Cl)C=C3""",21,"""3B409D39BE924530"""
+"""CECA83B60503978C_EAA8FE2191626E79_7019_UN""","""FC1=CC(=CC=C1)C=CC3=CC2=CC=CC(=C2N=C3Cl)C""",21,"""3B409D39BE924530"""
+"""B85C40D1045309C8_8DB00B3D2FF4149A_7019_UN""","""FC1=CC(=CC=C1)C=CC3=CC2=C(C=C(C)C=C2)N=C3Cl""",21,"""3B409D39BE924530"""
+"""93DAA3AA840BFD94_EE1F07548448380E_7019_UN""","""FC1=CC(=CC=C1)C=CC3=CC=C(C2=CC=C(Cl)C=C2)O3""",21,"""3B409D39BE924530"""
+"""92FDB8A5CAED891A_F617CB903019D182_7019_UN""","""FC1=CC(=CC=C1)C=CC3=CC(=C2OCCCOC2=C3)Cl""",21,"""3B409D39BE924530"""
+"""BC259B99FF565499_219B235C83DD6AE7_7019_UN""","""FC1=CC(=CC=C1)C=CC2=C(Cl)N=C(S2)N3CCCCC3""",21,"""3B409D39BE924530"""
+"""6EA84171F4B865FB_47D689DCAA81B057_7019_UN""","""FC1=CC(=CC=C1)C=CC3=CC2=C(C=CC(=C2)C)N=C3Cl""",21,"""3B409D39BE924530"""
+"""BFCB5F93909AF42A_32918ACBCE7313C3_7019_UN""","""FC1=CC(=CC=C1)C=CC3=CC=C(C2=CC=C(Cl)C=C2)S3""",21,"""3B409D39BE924530"""
+"""3BC52381F494B639_EC019661C9FA2B0F_7019_UN""","""FC1=CC(=CC=C1)C=CC3=C[N](C2=CC=C(Cl)C=C2)N=C3""",21,"""3B409D39BE924530"""
+"""39F62D1F2209BC9E_F52C1A1AD6BF90F1_7019_UN""","""FC1=CC(=CC=C1)C=CC3=CC2=C(C(=CC(=C2)Cl)Cl)OC3""",21,"""3B409D39BE924530"""
+"""D568C1E444316D98_0538D842F4948E47_7019_UN""","""FC1=CC(=CC=C1)C=CC3=CC=C(C2=CC=CC(=C2)Cl)S3""",21,"""3B409D39BE924530"""
+"""B01A8602CF6BD626_0F5E2ECDC427B580_7019_UN""","""FC1=CC(=CC=C1)C=CC2=C(OC(F)F)C(=CC(=C2)Cl)Cl""",21,"""3B409D39BE924530"""
+"""87C16FFBCC451A66_11C70EA8A1CA2E56_7019_UN""","""FC1=CC(=CC=C1)C=CC2=CC(=C(OCC)C(=C2)Cl)OC""",21,"""3B409D39BE924530"""
+"""6E2C31082B8D0D82_82E41F44639895E5_7019_UN""","""FC1=CC(=CC=C1)C=CC3=CC2=C([N](N=C2C)C)N=C3Cl""",21,"""3B409D39BE924530"""
+"""484E18670BE25742_6457663491AE318B_7019_UN""","""FC1=CC(=CC=C1)C=CC2=C[NH]N=C2C3=CC=CC(=C3)Cl""",21,"""3B409D39BE924530"""
+"""48579FC92BC21945_AB6947AF17FBDF8D_7019_UN""","""FC1=CC(=CC=C1)C=CC2=C(Cl)C=CC=C2N3CCCC3""",21,"""3B409D39BE924530"""
+"""975D52C65287FE82_B94BCA55302FEB7C_7019_UN""","""FC1=CC(=CC=C1)C=CC3=CC(=C2C=CC=CC2=C3O)Cl""",21,"""3B409D39BE924530"""
+"""7DF3C014C772EF84_BC0BA1843C33C032_7019_UN""","""FC1=CC(=CC=C1)C=CC2=C([S](CC)(=O)=O)C(=CC=C2)Cl""",21,"""3B409D39BE924530"""
+"""5F7AE904C4099CBC_2B057A5163F3931A_7019_UN""","""FC1=CC(=CC=C1)C=CC2=C(C=CC(=C2)Cl)OCC3CC3""",21,"""3B409D39BE924530"""
+"""467F8432B602A92C_BF3D23326A45592F_7019_UN""","""FC1=CC(=CC=C1)C=CC2=C[NH]N=C2C3=CC=C(Cl)C=C3""",21,"""3B409D39BE924530"""
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+"""34ED9DF7A4AC73D3_B2628E78389C31DE_6036_UN""","""NC1=C(C=CC=C1)NCCN(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""3CB94659325178CA"""
+"""14937265278B8C57_093357E3300B1E9A_6036_UN""","""NC1=C(C=CC=C1)NCCN(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""3CB94659325178CA"""
+"""E2244A050FF5F8D2_FB920CF07810C0A0_6036_UN""","""NC1=C(C=CC=C1)NCCN2CCCC(C(C)C)[S]2(=O)=O""",21,"""3CB94659325178CA"""
+"""BB08A0E231A20E8C_DB86187978D0809C_6036_UN""","""NC1=C(C=CC=C1)NCCN([S](C)(=O)=O)CC2CNCC2""",21,"""3CB94659325178CA"""
+"""A5B2A9CCF15738F7_E7FAA36F2F252F2A_6036_UN""","""NC1=C(C=CC=C1)NCCN([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""3CB94659325178CA"""
+"""89F9EBC2DBA1B23C_EEB2BEF652235E55_6036_UN""","""NC1=C(C=CC=C1)NCCN(CCCCl)[S](=O)(=O)C2CC2""",21,"""3CB94659325178CA"""
+"""F9D80D6DA8A3FBAD_4C87672E2FF4F6DE_6036_UN""","""NC1=C(C=CC=C1)NCCN2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""3CB94659325178CA"""
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+"""658A2254295F3A55_32F2DDDB296DD348_6031_DP""","""O(C(=O)C1=C(N=C(C=C1)CN)C2CC2)CC3(CNC3)C#N""",21,"""3DFC6D73AD94F6A8"""
+"""03396837649F160C_279A5C432106575E_6031_DP""","""O(C(=O)C1=C(N=C(C=C1)CN)C2CC2)C[C@@H]3C[C@H](N)C=C3""",21,"""3DFC6D73AD94F6A8"""
+"""D92342199FDC6A14_6E90FCA9FDDA793A_6031_DP""","""O(C(=O)C1=C(N=C(C=C1)CN)C2CC2)C[C@H]3CCCNC3""",21,"""3DFC6D73AD94F6A8"""
+"""BE3BAA5157D5C40D_C7EC78D33F23D680_6031_DP""","""O(C(=O)C1=C(N=C(C=C1)CN)C2CC2)CC3CC(NC)C3""",21,"""3DFC6D73AD94F6A8"""
+"""AE54949AAC276C58_97538869934C8D4D_6031_DP""","""O(C(=O)C1=C(N=C(C=C1)CN)C2CC2)CCC3CCNC3""",21,"""3DFC6D73AD94F6A8"""
+"""04ECAF727102FF87_7C08C5F16721351F_6031_DP""","""O(C(=O)C1=C(N=C(C=C1)CN)C2CC2)C[C@@H]3OCCNC3""",21,"""3DFC6D73AD94F6A8"""
+"""9B2C9F502A51DE9F_8D0091720803634D_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC(C(OC)=O)N""",21,"""3F48D965EA33B144"""
+"""0DCF08802B9DC16B_F3189E853E264157_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2CCNCC2""",21,"""3F48D965EA33B144"""
+"""2533D98806311B67_1F8BE4AD3F6D3B59_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2CCCNC2""",21,"""3F48D965EA33B144"""
+"""E306B1CA3FC71E0A_82511B2250663E4E_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2NCCNC2""",21,"""3F48D965EA33B144"""
+"""F8C406490EC9227D_660DA99FE8324750_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC(CC=CC)N""",21,"""3F48D965EA33B144"""
+"""1C4C0E68C3A53DF7_24678B5C506218CA_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC(CC(C)C)N""",21,"""3F48D965EA33B144"""
+"""A15D493949EDC52C_E4B12208B427ADBB_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2(N)CCCC2""",21,"""3F48D965EA33B144"""
+"""E665FD03FC468699_6708AC15D654590A_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)C[C@@H]2CCCNC2""",21,"""3F48D965EA33B144"""
+"""BB59226743342B59_0D8F97C0C75D29B4_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)C[C@@H]2CCCCN2""",21,"""3F48D965EA33B144"""
+"""277D3267FFB099F2_4E6EDAC0EC31B357_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2OCCNC2""",21,"""3F48D965EA33B144"""
+"""2161A96EA4333034_8F0BA58F75D20B82_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CCC2(CNC2)N""",21,"""3F48D965EA33B144"""
+"""F4E2AB78DCC2A27C_CD0D66BDC413397B_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC(N)CC(F)F""",21,"""3F48D965EA33B144"""
+"""2F76157A15E99BBD_AF46050C445EC212_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)C[C@@H](C(OC)=O)N""",21,"""3F48D965EA33B144"""
+"""FCEE6A60205E9FE8_4929EE5D76152AC1_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2COCCN2""",21,"""3F48D965EA33B144"""
+"""AA45CE84935B77C0_F3B7F60835D9802D_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC(CCN)(C)C""",21,"""3F48D965EA33B144"""
+"""A53E1C34CE2CF2D3_78B441A451C873AF_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2(CCNC2)C""",21,"""3F48D965EA33B144"""
+"""636B47ABA8E89C39_C84DAB169047F903_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC23CC(N)(C2)C3""",21,"""3F48D965EA33B144"""
+"""5CBEE8EA30D2B3FB_851363F2E0598B7C_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CCCNC2CC2""",21,"""3F48D965EA33B144"""
+"""52175468CE63DFE6_A7A597BABEA237E1_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC(=C2CNC2)F""",21,"""3F48D965EA33B144"""
+"""BE69FC62542D91F6_F47577666146936E_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC[C@H]2CCCN2""",21,"""3F48D965EA33B144"""
+"""4B88EE91B1CD1ECD_F72811A7520F9A44_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)C[C@H]2CC[C@@H](N)C2""",21,"""3F48D965EA33B144"""
+"""A4DEC203646641F1_AADE93987CD529D8_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)C[C@H]2COC[C@H]2N""",21,"""3F48D965EA33B144"""
+"""C4B32F746FC0A0CD_E9F9772A4B067E6B_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)C[C@H]2CCC[C@H]2N""",21,"""3F48D965EA33B144"""
+"""3105A664AD017A2D_CDD304064611D133_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2C(CN2)(C)C""",21,"""3F48D965EA33B144"""
+"""5FFEAE548A28D984_B19EA87A121EFC86_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CCCNC(C)C""",21,"""3F48D965EA33B144"""
+"""7E9B27958E238FF7_1945B6960AFFAB66_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CCC2(CN)CC2""",21,"""3F48D965EA33B144"""
+"""1B19E9437A0E0D8E_0AF19325A4ECF50C_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC(C(C)C)ON""",21,"""3F48D965EA33B144"""
+"""C7E3B9605BCF7314_226D6925CCF6B84A_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC(C(C)C)CN""",21,"""3F48D965EA33B144"""
+"""9D380493EB7B3329_125F789C3F9B6E67_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2=CNCCO2""",21,"""3F48D965EA33B144"""
+"""E941CD12A599EB1A_2A009707E746EADF_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2=CNCCC2""",21,"""3F48D965EA33B144"""
+"""58A63FF8D5235CFD_473D4A7C3D3D69DE_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CCC2CC(N)C2""",21,"""3F48D965EA33B144"""
+"""F672D07B5E741D5C_21E8894AF0E6789D_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)C[C@@H]2COCCN2""",21,"""3F48D965EA33B144"""
+"""9D85D94B9BEA35FB_DEEC0D8971CFDD85_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CCCC(CC)N""",21,"""3F48D965EA33B144"""
+"""A7D79157FD513792_C81926E6C52F0990_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2(CN)COC2""",21,"""3F48D965EA33B144"""
+"""F5DCE13E960D4A1C_E307AA7B8BF5BD50_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CCCCCCN""",21,"""3F48D965EA33B144"""
+"""97622B0A45F07115_E892F7D631C2AB86_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2[C@@H]3CNC[C@H]23""",21,"""3F48D965EA33B144"""
+"""3585733FC51C3CBE_304669CD6ECA94A4_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2(CNC2)C#N""",21,"""3F48D965EA33B144"""
+"""038A255C7CD0C434_252EE85566A110B2_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)C[C@@H]2C[C@H](N)C=C2""",21,"""3F48D965EA33B144"""
+"""CD902AFD62480051_6C2448BFBA7D3ED6_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)C[C@H]2CCCNC2""",21,"""3F48D965EA33B144"""
+"""8727A111D3568E66_C558CCC57884916C_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CC2CC(NC)C2""",21,"""3F48D965EA33B144"""
+"""8A8267D1817EA981_95E73C7FD4EBCAA1_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)CCC2CCNC2""",21,"""3F48D965EA33B144"""
+"""4B5ADFB9D387E049_7EBC71E7208672F3_6031_DP""","""O(C(=O)CCC(CC1CCCCC1)N)C[C@@H]2OCCNC2""",21,"""3F48D965EA33B144"""
+"""DE7DA4FDEC51C683_D49D773B5C6A6232_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](CC)(=O)=O)CC(=O)OC""",21,"""3F493FF32578FCBD"""
+"""45367F4567DF3DAC_F7C0C29FE3A98AAF_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""3F493FF32578FCBD"""
+"""A2529BE08A8ED72F_DDB7EDE631229709_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""3F493FF32578FCBD"""
+"""19882D4BF954BEAD_8F02FA0FFDBA2296_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""3F493FF32578FCBD"""
+"""EDCF847F1C91AD06_EE4929AC4DA1416C_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C)[S](=O)(=O)C2CCCNC2""",21,"""3F493FF32578FCBD"""
+"""86F413B550A1DB67_D84B15867FC00DDE_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C)[S](=O)(=O)CC2CCCN2""",21,"""3F493FF32578FCBD"""
+"""90EDEC4E79F77A79_FC94563BD47B7DC8_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""3F493FF32578FCBD"""
+"""38BC581AF71A4337_33B0632F9526B468_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C)(=O)=O)C2CCCNC2""",21,"""3F493FF32578FCBD"""
+"""0873DDA7BDADAC2A_E6F764B666A00922_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""3F493FF32578FCBD"""
+"""BAA721E1927323E5_5EB15013F0707459_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(CC)[S](=O)(=O)C2CCNC2""",21,"""3F493FF32578FCBD"""
+"""4755CE96E5D29847_9B12DE294CB05BA0_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""3F493FF32578FCBD"""
+"""ACA8BE0B7777D6FB_3E494B4D0E555C57_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""3F493FF32578FCBD"""
+"""FACFD99EC08F78DB_30D83C0737332FD8_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""3F493FF32578FCBD"""
+"""7068E803A346F662_DE415136800C89D8_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C)(=O)=O)CCNC2CC2""",21,"""3F493FF32578FCBD"""
+"""FE0B978535DB896F_61DD144949180A70_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""3F493FF32578FCBD"""
+"""25F782BA57FEC1CD_D653E43A0B64EC79_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C)[S](=O)(=O)C2CCNCC2""",21,"""3F493FF32578FCBD"""
+"""213C7DC252273252_78C1877AD173E3D6_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""3F493FF32578FCBD"""
+"""288F5DDEFAB2137D_60E55696E3B62F61_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""3F493FF32578FCBD"""
+"""F8E2238E3C929C19_80A91FC0BE14AC0D_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""3F493FF32578FCBD"""
+"""764D45D80CB4A94A_CCC7A2C38212F029_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C)(=O)=O)C2CCNCC2""",21,"""3F493FF32578FCBD"""
+"""4CAD95E243F40663_B3DC77821D363D47_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""3F493FF32578FCBD"""
+"""B708A5189B79FE05_63A32480471915A1_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""3F493FF32578FCBD"""
+"""C77C1E462512C0B5_B192F7D22FB5B5A9_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""3F493FF32578FCBD"""
+"""29C465510C126108_0AC32E4927229AED_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""3F493FF32578FCBD"""
+"""DA22206199A7FF14_F862755A6F3944D7_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""3F493FF32578FCBD"""
+"""779653533AF99CEA_D87661D36FF904EB_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C)(=O)=O)CC2CNCC2""",21,"""3F493FF32578FCBD"""
+"""AFB040C0D9F0FF1D_E40ADAC5380CAB5D_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""3F493FF32578FCBD"""
+"""9D02C0A315581BD7_ED42C75C450ADA22_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""3F493FF32578FCBD"""
+"""D3FD2936AB3B9B7F_4F771E8438DD72A9_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""3F493FF32578FCBD"""
+"""FF3893AE1C67460E_5E63CDA72BA8419D_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""3F493FF32578FCBD"""
+"""1166BFC9B6AEA301_ABD5F38BD133AFA6_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(CCCN)[S](=O)(=O)C2CC2""",21,"""3F493FF32578FCBD"""
+"""5CC50835256B391B_97D1C7929924B9C8_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2CCCC(CC=C)[S]2(=O)=O""",21,"""3F493FF32578FCBD"""
+"""FDEBE286EA8AFAC7_7EA7FDB5880A7397_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(CCCN)[S](=O)(=O)C(F)F""",21,"""3F493FF32578FCBD"""
+"""89EC4C28FC9F8BFF_8DA7575812159C43_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""3F493FF32578FCBD"""
+"""AD6EC637B6318461_84C947BBEB0003FC_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2CCCCNCC[S]2(=O)=O""",21,"""3F493FF32578FCBD"""
+"""36FE2A5C3B920829_F0918018E829DF54_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""3F493FF32578FCBD"""
+"""227FE730F7E56AB1_1F4A700C3E451022_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""3F493FF32578FCBD"""
+"""2D0BA962EC36DD39_B8B45F44FDE20338_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""3F493FF32578FCBD"""
+"""B2020F66350B418D_80F3AE1525531137_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""3F493FF32578FCBD"""
+"""04417DF3E1E44255_2AADAC1FFC8E7C91_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""3F493FF32578FCBD"""
+"""C8CCC847A7869AB9_8E0F2AC7A2E295EA_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""3F493FF32578FCBD"""
+"""F085AD46799470E2_9E43F4BBFBE55E0F_6036_UN""","""NCC(C1=CC=C(C=C1)Cl)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""3F493FF32578FCBD"""
+"""930C2D01E0788DBF_F247419BF70CEF84_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC(C(OC)=O)N""",21,"""400F098C153C3D8D"""
+"""356C238DEEBD8BB5_8C5F4E6CC129CD9E_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC3CCNCC3""",21,"""400F098C153C3D8D"""
+"""DC0D52A61D99D8E2_60CC3444C062B790_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC3CCCNC3""",21,"""400F098C153C3D8D"""
+"""F180D18BBCB3B774_FD16CBCBAF69B287_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC3NCCNC3""",21,"""400F098C153C3D8D"""
+"""F446EE4AB5FAE595_194A7976173DCB99_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC(CC=CC)N""",21,"""400F098C153C3D8D"""
+"""B881B7B8CA36C7C9_5B205BB5AF6D9403_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC(CC(C)C)N""",21,"""400F098C153C3D8D"""
+"""333757CE2C7E973C_9BF6F2E14B282172_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC3(N)CCCC3""",21,"""400F098C153C3D8D"""
+"""8C299729F54F050C_184F7CFC295BD5C3_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)C[C@@H]3CCCNC3""",21,"""400F098C153C3D8D"""
+"""1859441C02149F8A_72C847293852A57D_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)C[C@@H]3CCCCN3""",21,"""400F098C153C3D8D"""
+"""159F6A412D1EE7B8_31290A29133E3F9E_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC3OCCNC3""",21,"""400F098C153C3D8D"""
+"""5E3D20514CA36D4C_F04C75668ADD874B_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CCC3(CNC3)N""",21,"""400F098C153C3D8D"""
+"""367BBA8E13A4093B_B24AB6543B1CB5B2_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC(N)CC(F)F""",21,"""400F098C153C3D8D"""
+"""8AE868DCA4D2A394_D001D5E5BB514EDB_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)C[C@@H](C(OC)=O)N""",21,"""400F098C153C3D8D"""
+"""B4C3B39D733F7A2D_366E3EB4891AA608_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC3COCCN3""",21,"""400F098C153C3D8D"""
+"""6A724DC3AC897F82_8CF026E1CAD60CE4_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC(CCN)(C)C""",21,"""400F098C153C3D8D"""
+"""AC17F5681882FE03_07F3914DAEC7FF66_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC3(CCNC3)C""",21,"""400F098C153C3D8D"""
+"""6D0058D6BBFB22EE_B70A7BFF6F4875CA_6031_DP""","""O(C(=O)C1=C[N](N=N1)C2CCNCC2)CC34CC(N)(C3)C4""",21,"""400F098C153C3D8D"""
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+"""C602C0A3AFD8340A_1FA2392C23D1FBF8_6036_UN""","""NC1=CC(=CC=C1)CCCN(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""4348225F41B012E4"""
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+"""3562E6C6D1B92F78_76C233E543EA74B4_6036_UN""","""NC1=CC(=CC=C1)CCCN(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""4348225F41B012E4"""
+"""6EFD6E8D0F038227_846368F60BF1AA8E_6036_UN""","""NC1=CC(=CC=C1)CCCN2CCCC(C(C)C)[S]2(=O)=O""",21,"""4348225F41B012E4"""
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+"""53629A4CDE36377C_980BC7695CC44504_6036_UN""","""NC1=CC(=CC=C1)CCCN([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""4348225F41B012E4"""
+"""B49C738A095DDDAE_9143DAF021C2347B_6036_UN""","""NC1=CC(=CC=C1)CCCN(CCCCl)[S](=O)(=O)C2CC2""",21,"""4348225F41B012E4"""
+"""AD2C5844C2D4E1EB_337603285C159CF0_6036_UN""","""NC1=CC(=CC=C1)CCCN2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""4348225F41B012E4"""
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+"""385D764FEEA21021_C83DCCAF754D5011_2267_UN""","""CC(C)NCCC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""45FA66AC81359BFE"""
+"""B181D94257643E2E_AF0B3A41C6D3D39A_2267_UN""","""CC(C)NCCC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""45FA66AC81359BFE"""
+"""2E9990FF6BDE8C48_248A91B340C11A8B_2267_UN""","""CC(C)NCCC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""45FA66AC81359BFE"""
+"""7CA3A44AE079BA9A_D4018334F685F2DE_2267_UN""","""CC(C)NCCC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""45FA66AC81359BFE"""
+"""E5D8A3B0E69D59D1_140E82E97C57AE45_2267_UN""","""CC(C)NCCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""45FA66AC81359BFE"""
+"""30E6E9F26F8636B2_536B189106C78929_2267_UN""","""CC(C)NCCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""45FA66AC81359BFE"""
+"""E7675207B8C00E9A_5C464844286D0AC5_2267_UN""","""CC(C)NCCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""45FA66AC81359BFE"""
+"""C177181903CBAD92_3ABA768F897867A3_2267_UN""","""CC(C)NCCC#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""45FA66AC81359BFE"""
+"""053F0A0F35AB2AAC_906EC6C807BB7D0C_2267_UN""","""CC(C)NCCC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""45FA66AC81359BFE"""
+"""6C8F4723B8C2C920_70EA95C54F5925D2_2267_UN""","""CC(C)NCCC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""45FA66AC81359BFE"""
+"""5C90EAC539B748D3_15C15A33A4CAA3DB_2267_UN""","""CC(C)NCCC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""45FA66AC81359BFE"""
+"""FE85FCEA155BA751_D7EB6E8D4F5A6989_2267_UN""","""CC(C)NCCC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2""",21,"""45FA66AC81359BFE"""
+"""3CDA49341E414787_69265164E9517E06_2267_UN""","""CC(C)NCCC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""45FA66AC81359BFE"""
+"""D26D7E628C4AC388_41CD402CF314150B_2267_UN""","""CC(C)NCCC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""45FA66AC81359BFE"""
+"""4B79E0110988601A_82B2B6C5F19CCE35_2267_UN""","""CC(C)NCCC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""45FA66AC81359BFE"""
+"""D704CAEFCD0D29E6_57A2947960D45066_2267_UN""","""CC(C)NCCC#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""45FA66AC81359BFE"""
+"""D42506E4CEF8E05A_F41CDD74EE4D370A_2267_UN""","""CC(C)NCCC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""45FA66AC81359BFE"""
+"""17E4D0EF8244825E_DF13706011337D29_2267_UN""","""CC(C)NCCC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""45FA66AC81359BFE"""
+"""9AF07C3769FFC07F_339E0143610B54F4_2267_UN""","""CC(C)NCCC#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""45FA66AC81359BFE"""
+"""9CB1C5BDCEB2F852_C9231A7F5F2328F2_2267_UN""","""CC(C)NCCC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""45FA66AC81359BFE"""
+"""23B20842C95CB196_6F4F8E1A7DE6EF36_2267_UN""","""CC(C)NCCC#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""45FA66AC81359BFE"""
+"""7EED8AEA5FF7AAEB_E522BF157A686462_2267_UN""","""CC(C)NCCC#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""45FA66AC81359BFE"""
+"""4FF36C9BFA1AB5C8_39B47FC71FA39E29_2267_UN""","""CC(C)NCCC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""45FA66AC81359BFE"""
+"""2421AC5F1A04E172_8FA6EBC11B44F185_2267_UN""","""CC(C)NCCC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""45FA66AC81359BFE"""
+"""D1B9702B8AC3F4AC_8AAB72BA73B39610_2267_UN""","""CC(C)NCCC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""45FA66AC81359BFE"""
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+"""A846BE026FCF356A_57B4BE2897C533B2_2267_UN""","""CC(C)NCCC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""45FA66AC81359BFE"""
+"""6621F78B428A5C33_20DC033A501059C5_2267_UN""","""CC(C)NCCC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""45FA66AC81359BFE"""
+"""BA84FAB4C72BF7EE_F697E71898CF80F4_2267_UN""","""CC(C)NCCC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""45FA66AC81359BFE"""
+"""B2EFA8F70D155D01_D20818F0A0315A4F_2267_UN""","""CC(C)NCCC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""45FA66AC81359BFE"""
+"""EFBF1718992F7AA3_5D18EF6C61BD3BC6_2267_UN""","""CC(C)NCCC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""45FA66AC81359BFE"""
+"""AE3831589687869A_140DC2DDEE1524D5_2267_UN""","""CC(C)NCCC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""45FA66AC81359BFE"""
+"""1B1DCF4386F0918D_C829F8BFD1921A5F_2267_UN""","""CC(C)NCCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""45FA66AC81359BFE"""
+"""7B518E86E86B90D1_079BEC49C60AF7EE_2267_UN""","""CC(C)NCCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""45FA66AC81359BFE"""
+"""AA5E6CFDB6E202C8_43B11BEC51242338_2267_UN""","""CC(C)NCCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""45FA66AC81359BFE"""
+"""29FF3D7BC79C0B8D_381795B1B9540668_2267_UN""","""CC(C)NCCC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""45FA66AC81359BFE"""
+"""E3AFCF9812C61282_0AB12D29C2BB2E32_2267_UN""","""CC(C)NCCC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""45FA66AC81359BFE"""
+"""3F50DA4220D56325_3F9225EEF4CE553D_2267_UN""","""CC(C)NCCC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""45FA66AC81359BFE"""
+"""FFABD522751B403F_6720EFB43492A028_2267_UN""","""CC(C)NCCC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""45FA66AC81359BFE"""
+"""19B3CE895BD1EE8F_3F4698DA2AC059B1_2267_UN""","""CC(C)NCCC#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""45FA66AC81359BFE"""
+"""502698CAB5304E0B_AE7C189A37FAF7A7_7019_UN""","""CC1=NC=C(C=N1)C=CC2=CSC(=N2)C3=CC=C(Cl)C=C3""",21,"""4761C1F35D5E44DE"""
+"""B6215231E16EE2F9_9689A2EB72AE6F97_7019_UN""","""CC1=NC=C(C=N1)C=CC3=CC2=CC=CC(=C2N=C3Cl)C""",21,"""4761C1F35D5E44DE"""
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+"""444A4899515936E1_ED6C53816BE3CC12_6036_UN""","""CC(CCN([S](C(C)(C)C)(=O)=O)CC=C)C1(CN)CCC1""",21,"""4937B25B022B6B0F"""
+"""4F0B80C193025024_4837C6E52906CBE5_6036_UN""","""CC(CCN(C)[S](=O)(=O)CC[S](=O)(=O)C)C1(CN)CCC1""",21,"""4937B25B022B6B0F"""
+"""78439846DAF103EA_46A6B1AF1060B86A_6036_UN""","""CC(CCN(C(C)(C)C)[S](=O)(=O)CCN)C1(CN)CCC1""",21,"""4937B25B022B6B0F"""
+"""6A1CB83E9460181C_A83FDC9EA75F1E6A_6036_UN""","""CC(CCN([S](C)(=O)=O)CCNC1CC1)C2(CN)CCC2""",21,"""4937B25B022B6B0F"""
+"""F3EAA25ADEC26D26_17A399E16E4B9DC2_6036_UN""","""CC(CCN([S](C)(=O)=O)C(=O)CN=[N]#N)C1(CN)CCC1""",21,"""4937B25B022B6B0F"""
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+"""A437259034096E6D_AE597481E9A41070_6036_UN""","""CCC(CN([S](C)(=O)=O)CC1CNCC1)N2CCNCC2""",21,"""49662AA1A325E826"""
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+"""701942366D4BFC9E_5FFF3B0CE5EEDE31_2267_UN""","""OC(=O)C1(CC1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""496E4531621CCCE6"""
+"""BAF60750A8B22BCE_50D26BD9CB445DDD_2267_UN""","""OC(=O)C1(CC1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""496E4531621CCCE6"""
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+"""C521EC60ADB7631B_8E26955812B5992D_2267_UN""","""OC(=O)C1(CC1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""496E4531621CCCE6"""
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+"""7A8DB0C8642AC1A7_3F0A22DE822203EC_2267_UN""","""OC(=O)C1(CC1)C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""496E4531621CCCE6"""
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+"""D4F1FEF7D80D97B5_8332C85CF86DA69D_2267_UN""","""OC(=O)C1(CC1)C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""496E4531621CCCE6"""
+"""0C3E82BEB9B38925_863F5127909AC108_2267_UN""","""OC(=O)C1(CC1)C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""496E4531621CCCE6"""
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+"""324D04FE64708B91_518CCCF182946CDE_2267_UN""","""OC(=O)C1(CC1)C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""496E4531621CCCE6"""
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+"""1918B92CD65CAEA9_C4BDDB2232BB4D47_2267_UN""","""OC(=O)C1(CC1)C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""496E4531621CCCE6"""
+"""2846B1CB9302BAD7_0B0FCFD42523A0F6_2267_UN""","""OC(=O)C1(CC1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""496E4531621CCCE6"""
+"""4AFB33573139D521_4F253871B20D7420_2267_UN""","""OC(=O)C1(CC1)C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""496E4531621CCCE6"""
+"""7FED3D69B30EB0D9_3483B62C5A7D5170_2267_UN""","""OC(=O)C1(CC1)C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""496E4531621CCCE6"""
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+"""5938117C63716142_3306067317E70225_2267_UN""","""OC(=O)C1(CC1)C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""496E4531621CCCE6"""
+"""99BBC74329E2CBD6_6BB4CC29D7BBF730_2267_UN""","""OC(=O)C1(CC1)C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""496E4531621CCCE6"""
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+"""609DB3ED83AB9C64_BDD58EF5150AC614_2267_UN""","""NC1(CCCC1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""4A3F5EE3ECB5470D"""
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+"""858BCFAB424EE0DF_C7F8F4E018CD8CE2_2267_UN""","""NC1(CCCC1)C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""4A3F5EE3ECB5470D"""
+"""476E489F73893D96_A0CE020EAB530F69_2267_UN""","""NC1(CCCC1)C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""4A3F5EE3ECB5470D"""
+"""EAC26CAC8B165ADD_2B4FA9FC2D41C678_2267_UN""","""NC1(CCCC1)C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""4A3F5EE3ECB5470D"""
+"""8F2B5D3389714D1C_DBC4BB7B9B052E2D_2267_UN""","""NC1(CCCC1)C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""4A3F5EE3ECB5470D"""
+"""C5FED35FB2FF1A47_1BCBBAA611D772B6_2267_UN""","""NC1(CCCC1)C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""4A3F5EE3ECB5470D"""
+"""4DC6EF171922821D_5CAE20DE6B4755DA_2267_UN""","""NC1(CCCC1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""4A3F5EE3ECB5470D"""
+"""32C3550FE1459EC6_5383700B45EDD636_2267_UN""","""NC1(CCCC1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""4A3F5EE3ECB5470D"""
+"""8FECCBB7FB52F389_357F4EC0E4F8BB50_2267_UN""","""NC1(CCCC1)C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""4A3F5EE3ECB5470D"""
+"""2BE8487FA7496A90_9FABFE876A3BA1FF_2267_UN""","""NC1(CCCC1)C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""4A3F5EE3ECB5470D"""
+"""0AC0871C9D42C471_7F2FAD8A22D9F921_2267_UN""","""NC1(CCCC1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""4A3F5EE3ECB5470D"""
+"""E52AE0B6201E63CB_1A04627CC94A7F28_2267_UN""","""NC1(CCCC1)C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""4A3F5EE3ECB5470D"""
+"""01234429EEBD8B12_D82E56C222DAB57A_2267_UN""","""NC1(CCCC1)C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""4A3F5EE3ECB5470D"""
+"""200CF40BAC80FC21_66E3692B84D1A2F5_2267_UN""","""NC1(CCCC1)C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""4A3F5EE3ECB5470D"""
+"""CCC237605A333804_4E0878639E94C9F8_2267_UN""","""NC1(CCCC1)C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""4A3F5EE3ECB5470D"""
+"""326CF4638A8A5560_8D778E8A9C1C12C6_2267_UN""","""NC1(CCCC1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""4A3F5EE3ECB5470D"""
+"""849E57DE0EE4A113_5867AC360D548C95_2267_UN""","""NC1(CCCC1)C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""4A3F5EE3ECB5470D"""
+"""F1C0D9BB19B19B31_FBD9E53B83CDEBF9_2267_UN""","""NC1(CCCC1)C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""4A3F5EE3ECB5470D"""
+"""592B6FFF4D6C1AED_D0D6482F7CB3A1DA_2267_UN""","""NC1(CCCC1)C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""4A3F5EE3ECB5470D"""
+"""23151B974C382B64_3C5B390C0C8B8807_2267_UN""","""NC1(CCCC1)C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""4A3F5EE3ECB5470D"""
+"""799B8368428440ED_C6E6223032A3F401_2267_UN""","""NC1(CCCC1)C#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""4A3F5EE3ECB5470D"""
+"""A2B2E0795E8C9A70_608AB655106633C5_2267_UN""","""NC1(CCCC1)C#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""4A3F5EE3ECB5470D"""
+"""490206487C7DD0E6_EAE7875A17E8B891_2267_UN""","""NC1(CCCC1)C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""4A3F5EE3ECB5470D"""
+"""1DB18E430CCD1D22_36714788722342DA_2267_UN""","""NC1(CCCC1)C#CC2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""4A3F5EE3ECB5470D"""
+"""E541AEE7379A0C61_8063D38E76C42D76_2267_UN""","""NC1(CCCC1)C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""4A3F5EE3ECB5470D"""
+"""FEF83C8521A4A7BC_856E4AF51E334AE3_2267_UN""","""NC1(CCCC1)C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""4A3F5EE3ECB5470D"""
+"""273CE8FA36C846B5_7CAB82BDACEBE4C9_2267_UN""","""NC1(CCCC1)C#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""4A3F5EE3ECB5470D"""
+"""E6D139203A4CEF1A_58718667FA45EF41_2267_UN""","""NC1(CCCC1)C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""4A3F5EE3ECB5470D"""
+"""A60614F8F4AAA524_2F193B753D908536_2267_UN""","""NC1(CCCC1)C#CC2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""4A3F5EE3ECB5470D"""
+"""265FF4DB779449B8_F952DF57F54F5C07_2267_UN""","""NC1(CCCC1)C#CC2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""4A3F5EE3ECB5470D"""
+"""C534909A08A5A5FA_DDCD20BFCDB186BC_2267_UN""","""NC1(CCCC1)C#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""4A3F5EE3ECB5470D"""
+"""A70E812B8BDCAF8F_52DDD7230C3DE735_2267_UN""","""NC1(CCCC1)C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""4A3F5EE3ECB5470D"""
+"""1276D210082A8787_1BC8FA928395F826_2267_UN""","""NC1(CCCC1)C#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""4A3F5EE3ECB5470D"""
+"""9FE213647F7B2ECB_C7ECC0F0BC12C6AC_2267_UN""","""NC1(CCCC1)C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""4A3F5EE3ECB5470D"""
+"""8D9F5B3868EEDBBC_085ED406AB8A2B1D_2267_UN""","""NC1(CCCC1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""4A3F5EE3ECB5470D"""
+"""A19F38F71F04431E_4C7423A33CA4FFCB_2267_UN""","""NC1(CCCC1)C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""4A3F5EE3ECB5470D"""
+"""8AF587FFBFD22E3D_37D2ADFED4D4DA9B_2267_UN""","""NC1(CCCC1)C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""4A3F5EE3ECB5470D"""
+"""CE78BFBC77CC201F_05741566AF3BF2C1_2267_UN""","""NC1(CCCC1)C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""4A3F5EE3ECB5470D"""
+"""60CDD0CC256D79D8_30571DA1994E89CE_2267_UN""","""NC1(CCCC1)C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""4A3F5EE3ECB5470D"""
+"""FAE6F5805FD0A5F1_68E5D7FB59127CDB_2267_UN""","""NC1(CCCC1)C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""4A3F5EE3ECB5470D"""
+"""24CCC4A5CACB672C_3083A09547408542_2267_UN""","""NC1(CCCC1)C#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""4A3F5EE3ECB5470D"""
+"""2B134AFA80557797_F8F65947BE9CCA5C_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC(C(OC)=O)N""",21,"""4ABE11505CAC1855"""
+"""396A5958E2640025_86EE56B088B9E846_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3CCNCC3""",21,"""4ABE11505CAC1855"""
+"""8C852A3A02263E20_6A7D2C9889F29248_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3CCCNC3""",21,"""4ABE11505CAC1855"""
+"""9097D85B90131139_F7A7D317E6F9975F_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3NCCNC3""",21,"""4ABE11505CAC1855"""
+"""1BC9C0CE7B07D001_13FB61AA5EADEE41_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC(CC=CC)N""",21,"""4ABE11505CAC1855"""
+"""D2BD8EDEEEB494E4_51914369E6FDB1DB_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC(CC(C)C)N""",21,"""4ABE11505CAC1855"""
+"""47BDF683F96F0741_9147EA3D02B804AA_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3(N)CCCC3""",21,"""4ABE11505CAC1855"""
+"""36108C85F2729B39_12FE642060CBF01B_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)C[C@@H]3CCCNC3""",21,"""4ABE11505CAC1855"""
+"""F482D400BB8387D1_78795FF571C280A5_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)C[C@@H]3CCCCN3""",21,"""4ABE11505CAC1855"""
+"""77E787A9700C9BD5_3B9812F55AAE1A46_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3OCCNC3""",21,"""4ABE11505CAC1855"""
+"""1445B610F7CD7053_FAFD6DBAC34DA293_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CCC3(CNC3)N""",21,"""4ABE11505CAC1855"""
+"""3735AF8F35D95BBD_B8FBAE88728C906A_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC(N)CC(F)F""",21,"""4ABE11505CAC1855"""
+"""605C731077B580BD_DAB0CD39F2C16B03_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)C[C@@H](C(OC)=O)N""",21,"""4ABE11505CAC1855"""
+"""681FE9519FC010D0_3CDF2668C08A83D0_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3COCCN3""",21,"""4ABE11505CAC1855"""
+"""C45706F05FC86F32_86413E3D8346293C_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC(CCN)(C)C""",21,"""4ABE11505CAC1855"""
+"""B5D4B568A1416FEE_0D428991E757DABE_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3(CCNC3)C""",21,"""4ABE11505CAC1855"""
+"""867F62AD41FAF4E1_BDBB632326D85012_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC34CC(N)(C3)C4""",21,"""4ABE11505CAC1855"""
+"""73229671BA09570A_F0E5ABC756C6226D_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CCCNC3CC3""",21,"""4ABE11505CAC1855"""
+"""90B2F14BE964CACA_D2535F8F083D9EF0_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC(=C3CNC3)F""",21,"""4ABE11505CAC1855"""
+"""6E0780051F23B6E3_8183BF53D7D93A7F_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC[C@H]3CCCN3""",21,"""4ABE11505CAC1855"""
+"""994632493DEEBA77_82DED992E4903355_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)C[C@H]3CC[C@@H](N)C3""",21,"""4ABE11505CAC1855"""
+"""6FB1C94102FE3A8E_DF285BADCA4A80C9_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)C[C@H]3COC[C@H]3N""",21,"""4ABE11505CAC1855"""
+"""78441B0CA2DD727F_9C0FBF1FFD99D77A_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)C[C@H]3CCC[C@H]3N""",21,"""4ABE11505CAC1855"""
+"""6A0C0A0203109C5D_B825CC33F08E7822_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3C(CN3)(C)C""",21,"""4ABE11505CAC1855"""
+"""35813F5CAE811720_C468604FA4815597_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CCCNC(C)C""",21,"""4ABE11505CAC1855"""
+"""7BB812FC027EAED5_6CB37EA3BC600277_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CCC3(CN)CC3""",21,"""4ABE11505CAC1855"""
+"""1BB9F9A6FAF57A45_7F075B1012735C1D_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC(C(C)C)ON""",21,"""4ABE11505CAC1855"""
+"""0B0CF4B29D923530_579BA1107A69115B_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC(C(C)C)CN""",21,"""4ABE11505CAC1855"""
+"""DCE1D8B0708D9A92_67A9B0A98904C776_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3=CNCCO3""",21,"""4ABE11505CAC1855"""
+"""5A024F0839F5B914_5FF65F3251D943CE_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3=CNCCC3""",21,"""4ABE11505CAC1855"""
+"""128DDCCCA11C55A5_32CB82498BA2C0CF_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CCC3CC(N)C3""",21,"""4ABE11505CAC1855"""
+"""3853787150034716_541E417F4679D18C_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)C[C@@H]3COCCN3""",21,"""4ABE11505CAC1855"""
+"""BCF9D993625EB5DE_AB1AC5BCC7507494_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CCCC(CC)N""",21,"""4ABE11505CAC1855"""
+"""D9975C87E152CE13_BDEFEED373B0A081_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3(CN)COC3""",21,"""4ABE11505CAC1855"""
+"""786D33859114C3FA_96F1624E3D6A1441_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CCCCCCN""",21,"""4ABE11505CAC1855"""
+"""FA8E33019B391E44_9D643FE3875D0297_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3[C@@H]4CNC[C@H]34""",21,"""4ABE11505CAC1855"""
+"""1B9029284F29AED5_45B0A1F8D8553DB5_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3(CNC3)C#N""",21,"""4ABE11505CAC1855"""
+"""E6821C40DE0B7402_50D82060D03EB9A3_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)C[C@@H]3C[C@H](N)C=C3""",21,"""4ABE11505CAC1855"""
+"""E99AF27E716E5E37_19D2808A0CE297C7_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)C[C@H]3CCCNC3""",21,"""4ABE11505CAC1855"""
+"""A25D315E50C0AC84_B0AE04F0CE1B387D_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CC3CC(NC)C3""",21,"""4ABE11505CAC1855"""
+"""6A22C204ADA543EB_E011F44A627463B0_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)CCC3CCNC3""",21,"""4ABE11505CAC1855"""
+"""B4E00121E81BD508_0B4AB9D29619DBE2_6031_DP""","""O(C(=O)C[C@@H]1C[S](=O)(=O)[C@H]2CNC[C@@H]12)C[C@@H]3OCCNC3""",21,"""4ABE11505CAC1855"""
+"""E5A10F5565A60DED_F8B2574D8FC54CB8_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC(C(OC)=O)N""",21,"""4AFA1F5A6DF59EB1"""
+"""2C2F9F44878ED9F9_86AA58BAB9E06EA2_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3CCNCC3""",21,"""4AFA1F5A6DF59EB1"""
+"""B497E9A73D1FB877_6A392292B8AB14AC_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3CCCNC3""",21,"""4AFA1F5A6DF59EB1"""
+"""2E0CD6FCAD68FE9C_F7E3DD1DD7A011BB_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3NCCNC3""",21,"""4AFA1F5A6DF59EB1"""
+"""1D0E0344EF769E0E_13BF6FA06FF468A5_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC(CC=CC)N""",21,"""4AFA1F5A6DF59EB1"""
+"""CB9551AC458D8963_51D54D63D7A4373F_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC(CC(C)C)N""",21,"""4AFA1F5A6DF59EB1"""
+"""F3C4D7A84EC087A8_9103E43733E1824E_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3(N)CCCC3""",21,"""4AFA1F5A6DF59EB1"""
+"""A246112E7EF4203B_12BA6A2A519276FF_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)C[C@@H]3CCCNC3""",21,"""4AFA1F5A6DF59EB1"""
+"""4AA90BC855C67ABF_783D51FF409B0641_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)C[C@@H]3CCCCN3""",21,"""4AFA1F5A6DF59EB1"""
+"""67800251B9C13B1D_3BDC1CFF6BF79CA2_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3OCCNC3""",21,"""4AFA1F5A6DF59EB1"""
+"""9F3A4B1017A3D163_FAB963B0F2142477_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CCC3(CNC3)N""",21,"""4AFA1F5A6DF59EB1"""
+"""856E71A94CE83BDF_B8BFA08243D5168E_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC(N)CC(F)F""",21,"""4AFA1F5A6DF59EB1"""
+"""F8D9789FEF5DB232_DAF4C333C398EDE7_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)C[C@@H](C(OC)=O)N""",21,"""4AFA1F5A6DF59EB1"""
+"""1D22333F3D22BD09_3C9B2862F1D30534_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3COCCN3""",21,"""4AFA1F5A6DF59EB1"""
+"""050784708D1D8B2B_86053037B21FAFD8_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC(CCN)(C)C""",21,"""4AFA1F5A6DF59EB1"""
+"""DE42C6B286F870E0_0D06879BD60E5C5A_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3(CCNC3)C""",21,"""4AFA1F5A6DF59EB1"""
+"""37ED19EC5A014C3F_BDFF6D291781D6F6_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC34CC(N)(C3)C4""",21,"""4AFA1F5A6DF59EB1"""
+"""4E973A6E24B4F132_F0A1A5CD679FA489_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CCCNC3CC3""",21,"""4AFA1F5A6DF59EB1"""
+"""4130DD6EE697809A_D217518539641814_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC(=C3CNC3)F""",21,"""4AFA1F5A6DF59EB1"""
+"""D65267B61899549D_81C7B159E680BC9B_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC[C@H]3CCCN3""",21,"""4AFA1F5A6DF59EB1"""
+"""CE841962FB4AC4EF_829AD798D5C9B5B1_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)C[C@H]3CC[C@@H](N)C3""",21,"""4AFA1F5A6DF59EB1"""
+"""A433E6BECDAE0B2D_DF6C55A7FB13062D_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)C[C@H]3COC[C@H]3N""",21,"""4AFA1F5A6DF59EB1"""
+"""8F47F0F25342017B_9C4BB115CCC0519E_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)C[C@H]3CCC[C@H]3N""",21,"""4AFA1F5A6DF59EB1"""
+"""D97091FF21DCF063_B861C239C1D7FEC6_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3C(CN3)(C)C""",21,"""4AFA1F5A6DF59EB1"""
+"""4E9C27444E5AC992_C42C6E4595D8D373_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CCCNC(C)C""",21,"""4AFA1F5A6DF59EB1"""
+"""07D3252288F3F72E_6CF770A98D398493_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CCC3(CN)CC3""",21,"""4AFA1F5A6DF59EB1"""
+"""48E2E18CC2CDE17E_7F43551A232ADAF9_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC(C(C)C)ON""",21,"""4AFA1F5A6DF59EB1"""
+"""9739844E65A5DAF3_57DFAF1A4B3097BF_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC(C(C)C)CN""",21,"""4AFA1F5A6DF59EB1"""
+"""A774F00367545C0D_67EDBEA3B85D4192_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3=CNCCO3""",21,"""4AFA1F5A6DF59EB1"""
+"""EFFFBD78D5CC6443_5FB251386080C52A_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3=CNCCC3""",21,"""4AFA1F5A6DF59EB1"""
+"""AF377719E28443F4_328F8C43BAFB462B_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CCC3CC(N)C3""",21,"""4AFA1F5A6DF59EB1"""
+"""0CFF02407B96D874_545A4F7577205768_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)C[C@@H]3COCCN3""",21,"""4AFA1F5A6DF59EB1"""
+"""5B5BE53EA4640553_AB5ECBB6F609F270_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CCCC(CC)N""",21,"""4AFA1F5A6DF59EB1"""
+"""4C0744FDE0FB434B_BDABE0D942E92665_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3(CN)COC3""",21,"""4AFA1F5A6DF59EB1"""
+"""6E0C9A25C5F6B080_96B56C440C3392A5_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CCCCCCN""",21,"""4AFA1F5A6DF59EB1"""
+"""217A84C2B979CA09_9D2031E9B6048473_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3[C@@H]4CNC[C@H]34""",21,"""4AFA1F5A6DF59EB1"""
+"""932731ED93EE5BD8_45F4AFF2E90CBB51_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3(CNC3)C#N""",21,"""4AFA1F5A6DF59EB1"""
+"""B008C72DFC365658_509C2E6AE1673F47_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)C[C@@H]3C[C@H](N)C=C3""",21,"""4AFA1F5A6DF59EB1"""
+"""FCF90596F91EF642_19968E803DBB1123_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)C[C@H]3CCCNC3""",21,"""4AFA1F5A6DF59EB1"""
+"""A59559C67246B202_B0EA0AFAFF42BE99_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CC3CC(NC)C3""",21,"""4AFA1F5A6DF59EB1"""
+"""D1284F0E39160854_E055FA40532DE554_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)CCC3CCNC3""",21,"""4AFA1F5A6DF59EB1"""
+"""6558446D10B8DCC5_0B0EB7D8A7405D06_6031_DP""","""O(C(=O)C2=C1OCCNCC1=CC=C2)C[C@@H]3OCCNC3""",21,"""4AFA1F5A6DF59EB1"""
+"""DF72DB66047E21F4_F9C661EA7F2C6C8E_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)CC(C(OC)=O)N""",21,"""4B8E29FD9D1CBE87"""
+"""9EF02A3164411F56_87DE6E1D49094E94_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)CC2CCNCC2""",21,"""4B8E29FD9D1CBE87"""
+"""ECFE27A314E27884_6B4D14354842349A_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)CC2CCCNC2""",21,"""4B8E29FD9D1CBE87"""
+"""0FBEB4110E06E962_F697EBBA2749318D_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)CC2NCCNC2""",21,"""4B8E29FD9D1CBE87"""
+"""FED1117607EF5DB2_12CB59079F1D4893_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)CC(CC=CC)N""",21,"""4B8E29FD9D1CBE87"""
+"""BEFF66B12D122F23_50A17BC4274D1709_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)CC(CC(C)C)N""",21,"""4B8E29FD9D1CBE87"""
+"""2FB5F9A4433663E1_9077D290C308A278_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)CC2(N)CCCC2""",21,"""4B8E29FD9D1CBE87"""
+"""2D1A70D53AB8B68F_13CE5C8DA17B56C9_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)C[C@@H]2CCCNC2""",21,"""4B8E29FD9D1CBE87"""
+"""8082EE02DD15F322_79496758B0722677_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)C[C@@H]2CCCCN2""",21,"""4B8E29FD9D1CBE87"""
+"""90E4C7282550D6B9_3AA82A589B1EBC94_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)CC2OCCNC2""",21,"""4B8E29FD9D1CBE87"""
+"""DCBE1EF6514E054D_FBCD551702FD0441_6031_DP""","""O(C(=O)C(CN1C=CC(=O)NC1=O)N)CCC2(CNC2)N""",21,"""4B8E29FD9D1CBE87"""
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+"""F935186C1C05A1A2_B92C111354E1BC4B_1171_UN""","""COCCC1=NC(=CS1)C2=CC=C(NC(CCC)=O)C=C2""",21,"""4BD66CBE75666D50"""
+"""10AD7B1AF8A022E5_9443E520E9320A45_1171_UN""","""COCCC1=NC(=CS1)C2=C([N](CCCOC)C(=C2)C)C""",21,"""4BD66CBE75666D50"""
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+"""163B63A3852E113D_660F706F10F1B92B_1171_UN""","""COCCC1=NC(=CS1)C2=CC=C(CCCCCC)C=C2""",21,"""4BD66CBE75666D50"""
+"""7BE201511163521D_0E27ADAA7CE3995C_1171_UN""","""COCCC1=NC(=C(C)S1)C2=C(C(=C(C)[NH]2)C(OC)=O)C""",21,"""4BD66CBE75666D50"""
+"""D0248FC238A0CDA8_33D9A920EEC89296_1171_UN""","""COCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NC=N[NH]3""",21,"""4BD66CBE75666D50"""
+"""564FC480894ADC71_FDA1D49A7315D2D4_1171_UN""","""COCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NOC=C3""",21,"""4BD66CBE75666D50"""
+"""A759C8BF40C25AC4_C1BB8E193A806A96_1171_UN""","""COCCC1=NC(=CS1)C2=CC(=C(C=C2)OC(F)F)OC""",21,"""4BD66CBE75666D50"""
+"""D1843674EFFBD20F_2C2E8547D3B1BAD5_1171_UN""","""COCCC1=NC(=CS1)C2=CC=C(CCN[S](C)(=O)=O)S2""",21,"""4BD66CBE75666D50"""
+"""C7149F17F0357550_D8804F2C6A5CBD22_1171_UN""","""COCCC1=NC(=CS1)C2=C(C(=C(C)[NH]2)C(OCC)=O)C""",21,"""4BD66CBE75666D50"""
+"""5329AFCA5D18A0A1_D41C61985CA3586C_1171_UN""","""COCCC1=NC(=CS1)C2=CC=C(C(C)NC(=O)C)C=C2""",21,"""4BD66CBE75666D50"""
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+"""8BA3AB62798DB2DB_360382E7E014A9AC_1171_UN""","""COCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)CC(F)(F)F""",21,"""4BD66CBE75666D50"""
+"""FCE02942E886B2AA_082C1EE7075431DB_1171_UN""","""COCCC1=NC(=CS1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""4BD66CBE75666D50"""
+"""92DF4DAD4F2F6485_60A3DDE8DC4246E8_1171_UN""","""COCCC1=NC(=CS1)C2=CC=C(NC(C(C)C)=O)C=C2""",21,"""4BD66CBE75666D50"""
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+"""E84B1A1FFBF46AA8_79847502D2C639A8_1171_UN""","""COCCC1=NC(=CS1)C3=CC2=C(NC(C2(C)C)=O)C=C3""",21,"""4BD66CBE75666D50"""
+"""04B89A09932C73C5_4F1429BB24C9EB52_1171_UN""","""COCCC1=NC(=CS1)C2=CC(=C(SC)C=C2)NC(=O)C""",21,"""4BD66CBE75666D50"""
+"""6E57BFB4D525DF5A_ABB5B3E658FF329B_1171_UN""","""COCCC1=NC(=CS1)C2=CC=C(N(C)[S](=O)(=O)C)C=C2""",21,"""4BD66CBE75666D50"""
+"""D468845AD46C0BCF_CAAFAE8572FC782A_1171_UN""","""COCCC1=NC(=CS1)C3=CC2=C(N(C)C(=O)CC2)C=C3""",21,"""4BD66CBE75666D50"""
+"""5E9F8729A95BAD21_4BF8882695B7B7FA_1171_UN""","""COCCC1=NC(=CS1)C3=C[N](C2=CC=CC(=C2)C)N=N3""",21,"""4BD66CBE75666D50"""
+"""172AB43B57F9CE86_7BD1151135BEC22E_1171_UN""","""COCCC1=NC(=CS1)C3=CC2=C(CCN(C(C)=O)C2)S3""",21,"""4BD66CBE75666D50"""
+"""4B31AF8E30C4CCCE_9BBA129F196844FD_1171_UN""","""COCCC1=NC(=CS1)C2=CC3=C(C=C2)NC(N(C)C3)=O""",21,"""4BD66CBE75666D50"""
+"""118EE1B00FF4AA35_34A110D234214DB2_1171_UN""","""COCCC1=NC(=CS1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""4BD66CBE75666D50"""
+"""B06198C6E34740C0_EBDBB2E980B319C6_1171_UN""","""COCCC1=NC(=CS1)C3=C2OCC(C2=C(OC)C=C3)=O""",21,"""4BD66CBE75666D50"""
+"""C9E56E45A194BAAC_0E6CBFA2A1763D79_1171_UN""","""COCCC1=NC(=CS1)C2=CC=C([S](N(C)C)(=O)=O)C=C2""",21,"""4BD66CBE75666D50"""
+"""9241DD8A55F421A3_10269A1EE6DAD562_1171_UN""","""COCCC1=NC(=CS1)C2(NC(C(F)(F)F)=O)CCCC2""",21,"""4BD66CBE75666D50"""
+"""D4F09C629755E1D2_07A521FDCD83E17B_1171_UN""","""COCCC1=NC(=CS1)C3=C[N](C2=CC=C(F)C=C2)N=N3""",21,"""4BD66CBE75666D50"""
+"""AEA0A35FC06E6AFF_8033F4EFFDFD1AD1_1171_UN""","""COCCC1=NC(=CS1)C2CCN(C(C(F)(F)F)=O)CC2""",21,"""4BD66CBE75666D50"""
+"""D90DD3DE15F7CFAF_837AF4D7F2A3DD63_1171_UN""","""COCCC1=NC(=CS1)C2=CC(=C(C(=C2)OC)OC)OC""",21,"""4BD66CBE75666D50"""
+"""7B8E2A63A21A4E37_3746171A344B7F7F_1171_UN""","""COCCC1=NC(=CS1)C2=CC(=C(C=C2)NC(=O)C)SC""",21,"""4BD66CBE75666D50"""
+"""6E498C21B0051A44_1B007F8B4DBF81C0_1171_UN""","""COCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NC=CS3""",21,"""4BD66CBE75666D50"""
+"""E291CB77639BDA96_63EDCFB4AF932B43_1171_UN""","""COCCC1=NC(=CS1)C2=C([NH]C(=C2C)C(OCC)=O)C""",21,"""4BD66CBE75666D50"""
+"""250F9C3B826D419A_11057099EA8B9788_1171_UN""","""COCCC1=NC(=CS1)C2=CC=C(CCNC(C)=O)C=C2""",21,"""4BD66CBE75666D50"""
+"""1A0C07600D981E37_BD4598E234485B65_1171_UN""","""COCCC1=NC(=CS1)C2=CC=C(CN(C)C(=O)C)C=C2""",21,"""4BD66CBE75666D50"""
+"""9762E31F098FAC58_06C35A5C70EF970B_1171_UN""","""COCCC1=NC(=CS1)C2=CC(=NO2)C3=CC=C(F)C=C3""",21,"""4BD66CBE75666D50"""
+"""1569431F9C3BC2C7_47DC1C40A84F38C9_1171_UN""","""COCCC2=NC(=C(CC1=CC=CC=C1)S2)C(OCC)=O""",21,"""4BD66CBE75666D50"""
+"""D648E0DBAB64F5AE_B3FBCBC9CD323837_1171_UN""","""COCCC1=NC(=CS1)C2=C([N](CC(OC)=O)C(=C2)C)C""",21,"""4BD66CBE75666D50"""
+"""366852253C5C0479_B7B1E8331D178005_1171_UN""","""COCCC1=NC(=CS1)C2=CC=CC(=C2)[S](N(C)C)(=O)=O""",21,"""4BD66CBE75666D50"""
+"""97663109A9CD4CA2_DA08CAA2115246CC_1171_UN""","""COCCC1=NC(=CS1)C2=C([N](C(COC)C)C(=C2)C)C""",21,"""4BD66CBE75666D50"""
+"""A3C6262BF42F86DD_B81AE7C2884B1744_1171_UN""","""COCCC1=NC(=CS1)C2=C(C)[N](N=C2)C3=CC=CC=C3""",21,"""4BD66CBE75666D50"""
+"""0109FE13F1EA56AE_A00F6219DA2D9376_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](CC)(=O)=O)CC(=O)OC""",21,"""4BDB2AD1A33F0DF9"""
+"""8E7119F5849901B8_8352D7BD65EE7BEB_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""4BDB2AD1A33F0DF9"""
+"""6C8D182470EC5521_A925F8C4B765664D_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""4BDB2AD1A33F0DF9"""
+"""92D818569192A7E0_FB90EF2D7BFDD3D2_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""4BDB2AD1A33F0DF9"""
+"""C62E70D7CC580A83_9ADB3C8ECBE6B028_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2CCCNC2""",21,"""4BDB2AD1A33F0DF9"""
+"""FBEAB0977C9B97DB_ACD900A4F987FC9A_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C)[S](=O)(=O)CC2CCCN2""",21,"""4BDB2AD1A33F0DF9"""
+"""2625EEE707BAAD3B_88064319523C8C8C_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""4BDB2AD1A33F0DF9"""
+"""5221AF042EEB5DEC_4722760D1361452C_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C)(=O)=O)C2CCCNC2""",21,"""4BDB2AD1A33F0DF9"""
+"""4AF006B1C2BDCE89_92657194E0E7F866_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""4BDB2AD1A33F0DF9"""
+"""6FCE4751D87CF061_2A2345317637851D_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(CC)[S](=O)(=O)C2CCNC2""",21,"""4BDB2AD1A33F0DF9"""
+"""1C5D5B689804CFF6_EF80CB0BCAF7AAE4_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""4BDB2AD1A33F0DF9"""
+"""4DE12C1ECFCF70F7_4ADB5E6F8812AD13_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""4BDB2AD1A33F0DF9"""
+"""062BC368EFBDF6BC_444A2925B174DE9C_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""4BDB2AD1A33F0DF9"""
+"""20EF92F1458DDCD5_AAD34414064B789C_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C)(=O)=O)CCNC2CC2""",21,"""4BDB2AD1A33F0DF9"""
+"""6141967108178F66_154F016BCF5FFB34_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""4BDB2AD1A33F0DF9"""
+"""1AAF6C03F532F1E4_A2C1F1188D231D3D_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2CCNCC2""",21,"""4BDB2AD1A33F0DF9"""
+"""89A1606AA52BD167_0C53925857341292_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""4BDB2AD1A33F0DF9"""
+"""C3442638FE175FE3_147743B465F1DE25_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""4BDB2AD1A33F0DF9"""
+"""96C618A824BC7218_F43B0AE238535D49_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""4BDB2AD1A33F0DF9"""
+"""A205684E4414EE20_B855B7E10455016D_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C)(=O)=O)C2CCNCC2""",21,"""4BDB2AD1A33F0DF9"""
+"""11B425583FF8B3B2_C74E62A09B71CC03_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""4BDB2AD1A33F0DF9"""
+"""33BD84D3D098EC8D_173131A2C15EE4E5_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""4BDB2AD1A33F0DF9"""
+"""A5FBD96FE081BE8C_C500E2F0A9F244ED_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""4BDB2AD1A33F0DF9"""
+"""0B317428775E3383_7E513B6BA1656BA9_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""4BDB2AD1A33F0DF9"""
+"""2DE637FE8EFF067B_8CF06078E97EB593_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""4BDB2AD1A33F0DF9"""
+"""40136D48C0012C2A_ACE474F1E9BEF5AF_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C)(=O)=O)CC2CNCC2""",21,"""4BDB2AD1A33F0DF9"""
+"""8E011C2607A7780E_9098CFE7BE4B5A19_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""4BDB2AD1A33F0DF9"""
+"""CFA31109569EF470_99D0D27EC34D2B66_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""4BDB2AD1A33F0DF9"""
+"""533EE4BA12C9A62A_3BE50BA6BE9A83ED_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""4BDB2AD1A33F0DF9"""
+"""73ACD3C9372C33EF_2AF1D885ADEFB0D9_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""4BDB2AD1A33F0DF9"""
+"""53624A28F936211F_DF47E6A957745EE2_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(CCCN)[S](=O)(=O)C2CC2""",21,"""4BDB2AD1A33F0DF9"""
+"""957977F801525DCA_E343D2B01F63488C_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2CCCC(CC=C)[S]2(=O)=O""",21,"""4BDB2AD1A33F0DF9"""
+"""93AB562EDFE81ED4_0A35E8970E4D82D3_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(CCCN)[S](=O)(=O)C(F)F""",21,"""4BDB2AD1A33F0DF9"""
+"""41ACDEB23B855124_F935427A94526D07_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""4BDB2AD1A33F0DF9"""
+"""1E3FD750805F9327_F05B52996D47F2B8_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2CCCCNCC[S]2(=O)=O""",21,"""4BDB2AD1A33F0DF9"""
+"""8FE98DB243720AA1_8403953A6E6E2E10_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""4BDB2AD1A33F0DF9"""
+"""2F50387EA9703431_6BD8652EB802E166_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""4BDB2AD1A33F0DF9"""
+"""10DC052269EB5B1F_CC264A667BA5F27C_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""4BDB2AD1A33F0DF9"""
+"""C88CA609FC1C05AE_F461BB37A314E073_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""4BDB2AD1A33F0DF9"""
+"""99699232A77E685C_5E3FB93D7AC98DD5_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""4BDB2AD1A33F0DF9"""
+"""B4AAA02AFBEBB27D_FA9D3FE524A564AE_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""4BDB2AD1A33F0DF9"""
+"""610D924D3BE4A672_EAD1E1997DA2AF4B_6036_UN""","""C(C1NCCC1)(C(F)(F)F)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""4BDB2AD1A33F0DF9"""
+"""C4FDA35842458777_B9C410446567CCED_2267_UN""","""OC(=O)CNCC#CC1=CC=C(C(CCC(O)=O)=O)C=C1""",21,"""4E2EC0529CD84DF4"""
+"""BDEC6C734CD22A03_271799128A909BBE_2267_UN""","""OC(=O)CNCC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O""",21,"""4E2EC0529CD84DF4"""
+"""5D5B0A532BEC835C_C3E96A5168A0861B_2267_UN""","""OC(=O)CNCC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""4E2EC0529CD84DF4"""
+"""ECFBB66B2744094C_A4DF9CBFDB3E0590_2267_UN""","""OC(=O)CNCC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""4E2EC0529CD84DF4"""
+"""92D0F1015F89F405_2F5E374D5D2CCC81_2267_UN""","""OC(=O)CNCC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""4E2EC0529CD84DF4"""
+"""4224B4E3BC737F00_DFD525CAEB6824D4_2267_UN""","""OC(=O)CNCC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""4E2EC0529CD84DF4"""
+"""D0D1E88CAC76C18C_1FDA241761BA784F_2267_UN""","""OC(=O)CNCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""4E2EC0529CD84DF4"""
+"""EFAF9DA0DA81A0EC_58BFBE6F1B2A5F23_2267_UN""","""OC(=O)CNCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""4E2EC0529CD84DF4"""
+"""EA976BC315CC1038_5792EEBA3580DCCF_2267_UN""","""OC(=O)CNCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""4E2EC0529CD84DF4"""
+"""E38B7174FFD45E11_316ED0719495B1A9_2267_UN""","""OC(=O)CNCC#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""4E2EC0529CD84DF4"""
+"""BE203255DC430396_9BBA60361A56AB06_2267_UN""","""OC(=O)CNCC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""4E2EC0529CD84DF4"""
+"""118C54B54810CCA4_7B3E333B52B4F3D8_2267_UN""","""OC(=O)CNCC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""4E2EC0529CD84DF4"""
+"""D3AECBC909EE3704_1E15FCCDB92775D1_2267_UN""","""OC(=O)CNCC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""4E2EC0529CD84DF4"""
+"""7CEC7F254AFE4F28_DC3FC87352B7BF83_2267_UN""","""OC(=O)CNCC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2""",21,"""4E2EC0529CD84DF4"""
+"""E27EEB05CD92F8B3_62F2F79AF4BCA80C_2267_UN""","""OC(=O)CNCC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""4E2EC0529CD84DF4"""
+"""DC9796EA0E6247B2_4A19E6D2EEF9C301_2267_UN""","""OC(=O)CNCC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""4E2EC0529CD84DF4"""
+"""151480EA718F0C64_8966103BEC71183F_2267_UN""","""OC(=O)CNCC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""4E2EC0529CD84DF4"""
+"""6EDA71BA6894192C_5C7632877D39866C_2267_UN""","""OC(=O)CNCC#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""4E2EC0529CD84DF4"""
+"""7C88E8F5743B4367_FFC87B8AF3A0E100_2267_UN""","""OC(=O)CNCC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""4E2EC0529CD84DF4"""
+"""C41EBCFD9294F396_D4C7D69E0CDEAB23_2267_UN""","""OC(=O)CNCC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""4E2EC0529CD84DF4"""
+"""76AF7294C0DD9405_384AA7BD7CE682FE_2267_UN""","""OC(=O)CNCC#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""4E2EC0529CD84DF4"""
+"""F56E8AFDA25FF484_C2F7BC8142CEFEF8_2267_UN""","""OC(=O)CNCC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""4E2EC0529CD84DF4"""
+"""DAA26B7546BB09E0_649B28E4600B393C_2267_UN""","""OC(=O)CNCC#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""4E2EC0529CD84DF4"""
+"""AE38EBA46380F0BD_EEF619EB6785B268_2267_UN""","""OC(=O)CNCC#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""4E2EC0529CD84DF4"""
+"""240127F466B6041B_3260D939024E4823_2267_UN""","""OC(=O)CNCC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""4E2EC0529CD84DF4"""
+"""1B485FE224EDAB74_84724D3F06A9278F_2267_UN""","""OC(=O)CNCC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""4E2EC0529CD84DF4"""
+"""FBB7C6AEE0C108AE_817FD4446E5E401A_2267_UN""","""OC(=O)CNCC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""4E2EC0529CD84DF4"""
+"""3D66C77302611B07_78BA1C0CDC86EE30_2267_UN""","""OC(=O)CNCC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""4E2EC0529CD84DF4"""
+"""0E79E5E07F32EAC0_5C6018D68A28E5B8_2267_UN""","""OC(=O)CNCC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""4E2EC0529CD84DF4"""
+"""76607282D397232C_2B08A5C44DFD8FCF_2267_UN""","""OC(=O)CNCC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""4E2EC0529CD84DF4"""
+"""D15E53572DEC683B_FD4341E6852256FE_2267_UN""","""OC(=O)CNCC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""4E2EC0529CD84DF4"""
+"""17059593FFABD8B3_D9DCBE0EBDDC8C45_2267_UN""","""OC(=O)CNCC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""4E2EC0529CD84DF4"""
+"""333516F9B81D0000_56CC49927C50EDCC_2267_UN""","""OC(=O)CNCC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""4E2EC0529CD84DF4"""
+"""34054436F7BCE267_1FD96423F3F8F2DF_2267_UN""","""OC(=O)CNCC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""4E2EC0529CD84DF4"""
+"""6E75A0B1FC8FB070_C3FD5E41CC7FCC55_2267_UN""","""OC(=O)CNCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""4E2EC0529CD84DF4"""
+"""DCF4B16478429F46_0C4F4AB7DBE721E4_2267_UN""","""OC(=O)CNCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""4E2EC0529CD84DF4"""
+"""85E9E11906DEBA24_4865BD124CC9F532_2267_UN""","""OC(=O)CNCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""4E2EC0529CD84DF4"""
+"""1D8B59460FAD8518_33C3334FA4B9D062_2267_UN""","""OC(=O)CNCC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""4E2EC0529CD84DF4"""
+"""677324B6594ADBF0_01658BD7DF56F838_2267_UN""","""OC(=O)CNCC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""4E2EC0529CD84DF4"""
+"""05AFD6042CD43FF5_34468310E9238337_2267_UN""","""OC(=O)CNCC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""4E2EC0529CD84DF4"""
+"""66FF8062E6724F7D_6CF4494A297F7622_2267_UN""","""OC(=O)CNCC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""4E2EC0529CD84DF4"""
+"""A708545A885DB2C7_34923E24372D8FBB_2267_UN""","""OC(=O)CNCC#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""4E2EC0529CD84DF4"""
+"""02C37A65894DFC68_A7A95920D96A80DC_2267_UN""","""C(#CC1CCCOC1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""5043893620D501C5"""
+"""DEC973369E83D636_397AD076369DD78F_2267_UN""","""C(#CC1CCCOC1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""5043893620D501C5"""
+"""19A216C42E419784_DD842335D4ADCA2A_2267_UN""","""C(#CC1CCCOC1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""5043893620D501C5"""
+"""1198D0A7257A6B2E_BAB2D5DB673349A1_2267_UN""","""C(#CC1CCCOC1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""5043893620D501C5"""
+"""8228011D8AA772C3_31337E29E12180B0_2267_UN""","""C(#CC1CCCOC1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""5043893620D501C5"""
+"""447B9956797047E5_C1B86CAE576568E5_2267_UN""","""C(#CC1CCCOC1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""5043893620D501C5"""
+"""2CFA92DB13C2812D_01B76D73DDB7347E_2267_UN""","""C(#CC1CCCOC1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""5043893620D501C5"""
+"""E3FA753B25252B68_46D2F70BA7271312_2267_UN""","""C(#CC1CCCOC1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""5043893620D501C5"""
+"""4A1E202DB6C508CD_49FFA7DE898D90FE_2267_UN""","""C(#CC1CCCOC1)C2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""5043893620D501C5"""
+"""08CA9CB2A9EC4857_2F0399152898FD98_2267_UN""","""C(#CC1CCCOC1)C2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""5043893620D501C5"""
+"""26B61AD1EBBE15B4_85D72952A65BE737_2267_UN""","""C(#CC1CCCOC1)C2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""5043893620D501C5"""
+"""EE704DA37F43F231_65537A5FEEB9BFE9_2267_UN""","""C(#CC1CCCOC1)C2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""5043893620D501C5"""
+"""F764841BC8C882C0_0078B5A9052A39E0_2267_UN""","""C(#CC1CCCOC1)C2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""5043893620D501C5"""
+"""D6D3E29037D37881_C2528117EEBAF3B2_2267_UN""","""C(#CC1CCCOC1)C3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""5043893620D501C5"""
+"""AD0DC1D5C3444B3C_7C9FBEFE48B1E43D_2267_UN""","""C(#CC1CCCOC1)C2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""5043893620D501C5"""
+"""70130BE652E4D456_5474AFB652F48F30_2267_UN""","""C(#CC1CCCOC1)C2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""5043893620D501C5"""
+"""DDE7966F0EF88AE9_970B595F507C540E_2267_UN""","""C(#CC1CCCOC1)C2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""5043893620D501C5"""
+"""9A85787FD7EA639E_421B7BE3C134CA5D_2267_UN""","""C(#CC1CCCOC1)C3=CC=C(CC2(C)NCCC2)C=C3""",21,"""5043893620D501C5"""
+"""25ECF604F459B0E0_E1A532EE4FADAD31_2267_UN""","""C(#CC1CCCOC1)C2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""5043893620D501C5"""
+"""78E490ACA46A6F59_CAAA9FFAB0D3E712_2267_UN""","""C(#CC1CCCOC1)C2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""5043893620D501C5"""
+"""6851836C100B8FE1_2627EED9C0EBCECF_2267_UN""","""C(#CC1CCCOC1)C2=CC=C(C=C2)C3NCCNC3=O""",21,"""5043893620D501C5"""
+"""FAEABC86B74034BB_DC9AF5E5FEC3B2C9_2267_UN""","""C(#CC1CCCOC1)C2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""5043893620D501C5"""
+"""FC590138A6C157D6_7AF66180DC06750D_2267_UN""","""C(#CC1CCCOC1)C(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""5043893620D501C5"""
+"""D41E55B395E8AC90_F09B508FDB88FE59_2267_UN""","""C(#CC1CCCOC1)C2=C[N](CC(OCC)OCC)N=C2""",21,"""5043893620D501C5"""
+"""AAF9B62A346960B2_2C0D905DBE430412_2267_UN""","""C(#CC1CCCOC1)C2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""5043893620D501C5"""
+"""D4689602D9DE4638_9A1F045BBAA46BBE_2267_UN""","""C(#CC1CCCOC1)C2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""5043893620D501C5"""
+"""AABFAFA7EB88B77E_9F129D20D2530C2B_2267_UN""","""C(#CC1CCCOC1)C3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""5043893620D501C5"""
+"""438CCB97C094B9AD_66D75568608BA201_2267_UN""","""C(#CC1CCCOC1)C2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""5043893620D501C5"""
+"""93BC1E965C6D240D_420D51B23625A989_2267_UN""","""C(#CC1CCCOC1)C2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""5043893620D501C5"""
+"""3FF95A1250B95242_3565ECA0F1F0C3FE_2267_UN""","""C(#CC1CCCOC1)C2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""5043893620D501C5"""
+"""CC9002A0449A4F61_E32E0882392F1ACF_2267_UN""","""C(#CC1CCCOC1)C2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""5043893620D501C5"""
+"""F8C315FB41A450B9_C7B1F76A01D1C074_2267_UN""","""C(#CC1CCCOC1)C2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""5043893620D501C5"""
+"""C469147F858172A3_48A100F6C05DA1FD_2267_UN""","""C(#CC1CCCOC1)C2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""5043893620D501C5"""
+"""5E1384D7AB48B415_01B42D474FF5BEEE_2267_UN""","""C(#CC1CCCOC1)C2=CC=C(C=C2)CN3CCCCC3""",21,"""5043893620D501C5"""
+"""B56451C3E2140613_DD90172570728064_2267_UN""","""C(#CC1CCCOC1)C2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""5043893620D501C5"""
+"""A61E1B2C6D56C7E7_122203D367EA6DD5_2267_UN""","""C(#CC1CCCOC1)C2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""5043893620D501C5"""
+"""6D35B8DA9C84EFD0_5608F476F0C4B903_2267_UN""","""C(#CC1CCCOC1)C2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""5043893620D501C5"""
+"""59E409721C4E0EA7_2DAE7A2B18B49C53_2267_UN""","""C(#CC1CCCOC1)C3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""5043893620D501C5"""
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+"""BD1CFE9CF00D9731_47301B3DF4046783_2267_UN""","""C(#CCCNC1CC1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""51A1650073F67554"""
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+"""675C5D642CEB60C6_24771FE55717EF5A_6036_UN""","""NCC3(CCN1C(=O)C2=C([S]1(=O)=O)C=CS2)CCOCC3""",21,"""54493E924AB2614E"""
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+"""A10B328AA97A5ECD_E6A756397DDF01B0_6036_UN""","""NCC3(CCN1[S](C2(CC1CI)CC2)(=O)=O)CCOCC3""",21,"""54493E924AB2614E"""
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+"""1DA43956601309AE_D3B45E2592289ECB_6036_UN""","""NCC3(CCN([S](=O)(=O)C1CC1)C2CNC2)CCOCC3""",21,"""54493E924AB2614E"""
+"""50F744922E83946F_EBF3AF744A998CC4_6036_UN""","""NCC3(CCN1CC2(C[S]1(=O)=O)CCCC2)CCOCC3""",21,"""54493E924AB2614E"""
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+"""962F27B596EB64CB_E50F2BA6CD280819_6036_UN""","""NCC1(CCN([S](C)(=O)=O)CC[S](=O)(=O)Cl)CCOCC1""",21,"""54493E924AB2614E"""
+"""79F32DC57E0504B4_F543F5DA942FC3FC_6036_UN""","""NCC1(CCN(CCC)[S](=O)(=O)C(F)(F)F)CCOCC1""",21,"""54493E924AB2614E"""
+"""BCB72D1238547003_A37B2513502E174C_2267_UN""","""CC1=NSC=C1C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""5491F505A9919655"""
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+"""8DFE83F937066994_D9565F065DE95DBA_2267_UN""","""CC1=NSC=C1C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""5491F505A9919655"""
+"""CAB48B278FCE2235_BE60A9E8EE77DE31_2267_UN""","""CC1=NSC=C1C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""5491F505A9919655"""
+"""4DD2AD075ACA5341_35E1021A68651720_2267_UN""","""CC1=NSC=C1C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""5491F505A9919655"""
+"""829CA13FE135CA76_C56A109DDE21FF75_2267_UN""","""CC1=NSC=C1C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""5491F505A9919655"""
+"""726DF88179655654_0565114054F3A3EE_2267_UN""","""CC1=NSC=C1C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""5491F505A9919655"""
+"""F05FF8EB1624D443_42008B382E638482_2267_UN""","""CC1=NSC=C1C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""5491F505A9919655"""
+"""DD5E71F42ED1FA7D_4D2DDBED00C9076E_2267_UN""","""CC1=NSC=C1C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""5491F505A9919655"""
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+"""93109E388E0B735C_810555612F1F70A7_2267_UN""","""CC1=NSC=C1C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""5491F505A9919655"""
+"""BBFF81794CF3320C_6181066C67FD2879_2267_UN""","""CC1=NSC=C1C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""5491F505A9919655"""
+"""10F00AF0F5503F98_04AAC99A8C6EAE70_2267_UN""","""CC1=NSC=C1C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""5491F505A9919655"""
+"""7FA8B5F5F9641FFA_C680FD2467FE6422_2267_UN""","""CC1=NSC=C1C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""5491F505A9919655"""
+"""2F693B26F22774A2_784DC2CDC1F573AD_2267_UN""","""CC1=NSC=C1C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""5491F505A9919655"""
+"""B3CF510B0BA25BE0_50A6D385DBB018A0_2267_UN""","""CC1=NSC=C1C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""5491F505A9919655"""
+"""F48DD6BCDF416407_93D9256CD938C39E_2267_UN""","""CC1=NSC=C1C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""5491F505A9919655"""
+"""96D021FA479924EE_46C907D048705DCD_2267_UN""","""CC1=NSC=C1C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""5491F505A9919655"""
+"""A7038EDF3DEAF20D_E5774EDDC6E93AA1_2267_UN""","""CC1=NSC=C1C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""5491F505A9919655"""
+"""C5B5CE3125A627FC_CE78E3C939977082_2267_UN""","""CC1=NSC=C1C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""5491F505A9919655"""
+"""D966005BFB8BB886_22F592EA49AF595F_2267_UN""","""CC1=NSC=C1C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""5491F505A9919655"""
+"""E9D9CDC11FA6091F_D84889D677872559_2267_UN""","""CC1=NSC=C1C#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""5491F505A9919655"""
+"""B50A60FA24E09635_7E241DB35542E29D_2267_UN""","""CC1=NSC=C1C#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""5491F505A9919655"""
+"""85D4C66E2B5E61EB_F4492CBC52CC69C9_2267_UN""","""CC1=NSC=C1C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""5491F505A9919655"""
+"""A945AB26D730B3F2_28DFEC6E37079382_2267_UN""","""CC1=NSC=C1C#CC2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""5491F505A9919655"""
+"""3381BC8FF62AC148_9ECD786833E0FC2E_2267_UN""","""CC1=NSC=C1C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""5491F505A9919655"""
+"""A2B31AB9CAE9D5EF_9BC0E1135B179BBB_2267_UN""","""CC1=NSC=C1C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""5491F505A9919655"""
+"""3121CC6DA3F98100_6205295BE9CF3591_2267_UN""","""CC1=NSC=C1C#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""5491F505A9919655"""
+"""7E83EA79AC2E14FE_46DF2D81BF613E19_2267_UN""","""CC1=NSC=C1C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""5491F505A9919655"""
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+"""DB4C8A8502A53471_B4CEB09CE6F222E5_6036_UN""","""CN(CCN(C)[S](=O)(=O)C1=CC=C(Br)S1)C2CCNCC2""",21,"""56306289F2A84951"""
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+"""0AE4C87F95462FEC_BBAFC744F57F0377_6036_UN""","""C(COCCNC1CCC1)N(C)[S](=O)(=O)CC2CCCN2""",21,"""5CADED31AFC7F214"""
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+"""29D1642C75B7AADE_5054B1ED1F99BAC1_6036_UN""","""C(COCCNC1CCC1)N([S](C)(=O)=O)C2CCCNC2""",21,"""5CADED31AFC7F214"""
+"""F7CA61061E5258BB_8513B674EC1F078B_6036_UN""","""C(COCCNC1CCC1)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""5CADED31AFC7F214"""
+"""1BAC4571DEFFF36B_3D5582D17ACF7AF0_6036_UN""","""C(COCCNC1CCC1)N(CC)[S](=O)(=O)C2CCNC2""",21,"""5CADED31AFC7F214"""
+"""6011E203AC837CE1_F8F60CEBC60F5509_6036_UN""","""C(COCCNC1CCC1)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""5CADED31AFC7F214"""
+"""0E4828B1B9934B8F_5DAD998F84EA52FE_6036_UN""","""C(COCCNC1CCC1)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""5CADED31AFC7F214"""
+"""CC95AB17B975CB98_533CEEC5BD8C2171_6036_UN""","""C(COCCNC1CCC1)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""5CADED31AFC7F214"""
+"""8FAB8DA2A955E696_BDA583F40AB38771_6036_UN""","""C(COCCNC1CCC1)N([S](C)(=O)=O)CCNC2CC2""",21,"""5CADED31AFC7F214"""
+"""9056D0E5EE8B19DA_0239C68BC3A704D9_6036_UN""","""C(COCCNC1CCC1)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""5CADED31AFC7F214"""
+"""2020949D5EC4FDB9_B5B736F881DBE2D0_6036_UN""","""C(COCCNC1CCC1)N(C)[S](=O)(=O)C2CCNCC2""",21,"""5CADED31AFC7F214"""
+"""0C0E654E103771D2_1B2555B85BCCED7F_6036_UN""","""C(COCCNC1CCC1)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""5CADED31AFC7F214"""
+"""2CE26F11AA026E8A_03018454690921C8_6036_UN""","""C(COCCNC1CCC1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""5CADED31AFC7F214"""
+"""36316A0AD32827BE_E34DCD0234ABA2A4_6036_UN""","""C(COCCNC1CCC1)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""5CADED31AFC7F214"""
+"""8154589ED96BE744_AF23700108ADFE80_6036_UN""","""C(COCCNC1CCC1)N([S](C)(=O)=O)C2CCNCC2""",21,"""5CADED31AFC7F214"""
+"""C052C0C61B69EF50_D038A540978933EE_6036_UN""","""C(COCCNC1CCC1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""5CADED31AFC7F214"""
+"""9D391F649AD602A7_0047F642CDA61B08_6036_UN""","""C(COCCNC1CCC1)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""5CADED31AFC7F214"""
+"""18515DEF7629DF28_D2762510A50ABB00_6036_UN""","""C(COCCNC1CCC1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""5CADED31AFC7F214"""
+"""348EC72D1B5B7F57_6927FC8BAD9D9444_6036_UN""","""C(COCCNC1CCC1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""5CADED31AFC7F214"""
+"""503143DC8C54E6D5_9B86A798E5864A7E_6036_UN""","""C(COCCNC1CCC1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""5CADED31AFC7F214"""
+"""9DD26BC9054D69EB_BB92B311E5460A42_6036_UN""","""C(COCCNC1CCC1)N([S](C)(=O)=O)CC2CNCC2""",21,"""5CADED31AFC7F214"""
+"""396CE0A881858FB2_87EE0807B2B3A5F4_6036_UN""","""C(COCCNC1CCC1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""5CADED31AFC7F214"""
+"""5C5B84C27D622E5E_8EA6159ECFB5D48B_6036_UN""","""C(COCCNC1CCC1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""5CADED31AFC7F214"""
+"""6498BA83CB88298B_2C93CC46B2627C00_6036_UN""","""C(COCCNC1CCC1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""5CADED31AFC7F214"""
+"""3859C64B36A9B472_3D871F65A1174F34_6036_UN""","""C(COCCNC1CCC1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""5CADED31AFC7F214"""
+"""7DCE1F0136733ABC_C83121495B8CA10F_6036_UN""","""C(COCCNC1CCC1)N(CCCN)[S](=O)(=O)C2CC2""",21,"""5CADED31AFC7F214"""
+"""0404F92A377C040A_F4351550139BB761_6036_UN""","""C(COCCNC1CCC1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""5CADED31AFC7F214"""
+"""854B36920B682352_1D432F7702B57D3E_6036_UN""","""C(COCCNC1CCC1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""5CADED31AFC7F214"""
+"""49B2C396B854B35A_EE43859A98AA92EA_6036_UN""","""C(COCCNC1CCC1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""5CADED31AFC7F214"""
+"""0798EF2AEECC593E_E72D957961BF0D55_6036_UN""","""C(COCCNC1CCC1)N2CCCCNCC[S]2(=O)=O""",21,"""5CADED31AFC7F214"""
+"""ECA26D3ADD4C7C31_937552DA6296D1FD_6036_UN""","""C(COCCNC1CCC1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""5CADED31AFC7F214"""
+"""CAE7D0E5E7DC1FCA_7CAEA2CEB4FA1E8B_6036_UN""","""C(COCCNC1CCC1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""5CADED31AFC7F214"""
+"""6D88EE9DB03A626E_DB508D86775D0D91_6036_UN""","""C(COCCNC1CCC1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""5CADED31AFC7F214"""
+"""2EAA3171AF552D30_E3177CD7AFEC1F9E_6036_UN""","""C(COCCNC1CCC1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""5CADED31AFC7F214"""
+"""D9E50E452D20840D_49497EDD76317238_6036_UN""","""C(COCCNC1CCC1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""5CADED31AFC7F214"""
+"""5DCB3889A57B93AE_EDEBF805285D9B43_6036_UN""","""C(COCCNC1CCC1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""5CADED31AFC7F214"""
+"""ADCA7A2B687650F3_FDA72679715A50A6_6036_UN""","""C(COCCNC1CCC1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""5CADED31AFC7F214"""
+"""07BA06CE2103F29D_9217EBF3A47A9556_1171_DP""","""NCCCC1=NC(=CS1)C2=CC=C(NC(CCC)=O)C=C2""",21,"""60ED965E85FD444D"""
+"""2B8C2FD48918911F_BF781FC019A92358_1171_DP""","""NCCCC1=NC(=CS1)C2=C([N](CCCOC)C(=C2)C)C""",21,"""60ED965E85FD444D"""
+"""1B02AC1CE1FD753E_4AC0A14928C0DAD0_1171_DP""","""NCCCC1=NC(=CS1)C2=C([NH]C(=C2C(OCC)=O)C)C""",21,"""60ED965E85FD444D"""
+"""D6833D928C2E52A8_4D348A8FE06A9036_1171_DP""","""NCCCC1=NC(=CS1)C2=CC=C(CCCCCC)C=C2""",21,"""60ED965E85FD444D"""
+"""CF9EECD069D5C845_251C574A8C78B041_1171_DP""","""NCCCC1=NC(=C(C)S1)C2=C(C(=C(C)[NH]2)C(OC)=O)C""",21,"""60ED965E85FD444D"""
+"""59ED2E94C834F0FD_18E253C01E53BB8B_1171_DP""","""NCCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NC=N[NH]3""",21,"""60ED965E85FD444D"""
+"""68779BB510782FC0_D69A2E7A838EFBC9_1171_DP""","""NCCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NOC=C3""",21,"""60ED965E85FD444D"""
+"""2994369ACC54CCCC_EA8074F9CA1B438B_1171_DP""","""NCCCC1=NC(=CS1)C2=CC(=C(C=C2)OC(F)F)OC""",21,"""60ED965E85FD444D"""
+"""6784FD51126B9A9D_07157FA7232A93C8_1171_DP""","""NCCCC1=NC(=CS1)C2=CC=C(CCN[S](C)(=O)=O)S2""",21,"""60ED965E85FD444D"""
+"""57D1FCAD1BBB20F7_F3BBB5CC9AC7943F_1171_DP""","""NCCCC1=NC(=CS1)C2=C(C(=C(C)[NH]2)C(OCC)=O)C""",21,"""60ED965E85FD444D"""
+"""D2E8D050681E4ADB_FF279B78AC387171_1171_DP""","""NCCCC1=NC(=CS1)C2=CC=C(C(C)NC(=O)C)C=C2""",21,"""60ED965E85FD444D"""
+"""053590345DF9825B_78B3B64AD2F6D6B2_1171_DP""","""NCCCC1=NC(=CS1)C2=C([N](CCC(C)C)C(=C2)C)C""",21,"""60ED965E85FD444D"""
+"""7B1547F69438774C_1D387807108F80B1_1171_DP""","""NCCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)CC(F)(F)F""",21,"""60ED965E85FD444D"""
+"""4D212C4AAA0A1F3B_2317E407F7CF18C6_1171_DP""","""NCCCC1=NC(=CS1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""60ED965E85FD444D"""
+"""543DC68B72EF3E1F_4B9827082CD96FF5_1171_DP""","""NCCCC1=NC(=CS1)C2=CC=C(NC(C(C)C)=O)C=C2""",21,"""60ED965E85FD444D"""
+"""E1BC5B8B10EFB9EF_D597BDC1E8ED8269_1171_DP""","""NCCCC1=NC(=CS1)C3=C(F)C=C2NC(CCC2=C3)=O""",21,"""60ED965E85FD444D"""
+"""A4F2B77C498890EA_1FA818C1C6D17C3D_1171_DP""","""NCCCC1=NC(=CS1)C3=CC2=C(OC(C)C(N2)=O)C=C3""",21,"""60ED965E85FD444D"""
+"""5F94D90762C74D5E_52BF8FE2225D10B5_1171_DP""","""NCCCC1=NC(=CS1)C3=CC2=C(NC(C2(C)C)=O)C=C3""",21,"""60ED965E85FD444D"""
+"""AD2F1611E432F24D_642FD35BD452C24F_1171_DP""","""NCCCC1=NC(=CS1)C2=CC(=C(SC)C=C2)NC(=O)C""",21,"""60ED965E85FD444D"""
+"""48D98986A8C6F3CC_808E4906A8641B86_1171_DP""","""NCCCC1=NC(=CS1)C2=CC=C(N(C)[S](=O)(=O)C)C=C2""",21,"""60ED965E85FD444D"""
+"""82B23E2FC17666BD_E194546582675137_1171_DP""","""NCCCC1=NC(=CS1)C3=CC2=C(N(C)C(=O)CC2)C=C3""",21,"""60ED965E85FD444D"""
+"""ECE1E86A83FC715B_60C372C6652C9EE7_1171_DP""","""NCCCC1=NC(=CS1)C3=C[N](C2=CC=CC(=C2)C)N=N3""",21,"""60ED965E85FD444D"""
+"""13ABC67B7BEA7700_50EAEFF1C525EB33_1171_DP""","""NCCCC1=NC(=CS1)C3=CC2=C(CCN(C(C)=O)C2)S3""",21,"""60ED965E85FD444D"""
+"""3BBA40B405F70EA9_B081E87FE9F36DE0_1171_DP""","""NCCCC1=NC(=CS1)C2=CC3=C(C=C2)NC(N(C)C3)=O""",21,"""60ED965E85FD444D"""
+"""F908F375A47265F8_1F9AEA32C4BA64AF_1171_DP""","""NCCCC1=NC(=CS1)C3=CC2=C(C=C(OC)C=C2)C=C3""",21,"""60ED965E85FD444D"""
+"""8CB534DFDE38F998_C0E04809702830DB_1171_DP""","""NCCCC1=NC(=CS1)C3=C2OCC(C2=C(OC)C=C3)=O""",21,"""60ED965E85FD444D"""
+"""AA6D8F8EDBFA6F0F_2557454251ED1464_1171_DP""","""NCCCC1=NC(=CS1)C2=CC=C([S](N(C)C)(=O)=O)C=C2""",21,"""60ED965E85FD444D"""
+"""2DFF6253A381EB87_3B1D60FE1641FC7F_1171_DP""","""NCCCC1=NC(=CS1)C2(NC(C(F)(F)F)=O)CCCC2""",21,"""60ED965E85FD444D"""
+"""C0D607076D5CACAA_2C9EDB1D3D18C866_1171_DP""","""NCCCC1=NC(=CS1)C3=C[N](C2=CC=C(F)C=C2)N=N3""",21,"""60ED965E85FD444D"""
+"""514BBFDB3F057D31_AB080E0F0D6633CC_1171_DP""","""NCCCC1=NC(=CS1)C2CCN(C(C(F)(F)F)=O)CC2""",21,"""60ED965E85FD444D"""
+"""0AF41BBB58F61A08_A8410E370238F47E_1171_DP""","""NCCCC1=NC(=CS1)C2=CC(=C(C(=C2)OC)OC)OC""",21,"""60ED965E85FD444D"""
+"""7320AF45192A33BE_1C7DEDFAC4D05662_1171_DP""","""NCCCC1=NC(=CS1)C2=CC(=C(C=C2)NC(=O)C)SC""",21,"""60ED965E85FD444D"""
+"""608C81C1BEA98E1D_303B856BBD24A8DD_1171_DP""","""NCCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NC=CS3""",21,"""60ED965E85FD444D"""
+"""D26CAE1811A324FE_48D635545F08025E_1171_DP""","""NCCCC1=NC(=CS1)C2=C([NH]C(=C2C)C(OCC)=O)C""",21,"""60ED965E85FD444D"""
+"""28051747AE8CE3D5_3A3E8A791A10BE95_1171_DP""","""NCCCC1=NC(=CS1)C2=CC=C(CCNC(C)=O)C=C2""",21,"""60ED965E85FD444D"""
+"""0930B3A33895B2A5_967E6202C4D37278_1171_DP""","""NCCCC1=NC(=CS1)C2=CC=C(CN(C)C(=O)C)C=C2""",21,"""60ED965E85FD444D"""
+"""563DDB21D575B507_2DF8A0BC8074BE16_1171_DP""","""NCCCC1=NC(=CS1)C2=CC(=NO2)C3=CC=C(F)C=C3""",21,"""60ED965E85FD444D"""
+"""CB15860D60F6273D_6CE7E6A058D411D4_1171_DP""","""NCCCC2=NC(=C(CC1=CC=CC=C1)S2)C(OCC)=O""",21,"""60ED965E85FD444D"""
+"""F05BAD19BBFAEA96_98C031293DA9112A_1171_DP""","""NCCCC1=NC(=CS1)C2=C([N](CC(OC)=O)C(=C2)C)C""",21,"""60ED965E85FD444D"""
+"""E9ED934F86590E50_9C8A12D3ED8CA918_1171_DP""","""NCCCC1=NC(=CS1)C2=CC=CC(=C2)[S](N(C)C)(=O)=O""",21,"""60ED965E85FD444D"""
+"""2F40F070BE933914_F1333042E1C96FD1_1171_DP""","""NCCCC1=NC(=CS1)C2=C([N](C(COC)C)C(=C2)C)C""",21,"""60ED965E85FD444D"""
+"""45EEE7D1C91F28CB_93211D2278D03E59_1171_DP""","""NCCCC1=NC(=CS1)C2=C(C)[N](N=C2)C3=CC=CC=C3""",21,"""60ED965E85FD444D"""
+"""5C429B1FA011B0D8_96ED2865C1268DFE_2267_UN""","""C(#CC1=CC=CC=C1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""6107F87338990CE7"""
+"""B3ED09D47E73C85B_083EA1332ED1DAAD_2267_UN""","""C(#CC1=CC=CC=C1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""6107F87338990CE7"""
+"""F89940384EA25313_ECC05270CCE1C708_2267_UN""","""C(#CC1=CC=CC=C1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""6107F87338990CE7"""
+"""87B2C880A5E74A7E_8BF6A49E7F7F4483_2267_UN""","""C(#CC1=CC=CC=C1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""6107F87338990CE7"""
+"""C3B1827B1AFB109E_00770F6CF96D8D92_2267_UN""","""C(#CC1=CC=CC=C1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""6107F87338990CE7"""
+"""8861144A064BA584_F0FC1DEB4F2965C7_2267_UN""","""C(#CC1=CC=CC=C1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""6107F87338990CE7"""
+"""CFB8FC777B93A4BE_30F31C36C5FB395C_2267_UN""","""C(#CC1=CC=CC=C1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""6107F87338990CE7"""
+"""FB800F4E9EF01BD5_7796864EBF6B1E30_2267_UN""","""C(#CC1=CC=CC=C1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""6107F87338990CE7"""
+"""2333F1377BF930D4_78BBD69B91C19DDC_2267_UN""","""C(#CC1=CC=CC=C1)C2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""6107F87338990CE7"""
+"""DEB2F183E9B4E518_1E47E85030D4F0BA_2267_UN""","""C(#CC1=CC=CC=C1)C2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""6107F87338990CE7"""
+"""2DF469317650AA24_B4935817BE17EA15_2267_UN""","""C(#CC1=CC=CC=C1)C2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""6107F87338990CE7"""
+"""C6CD733E15708B96_54170B1AF6F5B2CB_2267_UN""","""C(#CC1=CC=CC=C1)C2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""6107F87338990CE7"""
+"""246AC2A2EFAF3F9D_313CC4EC1D6634C2_2267_UN""","""C(#CC1=CC=CC=C1)C2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""6107F87338990CE7"""
+"""0819F6D75A41C23D_F316F052F6F6FE90_2267_UN""","""C(#CC1=CC=CC=C1)C3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""6107F87338990CE7"""
+"""776A42E55570ACB9_4DDBCFBB50FDE91F_2267_UN""","""C(#CC1=CC=CC=C1)C2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""6107F87338990CE7"""
+"""5D930EE17413FB5B_6530DEF34AB88212_2267_UN""","""C(#CC1=CC=CC=C1)C2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""6107F87338990CE7"""
+"""6CF804EC8A492F86_A64F281A4830592C_2267_UN""","""C(#CC1=CC=CC=C1)C2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""6107F87338990CE7"""
+"""EEEC4051B4E2210E_735F0AA6D978C77F_2267_UN""","""C(#CC1=CC=CC=C1)C3=CC=C(CC2(C)NCCC2)C=C3""",21,"""6107F87338990CE7"""
+"""E22410203CE7B728_D0E143AB57E1A013_2267_UN""","""C(#CC1=CC=CC=C1)C2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""6107F87338990CE7"""
+"""7070850B474E5EA2_FBEEEEBFA89FEA30_2267_UN""","""C(#CC1=CC=CC=C1)C2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""6107F87338990CE7"""
+"""96AD083D3793DA2F_17639F9CD8A7C3ED_2267_UN""","""C(#CC1=CC=CC=C1)C2=CC=C(C=C2)C3NCCNC3=O""",21,"""6107F87338990CE7"""
+"""F9EE39EDEB6EAA32_EDDE84A0E68FBFEB_2267_UN""","""C(#CC1=CC=CC=C1)C2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""6107F87338990CE7"""
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+"""63636B2FF15A8DBB_F3E01773CBD15345_2267_UN""","""C(#CCOC1CNC1)C2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""6412692FEAD592F4"""
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+"""9DD31008EF3FF8FA_2673E3CAADEAFEE4_2267_UN""","""C(#CCOC1CNC1)C2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""6412692FEAD592F4"""
+"""8309144B95F1418B_6259146F3AC42A32_2267_UN""","""C(#CCOC1CNC1)C2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""6412692FEAD592F4"""
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+"""B58B5332384CA80F_1E7A2A6D9F2E5C37_2267_UN""","""C(#CCOC1CNC1)C2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""6412692FEAD592F4"""
+"""C5FE1A8D5D31E238_46C8E0375F72A922_2267_UN""","""C(#CCOC1CNC1)C2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""6412692FEAD592F4"""
+"""FFC4354959280AC9_1EAE9759412050BB_2267_UN""","""C(#CCOC1CNC1)C3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""6412692FEAD592F4"""
+"""D5CF054CB03A617D_8E96DBCF21030C89_6036_UN""","""CC(N)(CN([S](CC)(=O)=O)CC(=O)OC)C1CCCCC1""",21,"""6542930758119206"""
+"""B14C0A3A9056A582_ADCB6E6B9EC0E414_6036_UN""","""CC(N)(CN([C@H](C(OC)=O)C)[S](=O)(=O)C)C1CCCCC1""",21,"""6542930758119206"""
+"""A2FF08E38C2303D4_87BC41124C4BF9B2_6036_UN""","""CC(N)(CN(C)[S](=O)(=O)C1=CC=C(Br)S1)C2CCCCC2""",21,"""6542930758119206"""
+"""BDAEA2411A8DF206_D50956FB80D34C2D_6036_UN""","""CC(N)(CN1C2=C(C[S]1(=O)=O)C=CC=C2)C3CCCCC3""",21,"""6542930758119206"""
+"""1594DA7781BF01D4_B442855830C82FD7_6036_UN""","""CC(N)(CN(C)[S](=O)(=O)C1CCCNC1)C2CCCCC2""",21,"""6542930758119206"""
+"""E4B274E8D8820D25_8240B97202A96365_6036_UN""","""CC(N)(CN(C)[S](=O)(=O)CC1CCCN1)C2CCCCC2""",21,"""6542930758119206"""
+"""2AE4FC2C1E123C7E_A69FFACFA9121373_6036_UN""","""CC(N)(CN(C)[S](=O)(=O)C1=CC=C(Cl)S1)C2CCCCC2""",21,"""6542930758119206"""
+"""7948CC8ACDA7EF52_69BBCFDBE84FDAD3_6036_UN""","""CC(N)(CN([S](C)(=O)=O)C1CCCNC1)C2CCCCC2""",21,"""6542930758119206"""
+"""B4C37C4798731C35_BCFCC8421BC96799_6036_UN""","""CC(N)(CN([S](C)(=O)=O)C1=NN=C(N)S1)C2CCCCC2""",21,"""6542930758119206"""
+"""2A0680E208CF6E1C_04BAFCE78D191AE2_6036_UN""","""CC(N)(CN(CC)[S](=O)(=O)C1CCNC1)C2CCCCC2""",21,"""6542930758119206"""
+"""A9D0D5E4F8E4100C_C11972DD31D9351B_6036_UN""","""CC(N)(CN([S](C(C)(C)C)(=O)=O)CC=C)C1CCCCC1""",21,"""6542930758119206"""
+"""43FC6A6BCA215891_6442E7B9733C32EC_6036_UN""","""CC(N)(CN(C)[S](=O)(=O)CC[S](=O)(=O)C)C1CCCCC1""",21,"""6542930758119206"""
+"""E00821B3A20AFB5B_6AD390F34A5A4163_6036_UN""","""CC(N)(CN(C(C)(C)C)[S](=O)(=O)CCN)C1CCCCC1""",21,"""6542930758119206"""
+"""9F3FBE18D2CFE043_844AFDC2FD65E763_6036_UN""","""CC(N)(CN([S](C)(=O)=O)CCNC1CC1)C2CCCCC2""",21,"""6542930758119206"""
+"""7DD9CFA356FE9398_3BD6B8BD347164CB_6036_UN""","""CC(N)(CN([S](C)(=O)=O)C(=O)CN=[N]#N)C1CCCCC1""",21,"""6542930758119206"""
+"""F34CC6D0D2586F3A_8C5848CE760D82C2_6036_UN""","""CC(N)(CN(C)[S](=O)(=O)C1CCNCC1)C2CCCCC2""",21,"""6542930758119206"""
+"""5A2058E88409D4AB_22CA2B8EAC1A8D6D_6036_UN""","""CC(N)(CN1[S](CCC1C(OC)=O)(=O)=O)C2CCCCC2""",21,"""6542930758119206"""
+"""DF153B3CBBE39AE2_3AEEFA629EDF41DA_6036_UN""","""CC(N)(CN1[S](=O)(=O)C2=C(C1)C=CC=C2)C3CCCCC3""",21,"""6542930758119206"""
+"""EC68926DF2A0754A_DAA2B334C37DC2B6_6036_UN""","""CC(N)(CN([S](C)(=O)=O)CC1=CC=NO1)C2CCCCC2""",21,"""6542930758119206"""
+"""E68343389C14109E_96CC0E37FF7B9E92_6036_UN""","""CC(N)(CN([S](C)(=O)=O)C1CCNCC1)C2CCCCC2""",21,"""6542930758119206"""
+"""BE170A42D685A2F9_E9D7DB76605F53FC_6036_UN""","""CC(N)(CN([S](C)(=O)=O)C1=NC=CC=C1)C2CCCCC2""",21,"""6542930758119206"""
+"""46B1BA15FF7C0A97_39A888743A707B1A_6036_UN""","""CC(N)(CN(C)[S](=O)(=O)C1=CN=CC=C1)C2CCCCC2""",21,"""6542930758119206"""
+"""DA43E6F127026E97_EB995B2652DCDB12_6036_UN""","""CC(N)(CN(C(C)(C)C(=N)N)[S](=O)(=O)C)C1CCCCC1""",21,"""6542930758119206"""
+"""0C42A5844BD089F3_50C882BD5A4BF456_6036_UN""","""CC(N)(CN(C)[S](=O)(=O)C1=C[N](C)C=N1)C2CCCCC2""",21,"""6542930758119206"""
+"""8A75C1021D0EAB3C_A269D9AE12502A6C_6036_UN""","""CC(N)(CN1CCCC(C(C)C)[S]1(=O)=O)C2CCCCC2""",21,"""6542930758119206"""
+"""BD042DCAD7B8D5C6_827DCD2712906A50_6036_UN""","""CC(N)(CN([S](C)(=O)=O)CC1CNCC1)C2CCCCC2""",21,"""6542930758119206"""
+"""6FC2A95B19814D35_BE0176314565C5E6_6036_UN""","""CC(N)(CN([S](C)(=O)=O)[C@@H]1CNCCC1)C2CCCCC2""",21,"""6542930758119206"""
+"""705389A7E9D1E21A_B7496BA83863B499_6036_UN""","""CC(N)(CN(CCCCl)[S](=O)(=O)C1CC1)C2CCCCC2""",21,"""6542930758119206"""
+"""2729D906BDFFB729_157CB27045B41C12_6036_UN""","""CC(N)(CN1C(=O)C2=C([S]1(=O)=O)C=CS2)C3CCCCC3""",21,"""6542930758119206"""
+"""46C09C642F7B9D3F_0468615356C12F26_6036_UN""","""CC(N)(CN(C(C(C)(C)N)=O)[S](=O)(=O)C)C1CCCCC1""",21,"""6542930758119206"""
+"""2EE315E41A8736E9_F1DE5F7FAC5AC11D_6036_UN""","""CC(N)(CN(CCCN)[S](=O)(=O)C1CC1)C2CCCCC2""",21,"""6542930758119206"""
+"""889601DC0EA77623_CDDA6B66E44DD773_6036_UN""","""CC(N)(CN1CCCC(CC=C)[S]1(=O)=O)C2CCCCC2""",21,"""6542930758119206"""
+"""30D78E22CFC6CC7C_24AC5141F5631D2C_6036_UN""","""CC(N)(CN(CCCN)[S](=O)(=O)C(F)F)C1CCCCC1""",21,"""6542930758119206"""
+"""4772D7E0C0B4334E_D7ACFBAC6F7CF2F8_6036_UN""","""CC(N)(CN1[S](C2(CC1CI)CC2)(=O)=O)C3CCCCC3""",21,"""6542930758119206"""
+"""79E43FFED2485FF0_DEC2EB4F96696D47_6036_UN""","""CC(N)(CN1CCCCNCC[S]1(=O)=O)C2CCCCC2""",21,"""6542930758119206"""
+"""563A2A6A268776D2_AA9A2CEC9540B1EF_6036_UN""","""CC(N)(CN1[S](=O)(=O)C2(C1)CCOCC2)C3CCCCC3""",21,"""6542930758119206"""
+"""EEE7208B48A556F4_4541DCF8432C7E99_6036_UN""","""CC(N)(CN1C(CN)CC2([S]1(=O)=O)CC2)C3CCCCC3""",21,"""6542930758119206"""
+"""346B95F40D4D484C_E2BFF3B0808B6D83_6036_UN""","""CC(N)(CN([S](=O)(=O)C1CC1)C2CNC2)C3CCCCC3""",21,"""6542930758119206"""
+"""73EB8ACDDD787DA7_DAF802E1583A7F8C_6036_UN""","""CC(N)(CN1CC2(C[S]1(=O)=O)CCCC2)C3CCCCC3""",21,"""6542930758119206"""
+"""0E3004315F73FC8A_70A600EB81E7122A_6036_UN""","""CC(N)(CN([S](=O)(=O)C1CNC1)C2CC2)C3CCCCC3""",21,"""6542930758119206"""
+"""3736E449AFF368B5_D4048633DF8BFB51_6036_UN""","""CC(N)(CN([S](C)(=O)=O)CC[S](=O)(=O)Cl)C1CCCCC1""",21,"""6542930758119206"""
+"""6369F15A3D0DE559_C448584F868C30B4_6036_UN""","""CC(N)(CN(CCC)[S](=O)(=O)C(F)(F)F)C1CCCCC1""",21,"""6542930758119206"""
+"""381484D2B00B0870_920285248E3CCD6F_2267_UN""","""O=C(C#CC1=CC=C(C(CCC(O)=O)=O)C=C1)C2CCC2""",21,"""65E8553277834C76"""
+"""182255134EE7860A_0CD10C7261CB9A3C_2267_UN""","""O=C(C#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O)C2CCC2""",21,"""65E8553277834C76"""
+"""B56AD824249263FF_E82FFF3183FB8799_2267_UN""","""O=C(C#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O)C3CCC3""",21,"""65E8553277834C76"""
+"""11D098A856868E96_8F1909DF30650412_2267_UN""","""O=C(C#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2)C3CCC3""",21,"""65E8553277834C76"""
+"""7E2346CC634BF27D_0498A22DB677CD03_2267_UN""","""O=C(C#CC2=CC(=C1C=CC=CC1=C2)C(O)=O)C3CCC3""",21,"""65E8553277834C76"""
+"""D124DF51398BD219_F413B0AA00332556_2267_UN""","""O=C(C#CC2=C(C(O)=O)C=C1C=CC=CC1=C2)C3CCC3""",21,"""65E8553277834C76"""
+"""3187B5441A031A08_341CB1778AE179CD_2267_UN""","""O=C(C#CC1=CC=C(C=C1)C(=O)C2CCCO2)C3CCC3""",21,"""65E8553277834C76"""
+"""3E2A89A5B799B312_73792B0FF0715EA1_2267_UN""","""O=C(C#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F)C2CCC2""",21,"""65E8553277834C76"""
+"""B15AC0912346E578_7C547BDADEDBDD4D_2267_UN""","""O=C(C#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F)C2CCC2""",21,"""65E8553277834C76"""
+"""68063D3F3B6D2C0C_1AA845117FCEB02B_2267_UN""","""O=C(C#CC1=C(C(NCC(O)=O)=O)C=CC=C1)C2CCC2""",21,"""65E8553277834C76"""
+"""A8F60637BCBA9034_B07CF556F10DAA84_2267_UN""","""O=C(C#CC1=N[N](CC[S](CC)(=O)=O)C=C1C)C2CCC2""",21,"""65E8553277834C76"""
+"""ACDA1AEF50708981_50F8A65BB9EFF25A_2267_UN""","""O=C(C#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2)C3CCC3""",21,"""65E8553277834C76"""
+"""9C2DB513E353625E_35D369AD527C7453_2267_UN""","""O=C(C#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F)C2CCC2""",21,"""65E8553277834C76"""
+"""DD44B372F2688958_F7F95D13B9ECBE01_2267_UN""","""O=C(C#CC2=C1CCC(C(OC)=O)CC1=N[NH]2)C3CCC3""",21,"""65E8553277834C76"""
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+"""3649BD9C55EA5A23_61DF73B205A2C283_2267_UN""","""O=C(C#CC1=C(C(OCC)=O)C=N[N]1C(C)C)C2CCC2""",21,"""65E8553277834C76"""
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+"""EC17D62D0CA262C0_2F971134D7A21833_6036_UN""","""NCC(C1=C(C=CC=C1)Cl)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""681FA9BD23A90758"""
+"""D9BBD89BCA77F7F9_37B3C0D8E567D484_6036_UN""","""NCC(C1=C(C=CC=C1)Cl)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""681FA9BD23A90758"""
+"""0ADE6E4C1682290E_D7FF898EB8C557E8_6036_UN""","""NCC(C1=C(C=CC=C1)Cl)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""681FA9BD23A90758"""
+"""D6F93575DDCC8013_9B91348D84C30BCC_6036_UN""","""NCC(C1=C(C=CC=C1)Cl)N([S](C)(=O)=O)C2CCNCC2""",21,"""681FA9BD23A90758"""
+"""412F06EA502775AA_E48AE1CC1BE7C6A2_6036_UN""","""NCC(C1=C(C=CC=C1)Cl)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""681FA9BD23A90758"""
+"""D93C3056E369648E_34F5B2CE41C8EE44_6036_UN""","""NCC(C1=C(C=CC=C1)Cl)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""681FA9BD23A90758"""
+"""1BB8EF89CF47839D_E6C4619C29644E4C_6036_UN""","""NCC(C1=C(C=CC=C1)Cl)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""681FA9BD23A90758"""
+"""FC3E3D4ADC35F3C9_5D95B80721F36108_6036_UN""","""NCC(C1=C(C=CC=C1)Cl)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""681FA9BD23A90758"""
+"""65F8BA49DF09C745_AF34E31469E8BF32_6036_UN""","""NCC(C1=C(C=CC=C1)Cl)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""681FA9BD23A90758"""
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+"""701A76E5F82EB7BB_3A7B56ECB5BCD100_2267_UN""","""CN(C)C(C)(C)C#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""6B8FB2A948DEE4BB"""
+"""E9D157DD999FC413_7D1ECC94CF2CF66C_2267_UN""","""CN(C)C(C)(C)C#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""6B8FB2A948DEE4BB"""
+"""E9D53EE19B4E3856_72339C41E1867580_2267_UN""","""CN(C)C(C)(C)C#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""6B8FB2A948DEE4BB"""
+"""372BCEC5F9F04664_14CFA28A409318E6_2267_UN""","""CN(C)C(C)(C)C#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""6B8FB2A948DEE4BB"""
+"""218BAEF416C0D700_BE1B12CDCE500249_2267_UN""","""CN(C)C(C)(C)C#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""6B8FB2A948DEE4BB"""
+"""035D99FDF659EAE1_5E9F41C086B25A97_2267_UN""","""CN(C)C(C)(C)C#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""6B8FB2A948DEE4BB"""
+"""180D4620F23AD75E_3BB48E366D21DC9E_2267_UN""","""CN(C)C(C)(C)C#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""6B8FB2A948DEE4BB"""
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+"""D6607BDE57C2E56F_4753856120BA0143_2267_UN""","""CN(C)C(C)(C)C#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""6B8FB2A948DEE4BB"""
+"""D2FB63D1EEF5AD8C_6FB894293AFF6A4E_2267_UN""","""CN(C)C(C)(C)C#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""6B8FB2A948DEE4BB"""
+"""688CEACFF4DBE9CB_ACC762C03877B170_2267_UN""","""CN(C)C(C)(C)C#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""6B8FB2A948DEE4BB"""
+"""B858C0EA30EE113B_79D7407CA93F2F23_2267_UN""","""CN(C)C(C)(C)C#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""6B8FB2A948DEE4BB"""
+"""DC375E6DD0933EF0_DA69097127A6484F_2267_UN""","""CN(C)C(C)(C)C#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""6B8FB2A948DEE4BB"""
+"""7A4EA11B8BD6CCE8_F166A465D8D8026C_2267_UN""","""CN(C)C(C)(C)C#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""6B8FB2A948DEE4BB"""
+"""E4F6081CAF52FFD2_1DEBD546A8E02BB1_2267_UN""","""CN(C)C(C)(C)C#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""6B8FB2A948DEE4BB"""
+"""CD8F47421418468C_E756CE7A96C857B7_2267_UN""","""CN(C)C(C)(C)C#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""6B8FB2A948DEE4BB"""
+"""9F282113E1133A09_413A5A1FB40D9073_2267_UN""","""CN(C)C(C)(C)C#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""6B8FB2A948DEE4BB"""
+"""FF85FAA01B8ACBB8_CB576B10B3831B27_2267_UN""","""CN(C)C(C)(C)C#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""6B8FB2A948DEE4BB"""
+"""9E5DDDD68AC1ADF3_17C1ABC2D648E16C_2267_UN""","""CN(C)C(C)(C)C#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""6B8FB2A948DEE4BB"""
+"""14B25A96F796EEC3_A1D33FC4D2AF8EC0_2267_UN""","""CN(C)C(C)(C)C#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""6B8FB2A948DEE4BB"""
+"""2FB45E5C7450C827_A4DEA6BFBA58E955_2267_UN""","""CN(C)C(C)(C)C#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""6B8FB2A948DEE4BB"""
+"""5F9CDEF0B9546406_5D1B6EF70880477F_2267_UN""","""CN(C)C(C)(C)C#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""6B8FB2A948DEE4BB"""
+"""77E1A7A39E33570A_79C16A2D5E2E4CF7_2267_UN""","""CN(C)C(C)(C)C#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""6B8FB2A948DEE4BB"""
+"""2CCE9F44BA6B65A7_0EA9D73F99FB2680_2267_UN""","""CN(C)C(C)(C)C#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""6B8FB2A948DEE4BB"""
+"""25050021FD3894F8_D8E2331D5124FFB1_2267_UN""","""CN(C)C(C)(C)C#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""6B8FB2A948DEE4BB"""
+"""9594E6B4FCDA5C12_FC7DCCF569DA250A_2267_UN""","""CN(C)C(C)(C)C#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""6B8FB2A948DEE4BB"""
+"""25F1F004474740DE_736D3B69A8564483_2267_UN""","""CN(C)C(C)(C)C#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""6B8FB2A948DEE4BB"""
+"""0C56D09E0E288D6C_3A7816D827FE5B90_2267_UN""","""CN(C)C(C)(C)C#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""6B8FB2A948DEE4BB"""
+"""8F214BC7D68DF263_E65C2CBA1879651A_2267_UN""","""CN(C)C(C)(C)C#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""6B8FB2A948DEE4BB"""
+"""6CA7E0098E438BA8_29EE384C0FE188AB_2267_UN""","""CN(C)C(C)(C)C#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""6B8FB2A948DEE4BB"""
+"""B24CCFDA180DFC60_6DC4CFE998CF5C7D_2267_UN""","""CN(C)C(C)(C)C#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""6B8FB2A948DEE4BB"""
+"""DE867233E5EDB216_166241B470BF792D_2267_UN""","""CN(C)C(C)(C)C#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""6B8FB2A948DEE4BB"""
+"""5763976771B8C542_24C4F92C0B505177_2267_UN""","""CN(C)C(C)(C)C#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""6B8FB2A948DEE4BB"""
+"""65B13737808FE2E0_11E7F1EB3D252A78_2267_UN""","""CN(C)C(C)(C)C#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""6B8FB2A948DEE4BB"""
+"""D6366083CE059293_49553BB1FD79DF6D_2267_UN""","""CN(C)C(C)(C)C#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""6B8FB2A948DEE4BB"""
+"""E6C3D2C77760A700_11334CDFE32B26F4_2267_UN""","""CN(C)C(C)(C)C#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""6B8FB2A948DEE4BB"""
+"""B9B7A25259E78633_8011877EE5CB3B1B_6036_UN""","""CC1=CC(=CC=C1)C(CN)N([S](CC)(=O)=O)CC(=O)OC""",21,"""6BC5CFB69CD9A594"""
+"""56BB43344EF54F8A_A34C32DA5A08D386_6036_UN""","""CC1=CC(=CC=C1)C(CN)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""6BC5CFB69CD9A594"""
+"""C278BA4F740C0CE7_893B1DA38883CE20_6036_UN""","""CC1=CC(=CC=C1)C(CN)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""6BC5CFB69CD9A594"""
+"""2D27DE5664FE1FE4_DB8E0A4A441B7BBF_6036_UN""","""CC1=CC(=CC=C1)C(CN)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""6BC5CFB69CD9A594"""
+"""C1EE803863197BF0_BAC5D9E9F4001845_6036_UN""","""CC1=CC(=CC=C1)C(CN)N(C)[S](=O)(=O)C2CCCNC2""",21,"""6BC5CFB69CD9A594"""
+"""541489FE615DC45A_8CC7E5C3C66154F7_6036_UN""","""CC1=CC(=CC=C1)C(CN)N(C)[S](=O)(=O)CC2CCCN2""",21,"""6BC5CFB69CD9A594"""
+"""5449838FDBCE3B68_A818A67E6DDA24E1_6036_UN""","""CC1=CC(=CC=C1)C(CN)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""6BC5CFB69CD9A594"""
+"""F49ED1F4AC28515A_673C936A2C87ED41_6036_UN""","""CC1=CC(=CC=C1)C(CN)N([S](C)(=O)=O)C2CCCNC2""",21,"""6BC5CFB69CD9A594"""
+"""20ED42D4C619B4F4_B27B94F3DF01500B_6036_UN""","""CC1=CC(=CC=C1)C(CN)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""6BC5CFB69CD9A594"""
+"""8406805B543E7119_0A3DA05649D12D70_6036_UN""","""CC1=CC(=CC=C1)C(CN)N(CC)[S](=O)(=O)C2CCNC2""",21,"""6BC5CFB69CD9A594"""
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+"""0270DA6F7548F9D9_1BFBEEC1817C2B80_6036_UN""","""CC1=CC(=CC=C1)C(CN)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""6BC5CFB69CD9A594"""
+"""4F91CAA1151D51E5_0AEF3DE2920918B4_6036_UN""","""CC1=CC(=CC=C1)C(CN)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""6BC5CFB69CD9A594"""
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+"""CF06632E10179411_2A2B0DF031AB2ABE_6036_UN""","""CC1=CC(=CC=C1)C(CN)N(CCCN)[S](=O)(=O)C(F)F""",21,"""6BC5CFB69CD9A594"""
+"""E4D0A6193B63FB3C_D92BA71DABB4C56A_6036_UN""","""CC1=CC(=CC=C1)C(CN)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""6BC5CFB69CD9A594"""
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+"""308D23BAA21D15D0_A41D705D5188867D_6036_UN""","""CC1=CC(=CC=C1)C(CN)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""6BC5CFB69CD9A594"""
+"""A4E8B1807BCEB738_4BC6804987E4490B_6036_UN""","""CC1=CC(=CC=C1)C(CN)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""6BC5CFB69CD9A594"""
+"""158744DEE80EA84B_EC38AF0144435A11_6036_UN""","""CC1=CC(=CC=C1)C(CN)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""6BC5CFB69CD9A594"""
+"""2BAF0388CF6884AD_D47F5E509CF2481E_6036_UN""","""CC1=CC(=CC=C1)C(CN)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""6BC5CFB69CD9A594"""
+"""538C5C613FF7ECE8_7E215C5A452F25B8_6036_UN""","""CC1=CC(=CC=C1)C(CN)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""6BC5CFB69CD9A594"""
+"""846003E87E6A466B_DA83DA821B43CCC3_6036_UN""","""CC1=CC(=CC=C1)C(CN)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""6BC5CFB69CD9A594"""
+"""160466CD15720EFF_CACF04FE42440726_6036_UN""","""CC1=CC(=CC=C1)C(CN)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""6BC5CFB69CD9A594"""
+"""66901B2427EC4F09_879F7B2A776A9E1E_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](CC)(=O)=O)CC(=O)OC""",21,"""6C4B33E20E780091"""
+"""D73E4E3E8CD9A512_A4C2CE8EC8A97683_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""6C4B33E20E780091"""
+"""48F798E072155A54_8EB5E1F71A226B25_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""6C4B33E20E780091"""
+"""F53149B700ADF9E2_DC00F61ED6BADEBA_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""6C4B33E20E780091"""
+"""8618C7855DC8076F_BD4B25BD66A1BD40_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2CCCNC2""",21,"""6C4B33E20E780091"""
+"""7A846574BBA000E2_8B49199754C0F1F2_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)CC2CCCN2""",21,"""6C4B33E20E780091"""
+"""2A9A07D5FEA322A9_AF965A2AFF7B81E4_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""6C4B33E20E780091"""
+"""AD922DC24F04FCC2_60B26F3EBE264844_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2CCCNC2""",21,"""6C4B33E20E780091"""
+"""89CBB239BAC93F26_B5F568A74DA0F50E_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""6C4B33E20E780091"""
+"""83692FF0DB8FD0CB_0DB35C02DB708875_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(CC)[S](=O)(=O)C2CCNC2""",21,"""6C4B33E20E780091"""
+"""ED95285B805AA8D5_C810D23867B0A78C_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""6C4B33E20E780091"""
+"""2DAB634DE3FFC34B_6D4B475C2555A07B_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""6C4B33E20E780091"""
+"""CAED4412397605C3_63DA30161C33D3F4_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""6C4B33E20E780091"""
+"""8F7FB8391E6CCD98_8D435D27AB0C75F4_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CCNC2CC2""",21,"""6C4B33E20E780091"""
+"""F488D433E140DE8D_32DF18586218F65C_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""6C4B33E20E780091"""
+"""327CB8235B9B1DDE_8551E82B20641055_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2CCNCC2""",21,"""6C4B33E20E780091"""
+"""CFC65A60A4EB1C61_2BC38B6BFA731FFA_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""6C4B33E20E780091"""
+"""FE19790E125E35D0_33E75A87C8B6D34D_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""6C4B33E20E780091"""
+"""AE4E1933139FB3FA_D3AB13D195145021_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""6C4B33E20E780091"""
+"""0E6FF5A55E76DDCA_9FC5AED2A9120C05_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2CCNCC2""",21,"""6C4B33E20E780091"""
+"""6696EB33D656FCF6_E0DE7B933636C16B_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""6C4B33E20E780091"""
+"""5C1F9B0836646430_30A128916C19E98D_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""6C4B33E20E780091"""
+"""E862E55411181ED6_E290FBC304B54985_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""6C4B33E20E780091"""
+"""A8BC12EAA02E540C_59C122580C2266C1_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""6C4B33E20E780091"""
+"""90B53B07272A1D5C_AB60794B4439B8FB_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""6C4B33E20E780091"""
+"""1B5D856257ACC835_8B746DC244F9F8C7_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CC2CNCC2""",21,"""6C4B33E20E780091"""
+"""439FF91BE376B57D_B708D6D4130C5771_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""6C4B33E20E780091"""
+"""ED2BFA81F2C3C991_BE40CB4D6E0A260E_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""6C4B33E20E780091"""
+"""AF2DD516DC84B0AA_1C75129513DD8E85_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""6C4B33E20E780091"""
+"""5065086247D6B8D0_0D61C1B600A8BDB1_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""6C4B33E20E780091"""
+"""4F63A676464103C0_F8D7FF9AFA33538A_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(CCCN)[S](=O)(=O)C2CC2""",21,"""6C4B33E20E780091"""
+"""59791B8908133C6D_C4D3CB83B22445E4_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2CCCC(CC=C)[S]2(=O)=O""",21,"""6C4B33E20E780091"""
+"""FC267688A62E0F6E_2DA5F1A4A30A8FBB_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(CCCN)[S](=O)(=O)C(F)F""",21,"""6C4B33E20E780091"""
+"""AD4FFB97A038406E_DEA55B493915606F_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""6C4B33E20E780091"""
+"""2330C775E938CAA4_D7CB4BAAC000FFD0_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2CCCCNCC[S]2(=O)=O""",21,"""6C4B33E20E780091"""
+"""1E6B3696E23493C8_A3938C09C3292378_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""6C4B33E20E780091"""
+"""6B1BEF2150C588DF_4C487C1D1545EC0E_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""6C4B33E20E780091"""
+"""C78D5D501B5793DD_EBB65355D6E2FF14_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""6C4B33E20E780091"""
+"""A7F9A15D7E6E74FB_D3F1A2040E53ED1B_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""6C4B33E20E780091"""
+"""7C7F6025A0916A81_79AFA00ED78E80BD_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""6C4B33E20E780091"""
+"""D06AC52A36D1BBF8_DD0D26D689E269C6_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""6C4B33E20E780091"""
+"""D38E3D08CD6D0BA9_CD41F8AAD0E5A223_6036_UN""","""C(CSC1=CC=C(C=C1)Br)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""6C4B33E20E780091"""
+"""4037018BA36220D7_85C2D09DFCA3E243_6036_UN""","""CC(C)(CN([S](CC)(=O)=O)CC(=O)OC)NCC1CCC1""",21,"""6E16985585B17CCC"""
+"""32AC1A7C6CC23152_A69F653943600ADE_6036_UN""","""CC(C)(CN([C@H](C(OC)=O)C)[S](=O)(=O)C)NCC1CCC1""",21,"""6E16985585B17CCC"""
+"""66A4DABD17A63A4A_8CE84A4091EB1778_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)C1=CC=C(Br)S1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""BB24106D7BF50900_DE5D5DA95D73A2E7_6036_UN""","""CC(C)(CN1C2=C(C[S]1(=O)=O)C=CC=C2)NCC3CCC3""",21,"""6E16985585B17CCC"""
+"""D4B2060A8B738DD2_BF168E0AED68C11D_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)C1CCCNC1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""F5278EC8274FC94D_8914B220DF098DAF_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)CC1CCCN1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""48AB4185DEC749A1_ADCBF19D74B2FDB9_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)C1=CC=C(Cl)S1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""78AD21F242E215D3_62EFC48935EF3419_6036_UN""","""CC(C)(CN([S](C)(=O)=O)C1CCCNC1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""05B3B5582C257415_B7A8C310C6698953_6036_UN""","""CC(C)(CN([S](C)(=O)=O)C1=NN=C(N)S1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""D82FBC703C45B2C0_0FEEF7B550B9F428_6036_UN""","""CC(C)(CN(CC)[S](=O)(=O)C1CCNC1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""1C124D0EFE99119E_CA4D798FEC79DBD1_6036_UN""","""CC(C)(CN([S](C(C)(C)C)(=O)=O)CC=C)NCC1CCC1""",21,"""6E16985585B17CCC"""
+"""BCCD39C8E10DB220_6F16ECEBAE9CDC26_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)CC[S](=O)(=O)C)NCC1CCC1""",21,"""6E16985585B17CCC"""
+"""4489447286616D56_61879BA197FAAFA9_6036_UN""","""CC(C)(CN(C(C)(C)C)[S](=O)(=O)CCN)NCC1CCC1""",21,"""6E16985585B17CCC"""
+"""8C647E68982C8FC4_8F1EF69020C509A9_6036_UN""","""CC(C)(CN([S](C)(=O)=O)CCNC1CC1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""6E143BE50828ED7F_3082B3EFE9D18A01_6036_UN""","""CC(C)(CN([S](C)(=O)=O)C(=O)CN=[N]#N)NCC1CCC1""",21,"""6E16985585B17CCC"""
+"""B54350F0E370F4E9_870C439CABAD6C08_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)C1CCNCC1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""BE6010872981E036_299E20DC71BA63A7_6036_UN""","""CC(C)(CN1[S](CCC1C(OC)=O)(=O)=O)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""72F8E75BAF19D67E_31BAF130437FAF10_6036_UN""","""CC(C)(CN1[S](=O)(=O)C2=C(C1)C=CC=C2)NCC3CCC3""",21,"""6E16985585B17CCC"""
+"""8ABD4A88AC9C789F_D1F6B8661EDD2C7C_6036_UN""","""CC(C)(CN([S](C)(=O)=O)CC1=CC=NO1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""5BFF65F5E6F00B4C_9D98056522DB7058_6036_UN""","""CC(C)(CN([S](C)(=O)=O)C1CCNCC1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""5F32B4EA3231A3F0_E283D024BDFFBD36_6036_UN""","""CC(C)(CN([S](C)(=O)=O)C1=NC=CC=C1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""7C095FF350D9796A_32FC8326E7D095D0_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)C1=CN=CC=C1)NCC2CCC2""",21,"""6E16985585B17CCC"""
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+"""4CBADCB35D54AAD2_5B9C89EF87EB1A9C_6036_UN""","""CC(C)(CN(C)[S](=O)(=O)C1=C[N](C)C=N1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""875A438D20BBEC36_A93DD2FCCFF0C4A6_6036_UN""","""CC(C)(CN1CCCC(C(C)C)[S]1(=O)=O)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""55F6D5FEBC41BA74_8929C675CF30849A_6036_UN""","""CC(C)(CN([S](C)(=O)=O)CC1CNCC1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""E40705392AA7DBAF_B5557D6398C52B2C_6036_UN""","""CC(C)(CN([S](C)(=O)=O)[C@@H]1CNCCC1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""C82852B97A750E02_BC1D60FAE5C35A53_6036_UN""","""CC(C)(CN(CCCCl)[S](=O)(=O)C1CC1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""E5A0F642B34DB04C_1E28B9229814F2D8_6036_UN""","""CC(C)(CN1C(=O)C2=C([S]1(=O)=O)C=CS2)NCC3CCC3""",21,"""6E16985585B17CCC"""
+"""1C806C729E1715F9_0F3C6A018B61C1EC_6036_UN""","""CC(C)(CN(C(C(C)(C)N)=O)[S](=O)(=O)C)NCC1CCC1""",21,"""6E16985585B17CCC"""
+"""CA2C5076FDF6DB29_FA8A542D71FA2FD7_6036_UN""","""CC(C)(CN(CCCN)[S](=O)(=O)C1CC1)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""0376618BD2A3B1AE_C68E603439ED39B9_6036_UN""","""CC(C)(CN1CCCC(CC=C)[S]1(=O)=O)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""3971FEEDF69F7170_2FF85A1328C3F3E6_6036_UN""","""CC(C)(CN(CCCN)[S](=O)(=O)C(F)F)NCC1CCC1""",21,"""6E16985585B17CCC"""
+"""5FC35033A712801D_DCF8F0FEB2DC1C32_6036_UN""","""CC(C)(CN1[S](C2(CC1CI)CC2)(=O)=O)NCC3CCC3""",21,"""6E16985585B17CCC"""
+"""607BD67449D4E3FC_D596E01D4BC9838D_6036_UN""","""CC(C)(CN1CCCCNCC[S]1(=O)=O)NCC2CCC2""",21,"""6E16985585B17CCC"""
+"""74710C420C4AF418_A1CE27BE48E05F25_6036_UN""","""CC(C)(CN1[S](=O)(=O)C2(C1)CCOCC2)NCC3CCC3""",21,"""6E16985585B17CCC"""
+"""9B63960987F4E1C7_4E15D7AA9E8C9053_6036_UN""","""CC(C)(CN1C(CN)CC2([S]1(=O)=O)CC2)NCC3CCC3""",21,"""6E16985585B17CCC"""
+"""F813B254004D56E5_E9EBF8E25D2B8349_6036_UN""","""CC(C)(CN([S](=O)(=O)C1CC1)C2CNC2)NCC3CCC3""",21,"""6E16985585B17CCC"""
+"""7EDA90F970A235C2_D1AC09B3859A9146_6036_UN""","""CC(C)(CN1CC2(C[S]1(=O)=O)CCCC2)NCC3CCC3""",21,"""6E16985585B17CCC"""
+"""46C20E5E000FBE3F_7BF20BB95C47FCE0_6036_UN""","""CC(C)(CN([S](=O)(=O)C1CNC1)C2CC2)NCC3CCC3""",21,"""6E16985585B17CCC"""
+"""06C9E8A89DAAAB8C_DF508D61022B159B_6036_UN""","""CC(C)(CN([S](C)(=O)=O)CC[S](=O)(=O)Cl)NCC1CCC1""",21,"""6E16985585B17CCC"""
+"""FD8A239D88AFDF2C_CF1C531D5B2CDE7E_6036_UN""","""CC(C)(CN(CCC)[S](=O)(=O)C(F)(F)F)NCC1CCC1""",21,"""6E16985585B17CCC"""
+"""076C357152D226BC_87AE3681E4FD74C1_2267_UN""","""COC(CC#CC1=CC=C(C(CCC(O)=O)=O)C=C1)OC""",21,"""7044E6971D42F5D8"""
+"""10A38E2F20D035FE_197DBFD70B0A2392_2267_UN""","""COC(CC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O)OC""",21,"""7044E6971D42F5D8"""
+"""152B1F567C8A2A6B_FD834C94E93A3E37_2267_UN""","""COC(CC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O)OC""",21,"""7044E6971D42F5D8"""
+"""3F170A7C0035B99C_9AB5BA7A5AA4BDBC_2267_UN""","""COC(CC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2)OC""",21,"""7044E6971D42F5D8"""
+"""2CA8C2EE13633203_11341188DCB674AD_2267_UN""","""COC(CC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O)OC""",21,"""7044E6971D42F5D8"""
+"""0D51912FE50C3FAC_E1BF030F6AF29CF8_2267_UN""","""COC(CC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2)OC""",21,"""7044E6971D42F5D8"""
+"""DD44F640FC0A52D9_21B002D2E020C063_2267_UN""","""COC(CC#CC1=CC=C(C=C1)C(=O)C2CCCO2)OC""",21,"""7044E6971D42F5D8"""
+"""D15C05C1E80F20D1_66D598AA9AB0E70F_2267_UN""","""COC(CC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F)OC""",21,"""7044E6971D42F5D8"""
+"""A68BA6D11FF99456_69F8C87FB41A64E3_2267_UN""","""COC(CC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F)OC""",21,"""7044E6971D42F5D8"""
+"""EEF5F67C283E11AE_0F04F6B4150F0985_2267_UN""","""COC(CC#CC1=C(C(NCC(O)=O)=O)C=CC=C1)OC""",21,"""7044E6971D42F5D8"""
+"""934BE49922EC129E_A5D046F39BCC132A_2267_UN""","""COC(CC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C)OC""",21,"""7044E6971D42F5D8"""
+"""C8FC608FA1CEC18F_455415FED32E4BF4_2267_UN""","""COC(CC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2)OC""",21,"""7044E6971D42F5D8"""
+"""690BF74A8ECD2D03_207FDA0838BDCDFD_2267_UN""","""COC(CC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F)OC""",21,"""7044E6971D42F5D8"""
+"""EB7CD31C378C18A5_E255EEB6D32D07AF_2267_UN""","""COC(CC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2)OC""",21,"""7044E6971D42F5D8"""
+"""A83E39B996FB80B7_5C98D15F75261020_2267_UN""","""COC(CC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O)OC""",21,"""7044E6971D42F5D8"""
+"""FAD0FB02C39554FB_7473C0176F637B2D_2267_UN""","""COC(CC#CC1=C(C(OCC)=O)C=N[N]1C(C)C)OC""",21,"""7044E6971D42F5D8"""
+"""38F42C3B58A6805A_B70C36FE6DEBA013_2267_UN""","""COC(CC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N)OC""",21,"""7044E6971D42F5D8"""
+"""90A6634912472682_621C1442FCA33E40_2267_UN""","""COC(CC#CC2=CC=C(CC1(C)NCCC1)C=C2)OC""",21,"""7044E6971D42F5D8"""
+"""008D9274FE34F50F_C1A25D4F723A592C_2267_UN""","""COC(CC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12)OC""",21,"""7044E6971D42F5D8"""
+"""C86F866F4ADB219D_EAADF05B8D44130F_2267_UN""","""COC(CC#CC1=C(C)C=C(C(=C1)C)C2OCCO2)OC""",21,"""7044E6971D42F5D8"""
+"""8234F2DAE87B36E3_06208178FD7C3AD2_2267_UN""","""COC(CC#CC1=CC=C(C=C1)C2NCCNC2=O)OC""",21,"""7044E6971D42F5D8"""
+"""D476F1B689BDA3DB_FC9D9A44C35446D4_2267_UN""","""COC(CC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2)OC""",21,"""7044E6971D42F5D8"""
+"""03B687A93216148E_5AF10E21E1918110_2267_UN""","""COC(CC#CC(B1OC(CN(C)CC(O1)=O)=O)=C)OC""",21,"""7044E6971D42F5D8"""
+"""1FE35977D5F67CF0_D09C3F2EE61F0A44_2267_UN""","""COC(CC#CC1=C[N](CC(OCC)OCC)N=C1)OC""",21,"""7044E6971D42F5D8"""
+"""E3E9DB2088A0F9F6_0C0AFFFC83D4F00F_2267_UN""","""COC(CC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12)OC""",21,"""7044E6971D42F5D8"""
+"""445120CAF11DACB9_BA186BFA87339FA3_2267_UN""","""COC(CC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N)OC""",21,"""7044E6971D42F5D8"""
+"""E7A93B0363432FEC_BF15F281EFC4F836_2267_UN""","""COC(CC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2)OC""",21,"""7044E6971D42F5D8"""
+"""0E30AF49AB96C42D_46D03AC95D1C561C_2267_UN""","""COC(CC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3)OC""",21,"""7044E6971D42F5D8"""
+"""645BDF18B8B9DB72_620A3E130BB25D94_2267_UN""","""COC(CC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2)OC""",21,"""7044E6971D42F5D8"""
+"""80B98326B5A13D8A_15628301CC6737E3_2267_UN""","""COC(CC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O)OC""",21,"""7044E6971D42F5D8"""
+"""7B08648311AFBEF4_C329672304B8EED2_2267_UN""","""COC(CC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C)OC""",21,"""7044E6971D42F5D8"""
+"""60E20131B568F4E6_E7B698CB3C463469_2267_UN""","""COC(CC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O)OC""",21,"""7044E6971D42F5D8"""
+"""E8A2421111EA7910_68A66F57FDCA55E0_2267_UN""","""COC(CC#CC1=CC(=CC=C1)CC2=CC=CC=C2)OC""",21,"""7044E6971D42F5D8"""
+"""3B59714361F1C97F_21B342E672624AF3_2267_UN""","""COC(CC#CC1=CC=C(C=C1)CN2CCCCC2)OC""",21,"""7044E6971D42F5D8"""
+"""36343AA70C247C55_FD9778844DE57479_2267_UN""","""COC(CC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O)OC""",21,"""7044E6971D42F5D8"""
+"""003CD8AECE86669A_32256C725A7D99C8_2267_UN""","""COC(CC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2)OC""",21,"""7044E6971D42F5D8"""
+"""789CAF7D9A1152D5_760F9BD7CD534D1E_2267_UN""","""COC(CC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O)OC""",21,"""7044E6971D42F5D8"""
+"""34F0E4C1D654180E_0DA9158A2523684E_2267_UN""","""COC(CC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2)OC""",21,"""7044E6971D42F5D8"""
+"""435C273165F392EE_3F0FAD125ECC4014_2267_UN""","""COC(CC#CC1=CC=C(CCCCC(O)=O)C=C1)OC""",21,"""7044E6971D42F5D8"""
+"""D0CE687745B1C5D3_0A2CA5D568B93B1B_2267_UN""","""COC(CC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3)OC""",21,"""7044E6971D42F5D8"""
+"""236C0A7E0D217319_529E6F8FA8E5CE0E_2267_UN""","""COC(CC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O)OC""",21,"""7044E6971D42F5D8"""
+"""044383F5FB29E508_0AF818E1B6B73797_2267_UN""","""COC(CC#CC2=NC1=C(OC)C=CC(=C1S2)OC)OC""",21,"""7044E6971D42F5D8"""
+"""0F0D4F2AAB5BF161_8743A2127669557C_2267_UN""","""NC(=O)NCCC#CC1=CC=C(C(CCC(O)=O)=O)C=C1""",21,"""70A972048FD6D465"""
+"""D5CE3BF3859A9AC2_19902B44999E022F_2267_UN""","""NC(=O)NCCC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O""",21,"""70A972048FD6D465"""
+"""0F046077776D7B5B_FD6ED8077BAE1F8A_2267_UN""","""NC(=O)NCCC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""70A972048FD6D465"""
+"""7CCC18F8940C98B0_9A582EE9C8309C01_2267_UN""","""NC(=O)NCCC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""70A972048FD6D465"""
+"""2E3B28CCB981767C_11D9851B4E225510_2267_UN""","""NC(=O)NCCC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""70A972048FD6D465"""
+"""D2F42F7D7D35BC05_E152979CF866BD45_2267_UN""","""NC(=O)NCCC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""70A972048FD6D465"""
+"""0904A2A5C4B434D7_215D964172B4E1DE_2267_UN""","""NC(=O)NCCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""70A972048FD6D465"""
+"""FE6CF37D0F3A979C_66380C390824C6B2_2267_UN""","""NC(=O)NCCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""70A972048FD6D465"""
+"""ED2D746D50A6854E_69155CEC268E455E_2267_UN""","""NC(=O)NCCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""70A972048FD6D465"""
+"""1DBBC3062488E21B_0FE96227879B2838_2267_UN""","""NC(=O)NCCC#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""70A972048FD6D465"""
+"""3AA3668FA40CA8E5_A53DD26009583297_2267_UN""","""NC(=O)NCCC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""70A972048FD6D465"""
+"""3D1342467ADE8453_45B9816D41BA6A49_2267_UN""","""NC(=O)NCCC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""70A972048FD6D465"""
+"""020F296C8CA1BD67_20924E9BAA29EC40_2267_UN""","""NC(=O)NCCC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""70A972048FD6D465"""
+"""219CC9E7B09A1B8B_E2B87A2541B92612_2267_UN""","""NC(=O)NCCC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2""",21,"""70A972048FD6D465"""
+"""1E975BBD53FC599C_5C7545CCE7B2319D_2267_UN""","""NC(=O)NCCC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""70A972048FD6D465"""
+"""2FC772D8826840A5_749E5484FDF75A90_2267_UN""","""NC(=O)NCCC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""70A972048FD6D465"""
+"""A86F0B4DB8515052_B7E1A26DFF7F81AE_2267_UN""","""NC(=O)NCCC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""70A972048FD6D465"""
+"""76EA60D93A602418_62F180D16E371FFD_2267_UN""","""NC(=O)NCCC#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""70A972048FD6D465"""
+"""98086F8ED47421BD_C14FC9DCE0AE7891_2267_UN""","""NC(=O)NCCC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""70A972048FD6D465"""
+"""923FD37120478C16_EA4064C81FD032B2_2267_UN""","""NC(=O)NCCC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""70A972048FD6D465"""
+"""F94AAEB13F39672A_06CD15EB6FE81B6F_2267_UN""","""NC(=O)NCCC#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""70A972048FD6D465"""
+"""A8B3F6F87DD03274_FC700ED751C06769_2267_UN""","""NC(=O)NCCC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""70A972048FD6D465"""
+"""A7B97D53D399C6A1_5A1C9AB27305A0AD_2267_UN""","""NC(=O)NCCC#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""70A972048FD6D465"""
+"""262DE2DB5009A360_D071ABBD748B2BF9_2267_UN""","""NC(=O)NCCC#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""70A972048FD6D465"""
+"""7E2ED7AA3E52697E_0CE76B6F1140D1B2_2267_UN""","""NC(=O)NCCC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""70A972048FD6D465"""
+"""B97A9BE85FE5D0EA_BAF5FF6915A7BE1E_2267_UN""","""NC(=O)NCCC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""70A972048FD6D465"""
+"""8C6B16A1BA44A545_BFF866127D50D98B_2267_UN""","""NC(=O)NCCC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""70A972048FD6D465"""
+"""6D6FBF715D98A506_463DAE5ACF8877A1_2267_UN""","""NC(=O)NCCC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""70A972048FD6D465"""
+"""F672BC28870A0DB3_62E7AA8099267C29_2267_UN""","""NC(=O)NCCC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""70A972048FD6D465"""
+"""41AB9A6EADFAF9D6_158F17925EF3165E_2267_UN""","""NC(=O)NCCC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""70A972048FD6D465"""
+"""5DEEA47B46DF43D8_C3C4F3B0962CCF6F_2267_UN""","""NC(=O)NCCC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""70A972048FD6D465"""
+"""805D625F3AD7572E_E75B0C58AED215D4_2267_UN""","""NC(=O)NCCC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""70A972048FD6D465"""
+"""EF4E32618CE3071C_684BFBC46F5E745D_2267_UN""","""NC(=O)NCCC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""70A972048FD6D465"""
+"""906D966D7E600020_215ED675E0F66B4E_2267_UN""","""NC(=O)NCCC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""70A972048FD6D465"""
+"""89CCADD1556B3926_FD7AEC17DF7155C4_2267_UN""","""NC(=O)NCCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""70A972048FD6D465"""
+"""2F6130162760D9D7_32C8F8E1C8E9B875_2267_UN""","""NC(=O)NCCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""70A972048FD6D465"""
+"""44D109613D4DC808_76E20F445FC76CA3_2267_UN""","""NC(=O)NCCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""70A972048FD6D465"""
+"""DD051AFBF33F44E0_0D448119B7B749F3_2267_UN""","""NC(=O)NCCC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""70A972048FD6D465"""
+"""9D543009929C6F3F_3FE23981CC5861A9_2267_UN""","""NC(=O)NCCC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""70A972048FD6D465"""
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+"""F30CEDFAB9A01E19_B30D5F2362243413_6036_UN""","""CC(CN1CCNC(C)C1)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""70D036EB9327B566"""
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+"""5098C26DE631405D_2F7C5F8E55E966BA_6036_UN""","""CC(CN1CCNC(C)C1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""70D036EB9327B566"""
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+"""2B8BE60E6FA3C419_FC457E9AAB69749C_6036_UN""","""CC(CN1CCNC(C)C1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""70D036EB9327B566"""
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+"""FEE0E0F884303441_FE0BFECA99EAFC72_6036_UN""","""CC(CN1CCNC(C)C1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""70D036EB9327B566"""
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+"""0AA691A8DC3C4790_B7FB7C42D9660D0C_6036_UN""","""CC(CN1CCNC(C)C1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""70D036EB9327B566"""
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+"""6E0495BE2AA604FD_AB93D3DD8E53E286_6036_UN""","""CC(CN1CCNC(C)C1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""70D036EB9327B566"""
+"""DE6EC43C5B7880A7_A2DBCE44F35593F9_6036_UN""","""CC(CN1CCNC(C)C1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""70D036EB9327B566"""
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+"""0F3A68B913EADF89_11FAC4BF9DF70846_6036_UN""","""CC(CN1CCNC(C)C1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""70D036EB9327B566"""
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+"""DF6505AF3428865B_C23E5E40A44AD598_6036_UN""","""CC(CN1CCNC(C)C1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""70D036EB9327B566"""
+"""F3DD6410F7006C22_CB504EA35D5F4A27_6036_UN""","""CC(CN1CCNC(C)C1)N2CCCCNCC[S]2(=O)=O""",21,"""70D036EB9327B566"""
+"""B2832BB0E8086B4C_BF0889005E76968F_6036_UN""","""CC(CN1CCNC(C)C1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""70D036EB9327B566"""
+"""89F5A2E0D2123B4D_50D37914881A59F9_6036_UN""","""CC(CN1CCNC(C)C1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""70D036EB9327B566"""
+"""737E0897EC110D16_F72D565C4BBD4AE3_6036_UN""","""CC(CN1CCNC(C)C1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""70D036EB9327B566"""
+"""7612148EB2C5635F_CF6AA70D930C58EC_6036_UN""","""CC(CN1CCNC(C)C1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""70D036EB9327B566"""
+"""EF1E3C39AC140315_6534A5074AD1354A_6036_UN""","""CC(CN1CCNC(C)C1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""70D036EB9327B566"""
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+"""3EA2834CD193FDF7_D1DAFDA34DBA17D4_6036_UN""","""CC(CN1CCNC(C)C1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""70D036EB9327B566"""
+"""751AEFCF8368135E_9DFF8FFF7B97267C_6036_UN""","""NCC(CN1CCCCC1)N([S](CC)(=O)=O)CC(=O)OC""",21,"""762BC7370285B8F3"""
+"""3F8CF8D86F73A65E_BEA23A5BC454CEE1_6036_UN""","""NCC(CN1CCCCC1)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""762BC7370285B8F3"""
+"""236E80BC992395FB_94D5152216DFD347_6036_UN""","""NCC(CN1CCCCC1)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""762BC7370285B8F3"""
+"""B3BAD6DF056F3E3F_C66002CBDA4766D8_6036_UN""","""NCC(CN1CCCCC1)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""762BC7370285B8F3"""
+"""E21C231F84B80C17_A72BD1686A5C0522_6036_UN""","""NCC(CN1CCCCC1)N(C)[S](=O)(=O)C2CCCNC2""",21,"""762BC7370285B8F3"""
+"""86A467F701926FCE_9129ED42583D4990_6036_UN""","""NCC(CN1CCCCC1)N(C)[S](=O)(=O)CC2CCCN2""",21,"""762BC7370285B8F3"""
+"""25B5C1851AD467A6_B5F6AEFFF3863986_6036_UN""","""NCC(CN1CCCCC1)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""762BC7370285B8F3"""
+"""90E95AAEE209ED3D_7AD29BEBB2DBF026_6036_UN""","""NCC(CN1CCCCC1)N([S](C)(=O)=O)C2CCCNC2""",21,"""762BC7370285B8F3"""
+"""6E1AF192184A2602_AF959C72415D4D6C_6036_UN""","""NCC(CN1CCCCC1)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""762BC7370285B8F3"""
+"""8D4581F842FD7887_17D3A8D7D78D3017_6036_UN""","""NCC(CN1CCCCC1)N(CC)[S](=O)(=O)C2CCNC2""",21,"""762BC7370285B8F3"""
+"""6038165EACC6B916_D27026ED6B4D1FEE_6036_UN""","""NCC(CN1CCCCC1)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""762BC7370285B8F3"""
+"""E5B39C3A64173B1C_772BB38929A81819_6036_UN""","""NCC(CN1CCCCC1)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""762BC7370285B8F3"""
+"""0AA66C51FBB7D1CB_79BAC4C310CE6B96_6036_UN""","""NCC(CN1CCCCC1)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""762BC7370285B8F3"""
+"""6998182C454FC270_9723A9F2A7F1CD96_6036_UN""","""NCC(CN1CCCCC1)N([S](C)(=O)=O)CCNC2CC2""",21,"""762BC7370285B8F3"""
+"""296D12A6C53C6A4A_28BFEC8D6EE54E3E_6036_UN""","""NCC(CN1CCCCC1)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""762BC7370285B8F3"""
+"""5E89E92094F1EDB7_9F311CFE2C99A837_6036_UN""","""NCC(CN1CCCCC1)N(C)[S](=O)(=O)C2CCNCC2""",21,"""762BC7370285B8F3"""
+"""A5B2D948B39F42CB_31A37FBEF68EA798_6036_UN""","""NCC(CN1CCCCC1)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""762BC7370285B8F3"""
+"""6E7057B5C17C5C80_2987AE52C44B6B2F_6036_UN""","""NCC(CN1CCCCC1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""762BC7370285B8F3"""
+"""12BCB8C59551336D_C9CBE70499E9E843_6036_UN""","""NCC(CN1CCCCC1)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""762BC7370285B8F3"""
+"""037DD48395159C9D_85A55A07A5EFB467_6036_UN""","""NCC(CN1CCCCC1)N([S](C)(=O)=O)C2CCNCC2""",21,"""762BC7370285B8F3"""
+"""FE4B559660CCE9D3_FABE8F463ACB7909_6036_UN""","""NCC(CN1CCCCC1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""762BC7370285B8F3"""
+"""B1DF54A9E0594B1C_2AC1DC4460E451EF_6036_UN""","""NCC(CN1CCCCC1)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""762BC7370285B8F3"""
+"""2DBAD1F9DEDA2D4E_F8F00F160848F1E7_6036_UN""","""NCC(CN1CCCCC1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""762BC7370285B8F3"""
+"""3442EDBD6A339A39_43A1D68D00DFDEA3_6036_UN""","""NCC(CN1CCCCC1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""762BC7370285B8F3"""
+"""0A86FADD06DB215C_B1008D9E48C40099_6036_UN""","""NCC(CN1CCCCC1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""762BC7370285B8F3"""
+"""E95877B198D30685_91149917480440A5_6036_UN""","""NCC(CN1CCCCC1)N([S](C)(=O)=O)CC2CNCC2""",21,"""762BC7370285B8F3"""
+"""1DA01943EC33D8C1_AD6822011FF1EF13_6036_UN""","""NCC(CN1CCCCC1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""762BC7370285B8F3"""
+"""0572C7D88D1C4F47_A4203F9862F79E6C_6036_UN""","""NCC(CN1CCCCC1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""762BC7370285B8F3"""
+"""EDD678D1648D15BC_0615E6401F2036E7_6036_UN""","""NCC(CN1CCCCC1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""762BC7370285B8F3"""
+"""8FF5D9E1828A3500_170135630C5505D3_6036_UN""","""NCC(CN1CCCCC1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""762BC7370285B8F3"""
+"""1F414FDA671C3486_E2B70B4FF6CEEBE8_6036_UN""","""NCC(CN1CCCCC1)N(CCCN)[S](=O)(=O)C2CC2""",21,"""762BC7370285B8F3"""
+"""B7ED337F59827FCE_DEB33F56BED9FD86_6036_UN""","""NCC(CN1CCCCC1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""762BC7370285B8F3"""
+"""97C400607FDB591B_37C50571AFF737D9_6036_UN""","""NCC(CN1CCCCC1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""762BC7370285B8F3"""
+"""584AD47FE6B28954_C4C5AF9C35E8D80D_6036_UN""","""NCC(CN1CCCCC1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""762BC7370285B8F3"""
+"""244816666D012EB4_CDABBF7FCCFD47B2_6036_UN""","""NCC(CN1CCCCC1)N2CCCCNCC[S]2(=O)=O""",21,"""762BC7370285B8F3"""
+"""4F96AD281CACDD3D_B9F378DCCFD49B1A_6036_UN""","""NCC(CN1CCCCC1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""762BC7370285B8F3"""
+"""1C97984F849A0E3C_562888C819B8546C_6036_UN""","""NCC(CN1CCCCC1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""762BC7370285B8F3"""
+"""2F9210707601B0C7_F1D6A780DA1F4776_6036_UN""","""NCC(CN1CCCCC1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""762BC7370285B8F3"""
+"""B9A63C2A8BA32B64_C99156D102AE5579_6036_UN""","""NCC(CN1CCCCC1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""762BC7370285B8F3"""
+"""6EE8D19E0862FA57_63CF54DBDB7338DF_6036_UN""","""NCC(CN1CCCCC1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""762BC7370285B8F3"""
+"""FA9B9631CA3F0F83_C76DD203851FD1A4_6036_UN""","""NCC(CN1CCCCC1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""762BC7370285B8F3"""
+"""E47FC3EE6FAEF913_D7210C7FDC181A41_6036_UN""","""NCC(CN1CCCCC1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""762BC7370285B8F3"""
+"""8F37891934B51DF7_812DC23FC7DFE34D_2267_UN""","""NC1(CCC1)CC#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""76C712293E606254"""
+"""CB80E1B63E3DB757_1FFE4B692828B41E_2267_UN""","""NC1(CCC1)CC#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""76C712293E606254"""
+"""F41F8BAEE7B4D6ED_FB00B82ACA18A9BB_2267_UN""","""NC1(CCC1)CC#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""76C712293E606254"""
+"""328DAA9D91CCDE04_9C364EC479862A30_2267_UN""","""NC1(CCC1)CC#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""76C712293E606254"""
+"""E1175418870BD70C_17B7E536FF94E321_2267_UN""","""NC1(CCC1)CC#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""76C712293E606254"""
+"""E7DA735678FA74ED_E73CF7B149D00B74_2267_UN""","""NC1(CCC1)CC#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""76C712293E606254"""
+"""7DD245714D3F4D9C_2733F66CC30257EF_2267_UN""","""NC1(CCC1)CC#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""76C712293E606254"""
+"""C927DE9444B9B90E_60566C14B9927083_2267_UN""","""NC1(CCC1)CC#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""76C712293E606254"""
+"""88B63C0EFC3C344E_6F7B3CC19738F36F_2267_UN""","""NC1(CCC1)CC#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""76C712293E606254"""
+"""81A95B1A7710B333_0987020A362D9E09_2267_UN""","""NC1(CCC1)CC#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""76C712293E606254"""
+"""4D8059FF9DC1F8C5_A353B24DB8EE84A6_2267_UN""","""NC1(CCC1)CC#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""76C712293E606254"""
+"""66EF159B5AD5C1CF_43D7E140F00CDC78_2267_UN""","""NC1(CCC1)CC#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""76C712293E606254"""
+"""80327AA12FC5ADD7_26FC2EB61B9F5A71_2267_UN""","""NC1(CCC1)CC#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""76C712293E606254"""
+"""DDFDAA7F4DFC3336_E4D61A08F00F9023_2267_UN""","""NC1(CCC1)CC#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""76C712293E606254"""
+"""53BC0BF5FD78D972_5A1B25E1560487AC_2267_UN""","""NC1(CCC1)CC#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""76C712293E606254"""
+"""861A32276EA52114_72F034A94C41ECA1_2267_UN""","""NC1(CCC1)CC#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""76C712293E606254"""
+"""64C28613954B3842_B18FC2404EC9379F_2267_UN""","""NC1(CCC1)CC#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""76C712293E606254"""
+"""E66A65D8FF9297B8_649FE0FCDF81A9CC_2267_UN""","""NC1(CCC1)CC#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""76C712293E606254"""
+"""C10CC976D189CB2B_C721A9F15118CEA0_2267_UN""","""NC1(CCC1)CC#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""76C712293E606254"""
+"""896E2203AEC13CEA_EC2E04E5AE668483_2267_UN""","""NC1(CCC1)CC#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""76C712293E606254"""
+"""7870485D030CF91A_00A375C6DE5EAD5E_2267_UN""","""NC1(CCC1)CC#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""76C712293E606254"""
+"""4CE414E6F70671C2_FA1E6EFAE076D158_2267_UN""","""NC1(CCC1)CC#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""76C712293E606254"""
+"""E8194CFE2499A0F9_5C72FA9FC2B3169C_2267_UN""","""NC1(CCC1)CC#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""76C712293E606254"""
+"""6C7AB1796D6F318D_D61FCB90C53D9DC8_2267_UN""","""NC1(CCC1)CC#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""76C712293E606254"""
+"""3C5E25227DD58E41_0A890B42A0F66783_2267_UN""","""NC1(CCC1)CC#CC2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""76C712293E606254"""
+"""7C2A3EFD2B6E0AD7_BC9B9F44A411082F_2267_UN""","""NC1(CCC1)CC#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""76C712293E606254"""
+"""F937A6F3D1D5E693_B996063FCCE66FBA_2267_UN""","""NC1(CCC1)CC#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""76C712293E606254"""
+"""A73EAB1729E73B18_4053CE777E3EC190_2267_UN""","""NC1(CCC1)CC#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""76C712293E606254"""
+"""97FBD756B3F8BDAF_6489CAAD2890CA18_2267_UN""","""NC1(CCC1)CC#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""76C712293E606254"""
+"""41A50EBCDD23F736_13E177BFEF45A06F_2267_UN""","""NC1(CCC1)CC#CC2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""76C712293E606254"""
+"""EB0BBB89F47B6C42_C5AA939D279A795E_2267_UN""","""NC1(CCC1)CC#CC2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""76C712293E606254"""
+"""0C912AD0FF9387F5_E1356C751F64A3E5_2267_UN""","""NC1(CCC1)CC#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""76C712293E606254"""
+"""07F3F58A85DD3B77_6E259BE9DEE8C26C_2267_UN""","""NC1(CCC1)CC#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""76C712293E606254"""
+"""A4B87E1CC7ABD1E6_2730B6585140DD7F_2267_UN""","""NC1(CCC1)CC#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""76C712293E606254"""
+"""99ADA07F7C82855E_FB148C3A6EC7E3F5_2267_UN""","""NC1(CCC1)CC#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""76C712293E606254"""
+"""D77D07F8AC232491_34A698CC795F0E44_2267_UN""","""NC1(CCC1)CC#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""76C712293E606254"""
+"""3FC4DA1E7947691F_708C6F69EE71DA92_2267_UN""","""NC1(CCC1)CC#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""76C712293E606254"""
+"""7B10FA5DBC96D98F_0B2AE1340601FFC2_2267_UN""","""NC1(CCC1)CC#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""76C712293E606254"""
+"""BC0E039542B49B13_398C59AC7DEED798_2267_UN""","""NC1(CCC1)CC#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""76C712293E606254"""
+"""C7CE439594F78A72_0CAF516B4B9BAC97_2267_UN""","""NC1(CCC1)CC#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""76C712293E606254"""
+"""3427745E2BD76A98_541D9B318BC75982_2267_UN""","""NC1(CCC1)CC#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""76C712293E606254"""
+"""1ED3A04F0FE07CFB_0C7BEC5F9595A01B_2267_UN""","""NC1(CCC1)CC#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""76C712293E606254"""
+"""7C13FF354B53B371_C481CF946636529D_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC(C(OC)=O)N""",21,"""76C9878384068094"""
+"""08F0EC50ECFF6E64_BA99C06350137087_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3CCNCC3""",21,"""76C9878384068094"""
+"""B6DAAD8F03B5DC64_560ABA4B51580A89_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3CCCNC3""",21,"""76C9878384068094"""
+"""1E1CEC01702EFFE8_CBD045C43E530F9E_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3NCCNC3""",21,"""76C9878384068094"""
+"""130C37A5448930A5_2F8CF77986077680_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC(CC=CC)N""",21,"""76C9878384068094"""
+"""02B1AEED83638119_6DE6D5BA3E57291A_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC(CC(C)C)N""",21,"""76C9878384068094"""
+"""CC783EA940C136AD_AD307CEEDA129C6B_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3(N)CCCC3""",21,"""76C9878384068094"""
+"""2E1F257B6B5986BA_2E89F2F3B86168DA_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)C[C@@H]3CCCNC3""",21,"""76C9878384068094"""
+"""74D3117320818C2B_440EC926A9681864_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)C[C@@H]3CCCCN3""",21,"""76C9878384068094"""
+"""92482441CD15A203_07EF842682048287_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3OCCNC3""",21,"""76C9878384068094"""
+"""7F5F352C9CF741AB_C68AFB691BE73A52_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CCC3(CNC3)N""",21,"""76C9878384068094"""
+"""FB17AF91ADA16812_848C385BAA2608AB_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC(N)CC(F)F""",21,"""76C9878384068094"""
+"""2361C48C51A371D8_E6C75BEA2A6BF3C2_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)C[C@@H](C(OC)=O)N""",21,"""76C9878384068094"""
+"""70111E5E30BAB7C5_00A8B0BB18201B11_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3COCCN3""",21,"""76C9878384068094"""
+"""B8ADC966E9461F5A_BA36A8EE5BECB1FD_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC(CCN)(C)C""",21,"""76C9878384068094"""
+"""D741DBE545B3AC2D_31351F423FFD427F_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3(CCNC3)C""",21,"""76C9878384068094"""
+"""C05C3DB19B647A44_81CCF5F0FE72C8D3_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC34CC(N)(C3)C4""",21,"""76C9878384068094"""
+"""7424E4C2385AD5B2_CC923D148E6CBAAC_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CCCNC3CC3""",21,"""76C9878384068094"""
+"""B846B429259C9F78_EE24C95CD0970631_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC(=C3CNC3)F""",21,"""76C9878384068094"""
+"""BAB1B271EF95410A_BDF429800F73A2BE_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC[C@H]3CCCN3""",21,"""76C9878384068094"""
+"""AFF0B44292DAC28F_BEA94F413C3AAB94_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)C[C@H]3CC[C@@H](N)C3""",21,"""76C9878384068094"""
+"""0987C1D6327DC697_E35FCD7E12E01808_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)C[C@H]3COC[C@H]3N""",21,"""76C9878384068094"""
+"""1B140086F3AE554E_A07829CC25334FBB_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)C[C@H]3CCC[C@H]3N""",21,"""76C9878384068094"""
+"""10C5BC724CC4143E_84525AE02824E0E3_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3C(CN3)(C)C""",21,"""76C9878384068094"""
+"""D70D851B230919B4_F81FF69C7C2BCD56_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CCCNC(C)C""",21,"""76C9878384068094"""
+"""117F09AA5FEE91E2_50C4E87064CA9AB6_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CCC3(CN)CC3""",21,"""76C9878384068094"""
+"""C2603AB6FA80BE42_4370CDC3CAD9C4DC_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC(C(C)C)ON""",21,"""76C9878384068094"""
+"""BA7FA494E2E6ED9C_6BEC37C3A2C3899A_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC(C(C)C)CN""",21,"""76C9878384068094"""
+"""8AD27836944725D8_5BDE267A51AE5FB7_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3=CNCCO3""",21,"""76C9878384068094"""
+"""CAC0114F9F52BC12_6381C9E18973DB0F_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3=CNCCC3""",21,"""76C9878384068094"""
+"""7C362F617DB0C1BB_0EBC149A5308580E_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CCC3CC(N)C3""",21,"""76C9878384068094"""
+"""E7A5EE2021DF3F0B_6869D7AC9ED3494D_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)C[C@@H]3COCCN3""",21,"""76C9878384068094"""
+"""A80A18D64934187B_976D536F1FFAEC55_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CCCC(CC)N""",21,"""76C9878384068094"""
+"""1BFE2C0AA1115738_81987800AB1A3840_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3(CN)COC3""",21,"""76C9878384068094"""
+"""70D45282E44D0769_AA86F49DE5C08C80_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CCCCCCN""",21,"""76C9878384068094"""
+"""013C77B5D6151CBB_A113A9305FF79A56_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3[C@@H]4CNC[C@H]34""",21,"""76C9878384068094"""
+"""A0393ACFA2875646_79C7372B00FFA574_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3(CNC3)C#N""",21,"""76C9878384068094"""
+"""C624C6B0976DC90B_6CAFB6B308942162_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)C[C@@H]3C[C@H](N)C=C3""",21,"""76C9878384068094"""
+"""B8514365E348ED7C_25A51659D4480F06_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)C[C@H]3CCCNC3""",21,"""76C9878384068094"""
+"""62355379971F30A9_8CD9922316B1A0BC_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CC3CC(NC)C3""",21,"""76C9878384068094"""
+"""7211E2BB75457B9C_DC666299BADEFB71_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)CCC3CCNC3""",21,"""76C9878384068094"""
+"""78764F5AA2B2F824_373D2F014EB34323_6031_DP""","""O(C(=O)C1CCCN1C2CCNCC2)C[C@@H]3OCCNC3""",21,"""76C9878384068094"""
+"""686DA0B56334631F_1CCE8793C718D7CE_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC(=C(C(=C2)F)F)F""",21,"""797A7358F2F2075A"""
+"""BAB9C1A805ACD5A3_31CF2005E0EEE2F2_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=C(C(C)C)C=C2""",21,"""797A7358F2F2075A"""
+"""E83B6E4BD8C515CF_934CE73430F7C937_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC3=C(C=C2)CCC3""",21,"""797A7358F2F2075A"""
+"""CFADC190EB930263_339EA7F82F9FB395_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=CC(=C2)C#CC""",21,"""797A7358F2F2075A"""
+"""C6D9D0EC6B24762F_339A238A3EF7980A_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=CC(=C2)CSC""",21,"""797A7358F2F2075A"""
+"""5AB677E1FD86A934_B37493A49CE0B40F_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CN=C(C=C2)[N](=O)=O""",21,"""797A7358F2F2075A"""
+"""DAA5FD1B90A1D443_EB2F91883A784625_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CSC=C2C(F)(F)F""",21,"""797A7358F2F2075A"""
+"""BEACB90A9B9C6D6D_C22474E28AF743A4_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC(=CC=C2)C(=O)O""",21,"""797A7358F2F2075A"""
+"""DDC72989E8CA407D_202881E3BFC60C27_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C3=C2[NH]C=CC2=CC=C3""",21,"""797A7358F2F2075A"""
+"""CFE7B4E8F69C3925_E3C834B31E9F7D30_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=C(C=C(C)C=C2F)F""",21,"""797A7358F2F2075A"""
+"""9AB8F86EB16B97DC_57734ABBA9C45C6B_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=CC3=NON=C23""",21,"""797A7358F2F2075A"""
+"""1689832B8AA2906B_100914E3C4CE0F13_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=C(C(=C(C)C=C2)F)F""",21,"""797A7358F2F2075A"""
+"""99CDC30618DA0BD6_51C25F22CE532297_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C3=C[N]2C=NN=C2C=C3""",21,"""797A7358F2F2075A"""
+"""7D0E441D17D39A55_BFF4BCEA4C6DF13B_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC(=C(C=C2)F)OC""",21,"""797A7358F2F2075A"""
+"""1772826DDAFC9262_A929FF5B8BF86E47_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=C(C=C(C)C=C2C)C""",21,"""797A7358F2F2075A"""
+"""180C52D7EEB83AEC_DCE2A014CC2C08CB_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=C(OC)C=CC=C2F""",21,"""797A7358F2F2075A"""
+"""2A38C9949C7329EB_0CB10017C2F23FE7_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=C(C(N)=O)C=C2""",21,"""797A7358F2F2075A"""
+"""3ABC400FD2C77EE9_D6CE292B78E5DA52_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC(=C(OC)C=C2)F""",21,"""797A7358F2F2075A"""
+"""EC0945C75F9CFD7D_8E662AEE2888368E_6006_DP""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C3=C2[N](CCNC2)N=C3""",21,"""797A7358F2F2075A"""
+"""BEACB90A9B9C6D6D_823748B6D32E6395_6006_DP""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=CC(=C2)C(O)=O""",21,"""797A7358F2F2075A"""
+"""32118FCEDFD61C60_AB9C2280215C73EE_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=CC(=C2F)OC""",21,"""797A7358F2F2075A"""
+"""CF02EE50B8B58A19_1C0355FEE9ADB186_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=C(C=CC(=C2)OC)C""",21,"""797A7358F2F2075A"""
+"""9B760BFE3EE1C7D6_0D5BF91988E9C08B_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C3=C2OC=CC2=CC=C3""",21,"""797A7358F2F2075A"""
+"""9AB4BAA58F425AD1_B4AAFDBC8997F4BD_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=C(OC)C=C(C=C2)F""",21,"""797A7358F2F2075A"""
+"""C2642AD629520824_B4F7E1F4D72C6274_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC(=C(OC)C=C2)C""",21,"""797A7358F2F2075A"""
+"""D5934392CE165ED1_A4B08EBC60200DEB_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=C(C(C)O)C=C2""",21,"""797A7358F2F2075A"""
+"""E30484D446A14738_AC9432035F044ACA_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=COC(=C2)C(F)(F)F""",21,"""797A7358F2F2075A"""
+"""2A5EFEF2D4AB0146_B2617486E0961D39_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC(=CS2)C(F)(F)F""",21,"""797A7358F2F2075A"""
+"""8E241D43F18D4FA5_31F0764261772B22_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CN=C(N(C)C)N=C2""",21,"""797A7358F2F2075A"""
+"""824AD5C0A83E3FA5_E4719FD6576CF3E1_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C3=CC2=C(C=CC=N2)S3""",21,"""797A7358F2F2075A"""
+"""4A34DDF96D0D679D_53041F695F1FF599_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=C(C(=CC=C2O)F)F""",21,"""797A7358F2F2075A"""
+"""7F8A0D6EEBBFEF73_B44725E30E59F683_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CSC3=C2C=CC=C3""",21,"""797A7358F2F2075A"""
+"""A993EC12FD092732_CB419956C96E8414_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=C[N]3N=CC=C23""",21,"""797A7358F2F2075A"""
+"""CB8048677CF09670_72EBB0D748286FA3_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CN=C(C=C2)C(F)F""",21,"""797A7358F2F2075A"""
+"""FCA7B5E4CD5B36D5_19F06CDC6A4F9F2F_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC3=C(C=C2)CCO3""",21,"""797A7358F2F2075A"""
+"""4C14A9CC2D20F283_4F3316285E35CCAC_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=C(C=C2)[N](=O)=O""",21,"""797A7358F2F2075A"""
+"""E7021E40AD1CF7E9_B4FD128D91167937_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""797A7358F2F2075A"""
+"""06320B3B29039FF6_1049710DE0CF2B75_6006_UN""","""C[Si](C)(C)C#CC1=C(C=CC=N1)C2=CC=C(S2)C(F)(F)F""",21,"""797A7358F2F2075A"""
+"""FA1B17AD556787C7_F46ED157ABF22119_6014_UN""","""C(#CC1=C(C=CC=N1)Cl)C(CNCC2=CC=C(Cl)C=C2)=C""",21,"""797A7358F2F2075A"""
+"""48CAE5F03312346E_C474F89D27BA0AA3_6014_UN""","""C(#CC1=C(C=CC=N1)Cl)C=CC2=CC=CC(=C2)C(F)(F)F""",21,"""797A7358F2F2075A"""
+"""B878795853A7E8BB_7B6EF123A19FD5A1_6014_UN""","""C(#CC1=C(C=CC=N1)Cl)C2=CC(N(CC(OC)=O)C=C2)=O""",21,"""797A7358F2F2075A"""
+"""952DAB976ACC89B4_4CC1EDE30296F79F_6014_UN""","""C(#CC1=C(C=CC=N1)Cl)C3=CC=C2C(=O)OCCN2C3=O""",21,"""797A7358F2F2075A"""
+"""82D47FDAF1D7415A_90999B0BF5EF3404_7019_UN""","""CC1=NC=CC(=C1)C=CC2=CSC(=N2)C3=CC=C(Cl)C=C3""",21,"""798442629F4B877D"""
+"""232766638892F3D5_A86C217AB0BBAC34_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC2=CC=CC(=C2N=C3Cl)C""",21,"""798442629F4B877D"""
+"""8BD87D370E2199FF_CF74D4660E2DD6D7_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC2=C(C=C(C)C=C2)N=C3Cl""",21,"""798442629F4B877D"""
+"""51558E89F83971FB_ACDBD80FA591FA43_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC=C(C2=CC=C(Cl)C=C2)O3""",21,"""798442629F4B877D"""
+"""AB0A6FF0329448EA_B4D314CB11C013CF_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC(=C2OCCCOC2=C3)Cl""",21,"""798442629F4B877D"""
+"""F28D98F38DFB13C1_635FFC07A204A8AA_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(Cl)N=C(S2)N3CCCCC3""",21,"""798442629F4B877D"""
+"""5EAB53840316169B_051256878B58721A_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC2=C(C=CC(=C2)C)N=C3Cl""",21,"""798442629F4B877D"""
+"""21B11F87794E24EF_70555590EFAAD18E_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC=C(C2=CC=C(Cl)C=C2)S3""",21,"""798442629F4B877D"""
+"""F074BE6D905882FE_AEC5493AE823E942_7019_UN""","""CC1=NC=CC(=C1)C=CC3=C[N](C2=CC=C(Cl)C=C2)N=C3""",21,"""798442629F4B877D"""
+"""3902153C7832CDD8_B7E8C541F76652BC_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC2=C(C(=CC(=C2)Cl)Cl)OC3""",21,"""798442629F4B877D"""
+"""E5A99D56D6557E58_47FC0719D54D4C0A_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC=C(C2=CC=CC(=C2)Cl)S3""",21,"""798442629F4B877D"""
+"""DABF301016C46EAF_4D9AF196E5FE77CD_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(OC(F)F)C(=CC(=C2)Cl)Cl""",21,"""798442629F4B877D"""
+"""1FA870EE53E144FD_5303D1F38013EC1B_7019_UN""","""CC1=NC=CC(=C1)C=CC2=CC(=C(OCC)C(=C2)Cl)OC""",21,"""798442629F4B877D"""
+"""E8D429E92A200FA8_C020C01F424157A8_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC2=C([N](N=C2C)C)N=C3Cl""",21,"""798442629F4B877D"""
+"""B44F8EC09DB414B2_2693B96FB077F3C6_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C[NH]N=C2C3=CC=CC(=C3)Cl""",21,"""798442629F4B877D"""
+"""12C9695CB583E5F8_E9AD98F436221DC0_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(Cl)C=CC=C2N3CCCC3""",21,"""798442629F4B877D"""
+"""9F00500E840F7C81_FB8F150E11F62931_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC(=C2C=CC=CC2=C3O)Cl""",21,"""798442629F4B877D"""
+"""024BCB084AC21FB5_FECF7EDF1DEA027F_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C([S](CC)(=O)=O)C(=CC=C2)Cl""",21,"""798442629F4B877D"""
+"""C84C98C8EC7CD786_69C1A50A422A5157_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(C=CC(=C2)Cl)OCC3CC3""",21,"""798442629F4B877D"""
+"""99FFBC19107AAE4E_FDF9FC694B9C9B62_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C[NH]N=C2C3=CC=C(Cl)C=C3""",21,"""798442629F4B877D"""
+"""537FF5AFA1EA47A7_1FA106F626AAB36B_7019_UN""","""CC1=NC=CC(=C1)C=CC2=CC(=C(C(=C2)Cl)OC)OCC""",21,"""798442629F4B877D"""
+"""5A25AA97835BE7BE_B7EEFCF7836F3874_7019_UN""","""CC1=NC=CC(=C1)C=CC3=N[N](C2=CC=C(Cl)C=C2)N=C3""",21,"""798442629F4B877D"""
+"""5A7CEBFA35735952_8E5C378DC3A88F37_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CN=C(C2=CC=CC(=C2)Cl)S3""",21,"""798442629F4B877D"""
+"""FC1DA2EE25597D4E_6617D575F471F695_7019_UN""","""CC1=NC=CC(=C1)C=CC2=CC(=C(OC(C)C)C=C2Cl)Cl""",21,"""798442629F4B877D"""
+"""EEC3C6A5EB9925CC_8EA6A4CAC8AE5743_7019_DP""","""CC1=NC=CC(=C1)C=CC3=C(N=C(N2CCNCC2)S3)Cl""",21,"""798442629F4B877D"""
+"""6CD174E2FAAEA040_A3B7CDB91C87D000_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC2=C(C=CC(=C2)F)N=C3Cl""",21,"""798442629F4B877D"""
+"""7AC6D9D1D4D3E9C9_64F31640AA9CF129_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC2=C(C=C(F)C=C2)N=C3Cl""",21,"""798442629F4B877D"""
+"""C1909B6564D9BEBC_7665AE1B134AD2BC_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC=C(C2=C(Cl)C=CC=C2)S3""",21,"""798442629F4B877D"""
+"""70DA6AF5956B8F47_0DEC327671049CD5_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(Cl)N=C(S2)N3CCOCC3""",21,"""798442629F4B877D"""
+"""E6CA4481F0359AB3_750C6B40FF77A87C_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C[NH]C3=CC(=C(OC)C=C23)Cl""",21,"""798442629F4B877D"""
+"""12A702DFD44AEBEF_055F3C8167981D97_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(Cl)[N](N=C2)C3=CC=CC=C3""",21,"""798442629F4B877D"""
+"""B55D0844034CD948_C3503269851AF746_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(Cl)[NH]C3=C2C=C(C(=C3)Cl)Cl""",21,"""798442629F4B877D"""
+"""0BB0FB1D0DBCA50D_9EFA5F38F6419754_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(C=C(Cl)C=C2)[N]3C=NC=N3""",21,"""798442629F4B877D"""
+"""3CD2D5EB3EFEB76F_2AAC21A56A3DDFEC_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC=C(C2=C(Cl)C=CC=C2)O3""",21,"""798442629F4B877D"""
+"""AC7DD24480CA063F_16863FD257EE8055_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CN=C(C2=CC=C(Cl)C=C2)S3""",21,"""798442629F4B877D"""
+"""EA050752F7D0957E_8AA80228F8B550D8_7019_UN""","""CC1=NC=CC(=C1)C=CC3=C[N](C2=CC=CC(=C2)Cl)N=C3""",21,"""798442629F4B877D"""
+"""51FA6795D8CB2463_72EBE1BC909C3566_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(C(=C(F)C=C2)C(F)(F)F)Cl""",21,"""798442629F4B877D"""
+"""36C5A5605FCBA89B_9469E14D78CDCBDD_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(C=C(OC)C=C2CCl)OC""",21,"""798442629F4B877D"""
+"""CAB809B63CCC7629_16AF4D2AAE6CA792_7019_UN""","""CC1=NC=CC(=C1)C=CC2=CC(=C(OC(F)(F)F)C=C2)Cl""",21,"""798442629F4B877D"""
+"""D02C4F68530A7FD4_418E6951961AD48C_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(Cl)C=CC=C2[N]3C=CN=C3""",21,"""798442629F4B877D"""
+"""5E76D779E6C80BB9_69F6EF2B7E0EE553_7019_UN""","""CC1=NC=CC(=C1)C=CC3=CC(=C2OCOCC2=C3)CCl""",21,"""798442629F4B877D"""
+"""36E2BDCF12EB0C9D_A1CE6C19CC12785D_7019_UN""","""CC1=NC=CC(=C1)C=CC2=C(Cl)C=CC=C2[N]3C=CC=N3""",21,"""798442629F4B877D"""
+"""592AF0879EFC32A9_8C88AAE03A64BBAD_2267_UN""","""C(#CC1CCCCO1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""7B627AF6C3DB3AB4"""
+"""9177D81BC9D59208_125B23B6D593ECFE_2267_UN""","""C(#CC1CCCCO1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""7B627AF6C3DB3AB4"""
+"""B2C8D06A816CF271_F6A5D0F537A3F15B_2267_UN""","""C(#CC1CCCCO1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""7B627AF6C3DB3AB4"""
+"""DB95488A7FC895AA_9193261B843D72D0_2267_UN""","""C(#CC1CCCCO1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""7B627AF6C3DB3AB4"""
+"""6387B40ED7AFFB19_1A128DE9022FBBC1_2267_UN""","""C(#CC1CCCCO1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""7B627AF6C3DB3AB4"""
+"""850992DBE908DDBD_EA999F6EB46B5394_2267_UN""","""C(#CC1CCCCO1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""7B627AF6C3DB3AB4"""
+"""A9B3615BB326F748_2A969EB33EB90F0F_2267_UN""","""C(#CC1CCCCO1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""7B627AF6C3DB3AB4"""
+"""3FA93F21BCFB4496_6DF304CB44292863_2267_UN""","""C(#CC1CCCCO1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""7B627AF6C3DB3AB4"""
+"""0E32B9FA221FB7A0_62DE541E6A83AB8F_2267_UN""","""C(#CC1CCCCO1)C2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""7B627AF6C3DB3AB4"""
+"""7FB41404F9EB033D_04226AD5CB96C6E9_2267_UN""","""C(#CC1CCCCO1)C2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""7B627AF6C3DB3AB4"""
+"""425311D7A05A1026_AEF6DA924555DC46_2267_UN""","""C(#CC1CCCCO1)C2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""7B627AF6C3DB3AB4"""
+"""A4EDB19B65E56686_4E72899F0DB78498_2267_UN""","""C(#CC1CCCCO1)C2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""7B627AF6C3DB3AB4"""
+"""30AC797F23920B2B_2B594669E6240291_2267_UN""","""C(#CC1CCCCO1)C2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""7B627AF6C3DB3AB4"""
+"""753803B7F1D654FC_E97372D70DB4C8C3_2267_UN""","""C(#CC1CCCCO1)C3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""7B627AF6C3DB3AB4"""
+"""13A8179E0C3BD4BC_57BE4D3EABBFDF4C_2267_UN""","""C(#CC1CCCCO1)C2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""7B627AF6C3DB3AB4"""
+"""47F0743007F7BD1E_7F555C76B1FAB441_2267_UN""","""C(#CC1CCCCO1)C2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""7B627AF6C3DB3AB4"""
+"""A46148A8A5111EA7_BC2AAA9FB3726F7F_2267_UN""","""C(#CC1CCCCO1)C2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""7B627AF6C3DB3AB4"""
+"""625F0D019EBA06D3_693A8823223AF12C_2267_UN""","""C(#CC1CCCCO1)C3=CC=C(CC2(C)NCCC2)C=C3""",21,"""7B627AF6C3DB3AB4"""
+"""DDF09CBB73223F80_CA84C12EACA39640_2267_UN""","""C(#CC1CCCCO1)C2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""7B627AF6C3DB3AB4"""
+"""E8658A4676D10AF7_E18B6C3A53DDDC63_2267_UN""","""C(#CC1CCCCO1)C2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""7B627AF6C3DB3AB4"""
+"""AE438E1EBDA8501B_0D061D1923E5F5BE_2267_UN""","""C(#CC1CCCCO1)C2=CC=C(C=C2)C3NCCNC3=O""",21,"""7B627AF6C3DB3AB4"""
+"""DD3AEBB1BE65FD02_F7BB06251DCD89B8_2267_UN""","""C(#CC1CCCCO1)C2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""7B627AF6C3DB3AB4"""
+"""05F918D37D443773_51D792403F084E7C_2267_UN""","""C(#CC1CCCCO1)C(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""7B627AF6C3DB3AB4"""
+"""E401269D5D83DE30_DBBAA34F3886C528_2267_UN""","""C(#CC1CCCCO1)C2=C[N](CC(OCC)OCC)N=C2""",21,"""7B627AF6C3DB3AB4"""
+"""C5A23C40F9BE832E_072C639D5D4D3F63_2267_UN""","""C(#CC1CCCCO1)C2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""7B627AF6C3DB3AB4"""
+"""77E6DECD9FFA447D_B13EF79B59AA50CF_2267_UN""","""C(#CC1CCCCO1)C2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""7B627AF6C3DB3AB4"""
+"""594434AFC05E3A92_B4336EE0315D375A_2267_UN""","""C(#CC1CCCCO1)C3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""7B627AF6C3DB3AB4"""
+"""3E102329619F2F28_4DF6A6A883859970_2267_UN""","""C(#CC1CCCCO1)C2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""7B627AF6C3DB3AB4"""
+"""17492D70521393B1_692CA272D52B92F8_2267_UN""","""C(#CC1CCCCO1)C2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""7B627AF6C3DB3AB4"""
+"""E99DE40ED76F8947_1E441F6012FEF88F_2267_UN""","""C(#CC1CCCCO1)C2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""7B627AF6C3DB3AB4"""
+"""36A8F8050575935F_C80FFB42DA2121BE_2267_UN""","""C(#CC1CCCCO1)C2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""7B627AF6C3DB3AB4"""
+"""CE663F3F4FEDA0D4_EC9004AAE2DFFB05_2267_UN""","""C(#CC1CCCCO1)C2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""7B627AF6C3DB3AB4"""
+"""789D2A6B1364687C_6380F33623539A8C_2267_UN""","""C(#CC1CCCCO1)C2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""7B627AF6C3DB3AB4"""
+"""6EA4DAA313C1CD76_2A95DE87ACFB859F_2267_UN""","""C(#CC1CCCCO1)C2=CC=C(C=C2)CN3CCCCC3""",21,"""7B627AF6C3DB3AB4"""
+"""07BAF8A8E1C23F34_F6B1E4E5937CBB15_2267_UN""","""C(#CC1CCCCO1)C2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""7B627AF6C3DB3AB4"""
+"""F5A86BC0819EFF7B_3903F01384E456A4_2267_UN""","""C(#CC1CCCCO1)C2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""7B627AF6C3DB3AB4"""
+"""3335ED8960D5CD90_7D2907B613CA8272_2267_UN""","""C(#CC1CCCCO1)C2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""7B627AF6C3DB3AB4"""
+"""3702505775F4226F_068F89EBFBBAA722_2267_UN""","""C(#CC1CCCCO1)C3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""7B627AF6C3DB3AB4"""
+"""3A7EF2A4C4F987DA_3429317380558F78_2267_UN""","""C(#CC1CCCCO1)C2=CC=C(CCCCC(O)=O)C=C2""",21,"""7B627AF6C3DB3AB4"""
+"""D8665F11C0B50049_010A39B4B620F477_2267_UN""","""C(#CC1CCCCO1)C2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""7B627AF6C3DB3AB4"""
+"""D5600D3584592536_59B8F3EE767C0162_2267_UN""","""C(#CC1CCCCO1)C2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""7B627AF6C3DB3AB4"""
+"""4C346EFA73AB317E_01DE8480682EF8FB_2267_UN""","""C(#CC1CCCCO1)C3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""7B627AF6C3DB3AB4"""
+"""E983F4A7517CE8DD_8C75A5EBFA48B2A4_2267_UN""","""C[C@]1(NCCC1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""7B9F75FD03F733BD"""
+"""04DBF98AEDB3735D_12A62CBD15BFE5F7_2267_UN""","""C[C@]1(NCCC1)C#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""7B9F75FD03F733BD"""
+"""4AB3046101AEAB1A_F658DFFEF78FF852_2267_UN""","""C[C@]1(NCCC1)C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""7B9F75FD03F733BD"""
+"""49065D02746792BA_916E291044117BD9_2267_UN""","""C[C@]1(NCCC1)C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""7B9F75FD03F733BD"""
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+"""7BE89ADF197B96B7_EA64906574475A9D_2267_UN""","""C[C@]1(NCCC1)C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""7B9F75FD03F733BD"""
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+"""C64F8CD791F0CA09_6D0E0BC08405216A_2267_UN""","""C[C@]1(NCCC1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""7B9F75FD03F733BD"""
+"""2AE209C3214C8577_62235B15AAAFA286_2267_UN""","""C[C@]1(NCCC1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""7B9F75FD03F733BD"""
+"""990DBB800C94DE96_04DF65DE0BBACFE0_2267_UN""","""C[C@]1(NCCC1)C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""7B9F75FD03F733BD"""
+"""055F01357E10F019_AE0BD5998579D54F_2267_UN""","""C[C@]1(NCCC1)C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""7B9F75FD03F733BD"""
+"""CCA856D96F6270CE_4E8F8694CD9B8D91_2267_UN""","""C[C@]1(NCCC1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""7B9F75FD03F733BD"""
+"""31D5DE7650ECC05A_2BA4496226080B98_2267_UN""","""C[C@]1(NCCC1)C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""7B9F75FD03F733BD"""
+"""21113A62C7020CE6_E98E7DDCCD98C1CA_2267_UN""","""C[C@]1(NCCC1)C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""7B9F75FD03F733BD"""
+"""70BC1B764CB681DA_574342356B93D645_2267_UN""","""C[C@]1(NCCC1)C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""7B9F75FD03F733BD"""
+"""0EBE6EB05C652A41_7FA8537D71D6BD48_2267_UN""","""C[C@]1(NCCC1)C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""7B9F75FD03F733BD"""
+"""D3EB25F18EA9AD06_BCD7A594735E6676_2267_UN""","""C[C@]1(NCCC1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""7B9F75FD03F733BD"""
+"""123C6371FDE478B7_69C78728E216F825_2267_UN""","""C[C@]1(NCCC1)C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""7B9F75FD03F733BD"""
+"""51F7FD52BD63337F_CA79CE256C8F9F49_2267_UN""","""C[C@]1(NCCC1)C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""7B9F75FD03F733BD"""
+"""C29BDE8E17579AC6_E176633193F1D56A_2267_UN""","""C[C@]1(NCCC1)C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""7B9F75FD03F733BD"""
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+"""EE13B213C31904D9_DB47AC44F8AACC21_2267_UN""","""C[C@]1(NCCC1)C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""7B9F75FD03F733BD"""
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+"""A4247979666390A6_B1C3F890998659C6_2267_UN""","""C[C@]1(NCCC1)C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""7B9F75FD03F733BD"""
+"""AB0FEF8811444114_B4CE61EBF1713E53_2267_UN""","""C[C@]1(NCCC1)C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""7B9F75FD03F733BD"""
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+"""4249A14EFBB5BB8D_69D1AD7915079BF1_2267_UN""","""C[C@]1(NCCC1)C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""7B9F75FD03F733BD"""
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+"""18A273A02A0A2E54_EC6D0BA122F3F20C_2267_UN""","""C[C@]1(NCCC1)C#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""7B9F75FD03F733BD"""
+"""682183A4E6E1CD85_637DFC3DE37F9385_2267_UN""","""C[C@]1(NCCC1)C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""7B9F75FD03F733BD"""
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+"""58AD51339BBC0202_39FEFF1844C85FAD_2267_UN""","""C[C@]1(NCCC1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""7B9F75FD03F733BD"""
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+"""E1DF549F56780D90_067286E03B96AE2B_2267_UN""","""C[C@]1(NCCC1)C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""7B9F75FD03F733BD"""
+"""E553C0C070789CD6_34D43E7840798671_2267_UN""","""C[C@]1(NCCC1)C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""7B9F75FD03F733BD"""
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+"""6FDD7BBE0B8D7DD0_624ADDE974B025AD_6031_DP""","""O(C(=O)C1=CN=C(S1)N2CCNCC2)C[C@@H]3COCCN3""",21,"""7CEA8DC66E65EC74"""
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+"""C39A395DFD7E4DE2_2F861C1C3E2B63E6_6031_DP""","""O(C(=O)C1=CN=C(S1)N2CCNCC2)C[C@H]3CCCNC3""",21,"""7CEA8DC66E65EC74"""
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+"""C44294553C9576C9_D64568DC50BD9791_6031_DP""","""O(C(=O)C1=CN=C(S1)N2CCNCC2)CCC3CCNC3""",21,"""7CEA8DC66E65EC74"""
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+"""4F6D120875D77F43_968F915312DCB452_6036_UN""","""NCC(C1=CC=C(C=C1)F)N([S](CC)(=O)=O)CC(=O)OC""",21,"""7D5BD99B6BCE2ADD"""
+"""50E9C7F6D328F488_B5D224F7AD1F5CCF_6036_UN""","""NCC(C1=CC=C(C=C1)F)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""7D5BD99B6BCE2ADD"""
+"""9A2CAD81A4FE482C_9FA50B8E7F944169_6036_UN""","""NCC(C1=CC=C(C=C1)F)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""7D5BD99B6BCE2ADD"""
+"""DB6453AC3360B272_CD101C67B30CF4F6_6036_UN""","""NCC(C1=CC=C(C=C1)F)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""7D5BD99B6BCE2ADD"""
+"""4F552A5FC2E56F3F_AC5BCFC40317970C_6036_UN""","""NCC(C1=CC=C(C=C1)F)N(C)[S](=O)(=O)C2CCCNC2""",21,"""7D5BD99B6BCE2ADD"""
+"""AC4BE78AC2AB983C_9A59F3EE3176DBBE_6036_UN""","""NCC(C1=CC=C(C=C1)F)N(C)[S](=O)(=O)CC2CCCN2""",21,"""7D5BD99B6BCE2ADD"""
+"""C1AE23ADEA6D607E_BE86B0539ACDABA8_6036_UN""","""NCC(C1=CC=C(C=C1)F)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""7D5BD99B6BCE2ADD"""
+"""6B3E8375F956FB27_71A28547DB906208_6036_UN""","""NCC(C1=CC=C(C=C1)F)N([S](C)(=O)=O)C2CCCNC2""",21,"""7D5BD99B6BCE2ADD"""
+"""C6FB767C200CEDC7_A4E582DE2816DF42_6036_UN""","""NCC(C1=CC=C(C=C1)F)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""7D5BD99B6BCE2ADD"""
+"""E2163294A3F055C2_1CA3B67BBEC6A239_6036_UN""","""NCC(C1=CC=C(C=C1)F)N(CC)[S](=O)(=O)C2CCNC2""",21,"""7D5BD99B6BCE2ADD"""
+"""6060E7C7D3A2938D_D900384102068DC0_6036_UN""","""NCC(C1=CC=C(C=C1)F)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""7D5BD99B6BCE2ADD"""
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+"""E27CB097E2E84812_0EADDF661A888E22_2267_UN""","""N[S](=O)(=O)CCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""837E41754A2F0F83"""
+"""2EC8AE732E8465AD_C11FCB900D106393_2267_UN""","""N[S](=O)(=O)CCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""837E41754A2F0F83"""
+"""34C645291376A171_85353C359A3EB745_2267_UN""","""N[S](=O)(=O)CCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""837E41754A2F0F83"""
+"""4A38DDD3CAAFEBCB_FE93B268724E9215_2267_UN""","""N[S](=O)(=O)CCC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""837E41754A2F0F83"""
+"""3D38B9FD6D3D788D_CC350AF009A1BA4F_2267_UN""","""N[S](=O)(=O)CCC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""837E41754A2F0F83"""
+"""7738251DA53EFC1F_F91602373FD4C140_2267_UN""","""N[S](=O)(=O)CCC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""837E41754A2F0F83"""
+"""BE3A581F13EC920D_A1A4C86DFF883455_2267_UN""","""N[S](=O)(=O)CCC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""837E41754A2F0F83"""
+"""E3462C0E1E6010EA_F9C2BF03E1DACDCC_2267_UN""","""N[S](=O)(=O)CCC#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""837E41754A2F0F83"""
+"""A35AB2BDD17CCC96_73F677882792BAF5_2267_UN""","""N#[N]=NCCCC#CC1=CC=C(C(CCC(O)=O)=O)C=C1""",21,"""841CA79EDE2D3BEC"""
+"""63FC98F4CC49EE3F_ED25FEDEC865EDA6_2267_UN""","""N#[N]=NCCCC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O""",21,"""841CA79EDE2D3BEC"""
+"""5AE2F340E717394C_09DB0D9D2A55F003_2267_UN""","""N#[N]=NCCCC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""841CA79EDE2D3BEC"""
+"""952DBCF3C3636B76_6EEDFB7399CB7388_2267_UN""","""N#[N]=NCCCC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""841CA79EDE2D3BEC"""
+"""6497B4D5499E78F9_E56C50811FD9BA99_2267_UN""","""N#[N]=NCCCC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""841CA79EDE2D3BEC"""
+"""7F6DE26B9EAE3EBD_15E74206A99D52CC_2267_UN""","""N#[N]=NCCCC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""841CA79EDE2D3BEC"""
+"""353128608835DAAB_D5E843DB234F0E57_2267_UN""","""N#[N]=NCCCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""841CA79EDE2D3BEC"""
+"""0CE413EE50504823_928DD9A359DF293B_2267_UN""","""N#[N]=NCCCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""841CA79EDE2D3BEC"""
+"""B9B5E7EE2B20F378_9DA089767775AAD7_2267_UN""","""N#[N]=NCCCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""841CA79EDE2D3BEC"""
+"""E82CF31719E59578_FB5CB7BDD660C7B1_2267_UN""","""N#[N]=NCCCC#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""841CA79EDE2D3BEC"""
+"""3C8DEA77DA8ACD81_518807FA58A3DD1E_2267_UN""","""N#[N]=NCCCC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""841CA79EDE2D3BEC"""
+"""064D81E2A2046A64_B10C54F7104185C0_2267_UN""","""N#[N]=NCCCC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""841CA79EDE2D3BEC"""
+"""91F73C345F85C5D7_D4279B01FBD203C9_2267_UN""","""N#[N]=NCCCC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""841CA79EDE2D3BEC"""
+"""549536C296EB005B_160DAFBF1042C99B_2267_UN""","""N#[N]=NCCCC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2""",21,"""841CA79EDE2D3BEC"""
+"""B19CF0D55AE9B18C_A8C09056B649DE14_2267_UN""","""N#[N]=NCCCC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""841CA79EDE2D3BEC"""
+"""BA8D17D105753B59_802B811EAC0CB519_2267_UN""","""N#[N]=NCCCC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""841CA79EDE2D3BEC"""
+"""AA22735DC9D4FE8D_435477F7AE846E27_2267_UN""","""N#[N]=NCCCC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""841CA79EDE2D3BEC"""
+"""E618E6BFA5810C7E_9644554B3FCCF074_2267_UN""","""N#[N]=NCCCC#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""841CA79EDE2D3BEC"""
+"""F6CBE9755CB25013_35FA1C46B1559718_2267_UN""","""N#[N]=NCCCC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""841CA79EDE2D3BEC"""
+"""0063B0692C3A9CFE_1EF5B1524E2BDD3B_2267_UN""","""N#[N]=NCCCC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""841CA79EDE2D3BEC"""
+"""781916833AA7A256_F278C0713E13F4E6_2267_UN""","""N#[N]=NCCCC#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""841CA79EDE2D3BEC"""
+"""2F8C7479B9B381F4_08C5DB4D003B88E0_2267_UN""","""N#[N]=NCCCC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""841CA79EDE2D3BEC"""
+"""E2541412005E2FE5_AEA94F2822FE4F24_2267_UN""","""N#[N]=NCCCC#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""841CA79EDE2D3BEC"""
+"""E7D5483A290A1210_24C47E272570C470_2267_UN""","""N#[N]=NCCCC#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""841CA79EDE2D3BEC"""
+"""EBA16B0F721F98E4_F852BEF540BB3E3B_2267_UN""","""N#[N]=NCCCC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""841CA79EDE2D3BEC"""
+"""5118AECD75B1992E_4E402AF3445C5197_2267_UN""","""N#[N]=NCCCC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""841CA79EDE2D3BEC"""
+"""016DAB4147C9EB41_4B4DB3882CAB3602_2267_UN""","""N#[N]=NCCCC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""841CA79EDE2D3BEC"""
+"""D2FB0D57B66FEB1D_B2887BC09E739828_2267_UN""","""N#[N]=NCCCC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""841CA79EDE2D3BEC"""
+"""38FD170FFC59E860_96527F1AC8DD93A0_2267_UN""","""N#[N]=NCCCC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""841CA79EDE2D3BEC"""
+"""7CB5F6D18B11950A_E13AC2080F08F9D7_2267_UN""","""N#[N]=NCCCC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""841CA79EDE2D3BEC"""
+"""62A65244DEF1A9F9_3771262AC7D720E6_2267_UN""","""N#[N]=NCCCC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""841CA79EDE2D3BEC"""
+"""4305C85529D3F440_13EED9C2FF29FA5D_2267_UN""","""N#[N]=NCCCC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""841CA79EDE2D3BEC"""
+"""C78CE6A0DBF013B9_9CFE2E5E3EA59BD4_2267_UN""","""N#[N]=NCCCC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""841CA79EDE2D3BEC"""
+"""E0C02D7012A26D7D_D5EB03EFB10D84C7_2267_UN""","""N#[N]=NCCCC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""841CA79EDE2D3BEC"""
+"""3B5B67148A4F1F83_09CF398D8E8ABA4D_2267_UN""","""N#[N]=NCCCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""841CA79EDE2D3BEC"""
+"""67C79E3DFD3A9F51_C67D2D7B991257FC_2267_UN""","""N#[N]=NCCCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""841CA79EDE2D3BEC"""
+"""02728241B8062315_8257DADE0E3C832A_2267_UN""","""N#[N]=NCCCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""841CA79EDE2D3BEC"""
+"""9C85420D7A606247_F9F15483E64CA67A_2267_UN""","""N#[N]=NCCCC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""841CA79EDE2D3BEC"""
+"""3F9DEC538CED4BC8_CB57EC1B9DA38E20_2267_UN""","""N#[N]=NCCCC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""841CA79EDE2D3BEC"""
+"""EC6001CBFB125266_FE74E4DCABD6F52F_2267_UN""","""N#[N]=NCCCC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""841CA79EDE2D3BEC"""
+"""D5584747B675BA87_A6C62E866B8A003A_2267_UN""","""N#[N]=NCCCC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""841CA79EDE2D3BEC"""
+"""50659F7FAD774A8C_FEA059E875D8F9A3_2267_UN""","""N#[N]=NCCCC#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""841CA79EDE2D3BEC"""
+"""B6B5E810B60ACEF4_7320244F23F47438_2267_UN""","""CC1(CCCC1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""84CAF459DA4BF521"""
+"""27E19700AFBF91DD_EDF3AD19CC03236B_2267_UN""","""CC1(CCCC1)C#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""84CAF459DA4BF521"""
+"""507A2696D9D6F761_090D5E5A2E333ECE_2267_UN""","""CC1(CCCC1)C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""84CAF459DA4BF521"""
+"""816EF8C39A597B06_6E3BA8B49DADBD45_2267_UN""","""CC1(CCCC1)C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""84CAF459DA4BF521"""
+"""1D253CCA3FCCDD08_E5BA03461BBF7454_2267_UN""","""CC1(CCCC1)C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""84CAF459DA4BF521"""
+"""2BC69A12F30AE8C9_153111C1ADFB9C01_2267_UN""","""CC1(CCCC1)C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""84CAF459DA4BF521"""
+"""25B031068AD15D15_D53E101C2729C09A_2267_UN""","""CC1(CCCC1)C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""84CAF459DA4BF521"""
+"""D4F376C6E5F6CFE2_925B8A645DB9E7F6_2267_UN""","""CC1(CCCC1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""84CAF459DA4BF521"""
+"""4C1375AE73419895_9D76DAB17313641A_2267_UN""","""CC1(CCCC1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""84CAF459DA4BF521"""
+"""C205DF66897D46E5_FB8AE47AD206097C_2267_UN""","""CC1(CCCC1)C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""84CAF459DA4BF521"""
+"""899D981BABE591B2_515E543D5CC513D3_2267_UN""","""CC1(CCCC1)C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""84CAF459DA4BF521"""
+"""863C783477FCD126_B1DA073014274B0D_2267_UN""","""CC1(CCCC1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""84CAF459DA4BF521"""
+"""9155F1B1F2C2A4E3_D4F1C8C6FFB4CD04_2267_UN""","""CC1(CCCC1)C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""84CAF459DA4BF521"""
+"""937C24B02256EAE7_16DBFC7814240756_2267_UN""","""CC1(CCCC1)C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""84CAF459DA4BF521"""
+"""E5466361F662FAB3_A816C391B22F10D9_2267_UN""","""CC1(CCCC1)C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""84CAF459DA4BF521"""
+"""18139676D02AF56A_80FDD2D9A86A7BD4_2267_UN""","""CC1(CCCC1)C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""84CAF459DA4BF521"""
+"""B810BA68F2920A3A_43822430AAE2A0EA_2267_UN""","""CC1(CCCC1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""84CAF459DA4BF521"""
+"""2C1B1072C8D65E82_9692068C3BAA3EB9_2267_UN""","""CC1(CCCC1)C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""84CAF459DA4BF521"""
+"""3D31842F8BBFC9FB_352C4F81B53359D5_2267_UN""","""CC1(CCCC1)C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""84CAF459DA4BF521"""
+"""9DBD14C6E7C4ADE1_1E23E2954A4D13F6_2267_UN""","""CC1(CCCC1)C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""84CAF459DA4BF521"""
+"""96796F03851599F4_F2AE93B63A753A2B_2267_UN""","""CC1(CCCC1)C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""84CAF459DA4BF521"""
+"""5485E5EA4B27C549_0813888A045D462D_2267_UN""","""CC1(CCCC1)C#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""84CAF459DA4BF521"""
+"""F6A33CE8B27F5734_AE7F1CEF269881E9_2267_UN""","""CC1(CCCC1)C#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""84CAF459DA4BF521"""
+"""DAA125D60CF16CF4_24122DE021160ABD_2267_UN""","""CC1(CCCC1)C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""84CAF459DA4BF521"""
+"""D52CAAF6F27851B6_F884ED3244DDF0F6_2267_UN""","""CC1(CCCC1)C#CC2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""84CAF459DA4BF521"""
+"""A16CC448E4D7F5DD_4E967934403A9F5A_2267_UN""","""CC1(CCCC1)C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""84CAF459DA4BF521"""
+"""66137A440F89F680_4B9BE04F28CDF8CF_2267_UN""","""CC1(CCCC1)C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""84CAF459DA4BF521"""
+"""7BB15D60A8A382B0_B25E28079A1556E5_2267_UN""","""CC1(CCCC1)C#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""84CAF459DA4BF521"""
+"""36E51DEAA3B13BDD_96842CDDCCBB5D6D_2267_UN""","""CC1(CCCC1)C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""84CAF459DA4BF521"""
+"""4B1363E5E667D1C2_E1EC91CF0B6E371A_2267_UN""","""CC1(CCCC1)C#CC2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""84CAF459DA4BF521"""
+"""0C5B8CAF46BC55E3_37A775EDC3B1EE2B_2267_UN""","""CC1(CCCC1)C#CC2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""84CAF459DA4BF521"""
+"""3351742607BC8F98_13388A05FB4F3490_2267_UN""","""CC1(CCCC1)C#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""84CAF459DA4BF521"""
+"""53B842FC24B85E44_9C287D993AC35519_2267_UN""","""CC1(CCCC1)C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""84CAF459DA4BF521"""
+"""4E0BB83169A8898A_D53D5028B56B4A0A_2267_UN""","""CC1(CCCC1)C#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""84CAF459DA4BF521"""
+"""DA37E6CC489FCAEF_09196A4A8AEC7480_2267_UN""","""CC1(CCCC1)C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""84CAF459DA4BF521"""
+"""03FDF31F5FCDA54D_C6AB7EBC9D749931_2267_UN""","""CC1(CCCC1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""84CAF459DA4BF521"""
+"""DC1156E282206137_828189190A5A4DE7_2267_UN""","""CC1(CCCC1)C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""84CAF459DA4BF521"""
+"""71C97994B1F6F8E6_F9270744E22A68B7_2267_UN""","""CC1(CCCC1)C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""84CAF459DA4BF521"""
+"""A0A2D196AE838F2A_CB81BFDC99C540ED_2267_UN""","""CC1(CCCC1)C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""84CAF459DA4BF521"""
+"""61BF24FB6DBADFA3_FEA2B71BAFB03BE2_2267_UN""","""CC1(CCCC1)C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""84CAF459DA4BF521"""
+"""0AB12A02D643892D_A6107D416FECCEF7_2267_UN""","""CC1(CCCC1)C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""84CAF459DA4BF521"""
+"""79C386C16E45D21D_FE760A2F71BE376E_2267_UN""","""CC1(CCCC1)C#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""84CAF459DA4BF521"""
+"""F5FDA7825A00E3CB_726F8C03DC420259_2267_UN""","""C(#CC1NCCOC1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""85855C1525FD8340"""
+"""71AB1D82C71D627A_ECBC055533B5550A_2267_UN""","""C(#CC1NCCOC1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""85855C1525FD8340"""
+"""81775E8E499F6972_0842F616D18548AF_2267_UN""","""C(#CC1NCCOC1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""85855C1525FD8340"""
+"""B81A20F03DEBA7FB_6F7400F8621BCB24_2267_UN""","""C(#CC1NCCOC1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""85855C1525FD8340"""
+"""CC8A68D9B3BC33D2_E4F5AB0AE4090235_2267_UN""","""C(#CC1NCCOC1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""85855C1525FD8340"""
+"""711D543022639A2A_147EB98D524DEA60_2267_UN""","""C(#CC1NCCOC1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""85855C1525FD8340"""
+"""86EDC3EC620AC59A_D471B850D89FB6FB_2267_UN""","""C(#CC1NCCOC1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""85855C1525FD8340"""
+"""5251ED6B3A3FE4B3_93142228A20F9197_2267_UN""","""C(#CC1NCCOC1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""85855C1525FD8340"""
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+"""A246E708721E033A_CFB1353FD0455DB5_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)[NH]C(=N2)CN)CC3(CCNC3)C""",21,"""884DADFE6BBE9F5E"""
+"""C067761509E0DB35_7F48DF8D11CAD719_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)[NH]C(=N2)CN)CC34CC(N)(C3)C4""",21,"""884DADFE6BBE9F5E"""
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+"""52CBDF995DFBF515_96EDFDD1716B5687_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)[NH]C(=N2)CN)C[C@@H]3COCCN3""",21,"""884DADFE6BBE9F5E"""
+"""86437E89C5CE0BCC_69E97912F042F39F_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)[NH]C(=N2)CN)CCCC(CC)N""",21,"""884DADFE6BBE9F5E"""
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+"""A5642424A755A870_725DB85EF909BF76_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)[NH]C(=N2)CN)CC3CC(NC)C3""",21,"""884DADFE6BBE9F5E"""
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+"""2A9A30BB6068CE00_C9B9057CA10B5CE9_6031_DP""","""O(C(=O)C1=CC2=C(C=C1)[NH]C(=N2)CN)C[C@@H]3OCCNC3""",21,"""884DADFE6BBE9F5E"""
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+"""848ACC56803B13A8_052FA7E780B5FC12_2267_UN""","""C(#CC1=CC=NC=C1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""88E80DE474CD37FD"""
+"""0A029C31561CD93E_62195109332B7F99_2267_UN""","""C(#CC1=CC=NC=C1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""88E80DE474CD37FD"""
+"""CE15EEA13F590C57_E998FAFBB539B688_2267_UN""","""C(#CC1=CC=NC=C1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""88E80DE474CD37FD"""
+"""F9AE0F563CA9A7FA_1913E87C037D5EDD_2267_UN""","""C(#CC1=CC=NC=C1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""88E80DE474CD37FD"""
+"""6BCDC1F2A61D5628_D91CE9A189AF0246_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""88E80DE474CD37FD"""
+"""A429B58BF02BA263_9E7973D9F33F252A_2267_UN""","""C(#CC1=CC=NC=C1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""88E80DE474CD37FD"""
+"""D68C13DE46290C7C_9154230CDD95A6C6_2267_UN""","""C(#CC1=CC=NC=C1)C2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""88E80DE474CD37FD"""
+"""20ACC265FF3121C8_F7A81DC77C80CBA0_2267_UN""","""C(#CC1=CC=NC=C1)C2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""88E80DE474CD37FD"""
+"""CEFA6567924395CE_5D7CAD80F243D10F_2267_UN""","""C(#CC1=CC=NC=C1)C2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""88E80DE474CD37FD"""
+"""04AFC151E730D946_BDF8FE8DBAA189D1_2267_UN""","""C(#CC1=CC=NC=C1)C2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""88E80DE474CD37FD"""
+"""CFE25CE1228A96FD_D8D3317B51320FD8_2267_UN""","""C(#CC1=CC=NC=C1)C2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""88E80DE474CD37FD"""
+"""814C03F92FEA2F44_1AF905C5BAA2C58A_2267_UN""","""C(#CC1=CC=NC=C1)C3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""88E80DE474CD37FD"""
+"""E9C255570D9F5D94_A4343A2C1CA9D205_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""88E80DE474CD37FD"""
+"""40F5F45F54FF96B5_8CDF2B6406ECB908_2267_UN""","""C(#CC1=CC=NC=C1)C2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""88E80DE474CD37FD"""
+"""C5E613073DA367CA_4FA0DD8D04646236_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""88E80DE474CD37FD"""
+"""DB96D2DEC84FB7EF_9AB0FF31952CFC65_2267_UN""","""C(#CC1=CC=NC=C1)C3=CC=C(CC2(C)NCCC2)C=C3""",21,"""88E80DE474CD37FD"""
+"""8594E42B5E165991_390EB63C1BB59B09_2267_UN""","""C(#CC1=CC=NC=C1)C2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""88E80DE474CD37FD"""
+"""01B1A39A8B2C0F9E_12011B28E4CBD12A_2267_UN""","""C(#CC1=CC=NC=C1)C2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""88E80DE474CD37FD"""
+"""687B1C1F81255150_FE8C6A0B94F3F8F7_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC=C(C=C2)C3NCCNC3=O""",21,"""88E80DE474CD37FD"""
+"""717FB9AC807ACCCF_04317137AADB84F1_2267_UN""","""C(#CC1=CC=NC=C1)C2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""88E80DE474CD37FD"""
+"""D62A77CB0AF7426F_A25DE552881E4335_2267_UN""","""C(#CC1=CC=NC=C1)C(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""88E80DE474CD37FD"""
+"""AE28D88E958E6F45_2830D45D8F90C861_2267_UN""","""C(#CC1=CC=NC=C1)C2=C[N](CC(OCC)OCC)N=C2""",21,"""88E80DE474CD37FD"""
+"""6A12AD6DD90F5AAF_F4A6148FEA5B322A_2267_UN""","""C(#CC1=CC=NC=C1)C2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""88E80DE474CD37FD"""
+"""B72F573F7BE29117_42B48089EEBC5D86_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""88E80DE474CD37FD"""
+"""648A6DF256DA3F1E_47B919F2864B3A13_2267_UN""","""C(#CC1=CC=NC=C1)C3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""88E80DE474CD37FD"""
+"""DD989825FACA5AB7_BE7CD1BA34939439_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""88E80DE474CD37FD"""
+"""5097823AC531D344_9AA6D560623D9FB1_2267_UN""","""C(#CC1=CC=NC=C1)C2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""88E80DE474CD37FD"""
+"""29E48F8F8C888108_EDCE6872A5E8F5C6_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""88E80DE474CD37FD"""
+"""42C6DBE8E5522C59_3B858C506D372CF7_2267_UN""","""C(#CC1=CC=NC=C1)C2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""88E80DE474CD37FD"""
+"""274D18FB06E8B078_1F1A73B855C9F64C_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""88E80DE474CD37FD"""
+"""A6A81DC9C15AA818_900A8424944597C5_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""88E80DE474CD37FD"""
+"""1B8E0F4D3D2B6FD1_D91FA9951BED88D6_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC=C(C=C2)CN3CCCCC3""",21,"""88E80DE474CD37FD"""
+"""FEC8EAE752C6EF48_053B93F7246AB65C_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""88E80DE474CD37FD"""
+"""7FD92CD31222AB72_CA89870133F25BED_2267_UN""","""C(#CC1=CC=NC=C1)C2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""88E80DE474CD37FD"""
+"""A49FE8648B7A75B9_8EA370A4A4DC8F3B_2267_UN""","""C(#CC1=CC=NC=C1)C2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""88E80DE474CD37FD"""
+"""C47061AC283505E0_F505FEF94CACAA6B_2267_UN""","""C(#CC1=CC=NC=C1)C3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""88E80DE474CD37FD"""
+"""254320D36AAE9A2B_C7A3466137438231_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC=C(CCCCC(O)=O)C=C2""",21,"""88E80DE474CD37FD"""
+"""FDC47D55A7C531E6_F2804EA60136F93E_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""88E80DE474CD37FD"""
+"""089052E86E681210_AA3284FCC16A0C2B_2267_UN""","""C(#CC1=CC=NC=C1)C2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""88E80DE474CD37FD"""
+"""FC98CD822E41E54C_F254F392DF38F5B2_2267_UN""","""C(#CC1=CC=NC=C1)C3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""88E80DE474CD37FD"""
+"""2727B700A4D9D492_61E581A36BEB35AC_6036_UN""","""NCCC[N]1C=C(CN([S](CC)(=O)=O)CC(=O)OC)N=N1""",21,"""8A31C96B12F9AB23"""
+"""7B13DA988ADA17A5_42B83407D428DD31_6036_UN""","""NCCC[N]1C=C(CN([C@H](C(OC)=O)C)[S](=O)(=O)C)N=N1""",21,"""8A31C96B12F9AB23"""
+"""FF21FC81E4312058_68CF1B7E06A3C097_6036_UN""","""NCCC[N]2C=C(CN(C)[S](=O)(=O)C1=CC=C(Br)S1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""BEEEBCF7EF21767E_3A7A0C97CA3B7508_6036_UN""","""NCCC[N]3C=C(CN1C2=C(C[S]1(=O)=O)C=CC=C2)N=N3""",21,"""8A31C96B12F9AB23"""
+"""A7895458C6690D2D_5B31DF347A2016F2_6036_UN""","""NCCC[N]2C=C(CN(C)[S](=O)(=O)C1CCCNC1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""BAFBDAA53BD7C6E3_6D33E31E48415A40_6036_UN""","""NCCC[N]2C=C(CN(C)[S](=O)(=O)CC1CCCN1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""85C085D23E76AEDE_49ECA0A3E3FA2A56_6036_UN""","""NCCC[N]2C=C(CN(C)[S](=O)(=O)C1=CC=C(Cl)S1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""B989264849B77DDA_86C895B7A2A7E3F6_6036_UN""","""NCCC[N]2C=C(CN([S](C)(=O)=O)C1CCCNC1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""47742F0A54F783C6_538F922E51215EBC_6036_UN""","""NCCC[N]2C=C(CN([S](C)(=O)=O)C1=NN=C(N)S1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""A9D6CDD9D3FC8A5B_EBC9A68BC7F123C7_6036_UN""","""NCCC[N]2C=C(CN(CC)[S](=O)(=O)C1CCNC1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""8E04C7C0A6C838FF_2E6A28B17B310C3E_6036_UN""","""NCCC[N]1C=C(CN([S](C(C)(C)C)(=O)=O)CC=C)N=N1""",21,"""8A31C96B12F9AB23"""
+"""02FB6821CE0076CC_8B31BDD539D40BC9_6036_UN""","""NCCC[N]1C=C(CN(C)[S](=O)(=O)CC[S](=O)(=O)C)N=N1""",21,"""8A31C96B12F9AB23"""
+"""E5EAF10D76F5B913_85A0CA9F00B27846_6036_UN""","""NCCC[N]1C=C(CN(C(C)(C)C)[S](=O)(=O)CCN)N=N1""",21,"""8A31C96B12F9AB23"""
+"""75597B9C5078972B_6B39A7AEB78DDE46_6036_UN""","""NCCC[N]2C=C(CN([S](C)(=O)=O)CCNC1CC1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""AC641182C6D156AF_D4A5E2D17E995DEE_6036_UN""","""NCCC[N]1C=C(CN([S](C)(=O)=O)C(=O)CN=[N]#N)N=N1""",21,"""8A31C96B12F9AB23"""
+"""B2A83E88743BD488_632B12A23CE5BBE7_6036_UN""","""NCCC[N]2C=C(CN(C)[S](=O)(=O)C1CCNCC1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""F37E980568852E2E_CDB971E2E6F2B448_6036_UN""","""NCCC[N]2C=C(CN1[S](CCC1C(OC)=O)(=O)=O)N=N2""",21,"""8A31C96B12F9AB23"""
+"""0C97BE7E68D6CB38_D59DA00ED43778FF_6036_UN""","""NCCC[N]3C=C(CN1[S](=O)(=O)C2=C(C1)C=CC=C2)N=N3""",21,"""8A31C96B12F9AB23"""
+"""ABF5E37A3E5D349F_35D1E9588995FB93_6036_UN""","""NCCC[N]2C=C(CN([S](C)(=O)=O)CC1=CC=NO1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""37C6D9EA0DAE6DB1_79BF545BB593A7B7_6036_UN""","""NCCC[N]2C=C(CN([S](C)(=O)=O)C1CCNCC1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""D2A374E419D7A810_06A4811A2AB76AD9_6036_UN""","""NCCC[N]2C=C(CN([S](C)(=O)=O)C1=NC=CC=C1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""EF9F9E6B66FD3CB1_D6DBD2187098423F_6036_UN""","""NCCC[N]2C=C(CN(C)[S](=O)(=O)C1=CN=CC=C1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""62BB8BC732A23470_04EA014A1834E237_6036_UN""","""NCCC[N]1C=C(CN(C(C)(C)C(=N)N)[S](=O)(=O)C)N=N1""",21,"""8A31C96B12F9AB23"""
+"""A09DD3BB9D4B97BD_BFBBD8D110A3CD73_6036_UN""","""NCCC[N]2C=C(CN(C)[S](=O)(=O)C1=C[N](C)C=N1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""4C6C603D1243019B_4D1A83C258B81349_6036_UN""","""NCCC[N]2C=C(CN1CCCC(C(C)C)[S]1(=O)=O)N=N2""",21,"""8A31C96B12F9AB23"""
+"""869D07F2A8B25235_6D0E974B58785375_6036_UN""","""NCCC[N]2C=C(CN([S](C)(=O)=O)CC1CNCC1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""4FA4AD9738976564_51722C5D0F8DFCC3_6036_UN""","""NCCC[N]2C=C(CN([S](C)(=O)=O)[C@@H]1CNCCC1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""B53B0D2599752208_583A31C4728B8DBC_6036_UN""","""NCCC[N]2C=C(CN(CCCCl)[S](=O)(=O)C1CC1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""37BF4CFCB204E018_FA0FE81C0F5C2537_6036_UN""","""NCCC[N]3C=C(CN1C(=O)C2=C([S]1(=O)=O)C=CS2)N=N3""",21,"""8A31C96B12F9AB23"""
+"""17B4C1449507656C_EB1B3B3F1C291603_6036_UN""","""NCCC[N]1C=C(CN(C(C(C)(C)N)=O)[S](=O)(=O)C)N=N1""",21,"""8A31C96B12F9AB23"""
+"""82F2FE5CDB399904_1EAD0513E6B2F838_6036_UN""","""NCCC[N]2C=C(CN(CCCN)[S](=O)(=O)C1CC1)N=N2""",21,"""8A31C96B12F9AB23"""
+"""D21E90B25227846B_22A9310AAEA5EE56_6036_UN""","""NCCC[N]2C=C(CN1CCCC(CC=C)[S]1(=O)=O)N=N2""",21,"""8A31C96B12F9AB23"""
+"""6D7B1F2B128CE20E_CBDF0B2DBF8B2409_6036_UN""","""NCCC[N]1C=C(CN(CCCN)[S](=O)(=O)C(F)F)N=N1""",21,"""8A31C96B12F9AB23"""
+"""47920C18A38D9172_38DFA1C02594CBDD_6036_UN""","""NCCC[N]3C=C(CN1[S](C2(CC1CI)CC2)(=O)=O)N=N3""",21,"""8A31C96B12F9AB23"""
+"""6833792BFB870CA2_31B1B123DC815462_6036_UN""","""NCCC[N]2C=C(CN1CCCCNCC[S]1(=O)=O)N=N2""",21,"""8A31C96B12F9AB23"""
+"""CC584B75840D4500_45E97680DFA888CA_6036_UN""","""NCCC[N]3C=C(CN1[S](=O)(=O)C2(C1)CCOCC2)N=N3""",21,"""8A31C96B12F9AB23"""
+"""390B7D356489EAAA_AA32869409C447BC_6036_UN""","""NCCC[N]3C=C(CN1C(CN)CC2([S]1(=O)=O)CC2)N=N3""",21,"""8A31C96B12F9AB23"""
+"""3B7D1455B0731E98_0DCCA9DCCA6354A6_6036_UN""","""NCCC[N]3C=C(CN([S](=O)(=O)C1CC1)C2CNC2)N=N3""",21,"""8A31C96B12F9AB23"""
+"""D5D5E74BDADBFA08_358B588D12D246A9_6036_UN""","""NCCC[N]3C=C(CN1CC2(C[S]1(=O)=O)CCCC2)N=N3""",21,"""8A31C96B12F9AB23"""
+"""F59033F545F514C6_9FD55A87CB0F2B0F_6036_UN""","""NCCC[N]3C=C(CN([S](=O)(=O)C1CNC1)C2CC2)N=N3""",21,"""8A31C96B12F9AB23"""
+"""6918BBD1CBDDF779_3B77DC5F9563C274_6036_UN""","""NCCC[N]1C=C(CN([S](C)(=O)=O)CC[S](=O)(=O)Cl)N=N1""",21,"""8A31C96B12F9AB23"""
+"""C3E65F501A8984CC_2B3B0223CC640991_6036_UN""","""NCCC[N]1C=C(CN(CCC)[S](=O)(=O)C(F)(F)F)N=N1""",21,"""8A31C96B12F9AB23"""
+"""8A5923DE25365FD0_60B2D80CFEA2F640_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](CC)(=O)=O)CC(=O)OC""",21,"""8B6690C487B068CF"""
+"""112FCBA1F6BCACF2_43EF6DA841611EDD_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""8B6690C487B068CF"""
+"""23419C9928D5DDC5_699842D193EA037B_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""8B6690C487B068CF"""
+"""A472C22D4CBF7B63_3B2D55385F72B6E4_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""8B6690C487B068CF"""
+"""FD0D374B7417A734_5A66869BEF69D51E_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C)[S](=O)(=O)C2CCCNC2""",21,"""8B6690C487B068CF"""
+"""D5E5DB4956BB68A6_6C64BAB1DD0899AC_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C)[S](=O)(=O)CC2CCCN2""",21,"""8B6690C487B068CF"""
+"""287DB006AFD2251F_48BBF90C76B3E9BA_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""8B6690C487B068CF"""
+"""45996DC05626CBFC_879FCC1837EE201A_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C)(=O)=O)C2CCCNC2""",21,"""8B6690C487B068CF"""
+"""A494EE567002D745_52D8CB81C4689D50_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""8B6690C487B068CF"""
+"""2852E0295B1DE144_EA9EFF2452B8E02B_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(CC)[S](=O)(=O)C2CCNC2""",21,"""8B6690C487B068CF"""
+"""3AA11E8EB8AC7162_2F3D711EEE78CFD2_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""8B6690C487B068CF"""
+"""FE0DEF0A4A9E29C3_8A66E47AAC9DC825_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""8B6690C487B068CF"""
+"""DC74C533AA53561E_84F7933095FBBBAA_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""8B6690C487B068CF"""
+"""2BAD74A3241ED5B8_6A6EFE0122C41DAA_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C)(=O)=O)CCNC2CC2""",21,"""8B6690C487B068CF"""
+"""2F9F6CEBA932EF71_D5F2BB7EEBD09E02_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""8B6690C487B068CF"""
+"""D2BBA5179434F9D6_627C4B0DA9AC780B_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C)[S](=O)(=O)C2CCNCC2""",21,"""8B6690C487B068CF"""
+"""A1D9731BFE4A7600_CCEE284D73BB77A4_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""8B6690C487B068CF"""
+"""1231BE04AF744C38_D4CAF9A1417EBB13_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""8B6690C487B068CF"""
+"""34370F35965FBAA0_3486B0F71CDC387F_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""8B6690C487B068CF"""
+"""5F0B2D5264F1B472_78E80DF420DA645B_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C)(=O)=O)C2CCNCC2""",21,"""8B6690C487B068CF"""
+"""7CA6BAFE4ED8B773_07F3D8B5BFFEA935_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""8B6690C487B068CF"""
+"""9BF3F34AC926AFAF_D78C8BB7E5D181D3_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""8B6690C487B068CF"""
+"""2EB6432F910976FC_05BD58E58D7D21DB_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""8B6690C487B068CF"""
+"""05250B73F701E9A9_BEEC817E85EA0E9F_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""8B6690C487B068CF"""
+"""9E7B07BFCD84A522_4C4DDA6DCDF1D0A5_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""8B6690C487B068CF"""
+"""C919473449FC8DCC_6C59CEE4CD319099_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C)(=O)=O)CC2CNCC2""",21,"""8B6690C487B068CF"""
+"""6317854EDA215A7F_502575F29AC43F2F_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""8B6690C487B068CF"""
+"""B41D8D5480CD83AB_596D686BE7C24E50_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""8B6690C487B068CF"""
+"""1B5D14EDEB06DCCB_FB58B1B39A15E6DB_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""8B6690C487B068CF"""
+"""C785CB458467F3F2_EA4C62908960D5EF_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""8B6690C487B068CF"""
+"""93E44EA47C86F191_1FFA5CBC73FB3BD4_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(CCCN)[S](=O)(=O)C2CC2""",21,"""8B6690C487B068CF"""
+"""BA254011236B3F7C_23FE68A53BEC2DBA_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""8B6690C487B068CF"""
+"""89794C20E0AFFBF6_CA8852822AC2E7E5_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""8B6690C487B068CF"""
+"""D24DC7E58EDF12F0_3988F86FB0DD0831_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""8B6690C487B068CF"""
+"""6FA2C24E22022C63_30E6E88C49C8978E_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2CCCCNCC[S]2(=O)=O""",21,"""8B6690C487B068CF"""
+"""0E0229D5A4968DF7_44BE2F2F4AE14B26_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""8B6690C487B068CF"""
+"""17EC2A37EC141542_AB65DF3B9C8D8450_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""8B6690C487B068CF"""
+"""6FACEA0B8872305A_0C9BF0735F2A974A_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""8B6690C487B068CF"""
+"""7A3D37A717FCFA45_34DC0122879B8545_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""8B6690C487B068CF"""
+"""D81D80AFB0EA677C_9E8203285E46E8E3_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""8B6690C487B068CF"""
+"""77D3E5ECD306641A_3A2085F0002A0198_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""8B6690C487B068CF"""
+"""78BF3853EDE6F09D_2A6C5B8C592DCA7D_6036_UN""","""CC1(C)CC(CC(C)(C)N1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""8B6690C487B068CF"""
+"""3F509A025533B18E_60A1BE4A3BABC5DE_6036_UN""","""CCC(CN1CCNCC1)N([S](CC)(=O)=O)CC(=O)OC""",21,"""8B75F68242B95B51"""
+"""A86FF349E48CD2E8_43FC0BEE84682D43_6036_UN""","""CCC(CN1CCNCC1)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""8B75F68242B95B51"""
+"""7CA45F2C624581DE_698B249756E330E5_6036_UN""","""CCC(CN1CCNCC1)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""8B75F68242B95B51"""
+"""641F1C1925893DAC_3B3E337E9A7B857A_6036_UN""","""CCC(CN1CCNCC1)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""8B75F68242B95B51"""
+"""DEB79E712A42E1A9_5A75E0DD2A60E680_6036_UN""","""CCC(CN1CCNCC1)N(C)[S](=O)(=O)C2CCCNC2""",21,"""8B75F68242B95B51"""
+"""F39CE58FA718748E_6C77DCF71801AA32_6036_UN""","""CCC(CN1CCNCC1)N(C)[S](=O)(=O)CC2CCCN2""",21,"""8B75F68242B95B51"""
+"""E20B9A510A314338_48A89F4AB3BADA24_6036_UN""","""CCC(CN1CCNCC1)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""8B75F68242B95B51"""
+"""3EA3EDCF91D9D404_878CAA5EF2E71384_6036_UN""","""CCC(CN1CCNCC1)N([S](C)(=O)=O)C2CCCNC2""",21,"""8B75F68242B95B51"""
+"""A5CE9BAB05A505BF_52CBADC70161AECE_6036_UN""","""CCC(CN1CCNCC1)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""8B75F68242B95B51"""
+"""04D7532A68873821_EA8D996297B1D3B5_6036_UN""","""CCC(CN1CCNCC1)N(CC)[S](=O)(=O)C2CCNC2""",21,"""8B75F68242B95B51"""
+"""10DEA12012D52E62_2F2E17582B71FC4C_6036_UN""","""CCC(CN1CCNCC1)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""8B75F68242B95B51"""
+"""F3DB7504BFB3A4E6_8A75823C6994FBBB_6036_UN""","""CCC(CN1CCNCC1)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""8B75F68242B95B51"""
+"""5167B9897DBC1E93_84E4F57650F28834_6036_UN""","""CCC(CN1CCNCC1)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""8B75F68242B95B51"""
+"""FA5AFD161B3F7E7E_6A7D9847E7CD2E34_6036_UN""","""CCC(CN1CCNCC1)N([S](C)(=O)=O)CCNC2CC2""",21,"""8B75F68242B95B51"""
+"""65F8A66FF84AC655_D5E1DD382ED9AD9C_6036_UN""","""CCC(CN1CCNCC1)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""8B75F68242B95B51"""
+"""474F914BC49A0671_626F2D4B6CA54B95_6036_UN""","""CCC(CN1CCNCC1)N(C)[S](=O)(=O)C2CCNCC2""",21,"""8B75F68242B95B51"""
+"""129FE24C5FB4F8B9_CCFD4E0BB6B2443A_6036_UN""","""CCC(CN1CCNCC1)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""8B75F68242B95B51"""
+"""3F0193A125D92233_D4D99FE78477888D_6036_UN""","""CCC(CN1CCNCC1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""8B75F68242B95B51"""
+"""B659AE797EF0B877_3495D6B1D9D50BE1_6036_UN""","""CCC(CN1CCNCC1)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""8B75F68242B95B51"""
+"""199E226B29AEC461_78FB6BB2E5D357C5_6036_UN""","""CCC(CN1CCNCC1)N([S](C)(=O)=O)C2CCNCC2""",21,"""8B75F68242B95B51"""
+"""30BE5E99F4A7A27A_07E0BEF37AF79AAB_6036_UN""","""CCC(CN1CCNCC1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""8B75F68242B95B51"""
+"""2A1671DC3F066E76_D79FEDF120D8B24D_6036_UN""","""CCC(CN1CCNCC1)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""8B75F68242B95B51"""
+"""673B7E41BB38EAE5_05AE3EA348741245_6036_UN""","""CCC(CN1CCNCC1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""8B75F68242B95B51"""
+"""63DBCBD78FC14155_BEFFE73840E33D01_6036_UN""","""CCC(CN1CCNCC1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""8B75F68242B95B51"""
+"""556E1125FCED0F4C_4C5EBC2B08F8E33B_6036_UN""","""CCC(CN1CCNCC1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""8B75F68242B95B51"""
+"""3E0DAA87DD42A9B4_6C4AA8A20838A307_6036_UN""","""CCC(CN1CCNCC1)N([S](C)(=O)=O)CC2CNCC2""",21,"""8B75F68242B95B51"""
+"""3A094AA26580F8D9_503613B45FCD0CB1_6036_UN""","""CCC(CN1CCNCC1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""8B75F68242B95B51"""
+"""6287DA59225C7473_597E0E2D22CB7DCE_6036_UN""","""CCC(CN1CCNCC1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""8B75F68242B95B51"""
+"""343CBD54B778D01F_FB4BD7F55F1CD545_6036_UN""","""CCC(CN1CCNCC1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""8B75F68242B95B51"""
+"""F0FAF8220011BE47_EA5F04D64C69E671_6036_UN""","""CCC(CN1CCNCC1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""8B75F68242B95B51"""
+"""A6835ED3D5975067_1FE93AFAB6F2084A_6036_UN""","""CCC(CN1CCNCC1)N(CCCN)[S](=O)(=O)C2CC2""",21,"""8B75F68242B95B51"""
+"""EE9285C59574EC17_23ED0EE3FEE51E24_6036_UN""","""CCC(CN1CCNCC1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""8B75F68242B95B51"""
+"""D8FDE85938728597_CA9B34C4EFCBD47B_6036_UN""","""CCC(CN1CCNCC1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""8B75F68242B95B51"""
+"""06CDBD486C6FFC69_399B9E2975D43BAF_6036_UN""","""CCC(CN1CCNCC1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""8B75F68242B95B51"""
+"""AB2B222BC914D513_30F58ECA8CC1A410_6036_UN""","""CCC(CN1CCNCC1)N2CCCCNCC[S]2(=O)=O""",21,"""8B75F68242B95B51"""
+"""2C669E636E7FAFBD_44AD49698FE878B8_6036_UN""","""CCC(CN1CCNCC1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""8B75F68242B95B51"""
+"""1BAC2AB1F24452C0_AB76B97D5984B7CE_6036_UN""","""CCC(CN1CCNCC1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""8B75F68242B95B51"""
+"""51D08CE95B13C0A2_0C8896359A23A4D4_6036_UN""","""CCC(CN1CCNCC1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""8B75F68242B95B51"""
+"""B6B9C0C47DC84C40_34CF67644292B6DB_6036_UN""","""CCC(CN1CCNCC1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""8B75F68242B95B51"""
+"""DA3D08BB7586B716_9E91656E9B4FDB7D_6036_UN""","""CCC(CN1CCNCC1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""8B75F68242B95B51"""
+"""4FD8B13FB94E1B3A_3A33E3B6C5233206_6036_UN""","""CCC(CN1CCNCC1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""8B75F68242B95B51"""
+"""330C9D21AA3A36C2_2A7F3DCA9C24F9E3_6036_UN""","""CCC(CN1CCNCC1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""8B75F68242B95B51"""
+"""D5F6BAD50D499651_60593007CEE075E1_6036_UN""","""C(CNCC1CCCCC1)N([S](CC)(=O)=O)CC(=O)OC""",21,"""8B8D78CFB7F2EB6E"""
+"""C21DD0D4E86B6930_430485A371239D7C_6036_UN""","""C(CNCC1CCCCC1)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""8B8D78CFB7F2EB6E"""
+"""658E6A702483DE24_6973AADAA3A880DA_6036_UN""","""C(CNCC1CCCCC1)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""8B8D78CFB7F2EB6E"""
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+"""219BFCAE37BA5923_1FE1C65F00949D9E_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OC[C@@H](C(OC)=O)N""",21,"""8FEF1A36AEF9EEC8"""
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+"""536399B43F19A532_4310355B7113DFA1_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCC(CCN)(C)C""",21,"""8FEF1A36AEF9EEC8"""
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+"""ECC78C48E1AFE966_78EA6845D48DA68F_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCC23CC(N)(C2)C3""",21,"""8FEF1A36AEF9EEC8"""
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+"""C659AEE678A720F5_170254E9FA68686D_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCC(=C2CNC2)F""",21,"""8FEF1A36AEF9EEC8"""
+"""4563959EE6E57F38_44D2B435258CCCE2_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCC[C@H]2CCCN2""",21,"""8FEF1A36AEF9EEC8"""
+"""1ABDCC5CFEFC4FA9_478FD2F416C5C5C8_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OC[C@H]2CC[C@@H](N)C2""",21,"""8FEF1A36AEF9EEC8"""
+"""F9E86EF20A3FE9FA_1A7950CB381F7654_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OC[C@H]2COC[C@H]2N""",21,"""8FEF1A36AEF9EEC8"""
+"""9727E5B2D096E54F_595EB4790FCC21E7_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OC[C@H]2CCC[C@H]2N""",21,"""8FEF1A36AEF9EEC8"""
+"""C834460374E9B500_7D74C75502DB8EBF_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCC2C(CN2)(C)C""",21,"""8FEF1A36AEF9EEC8"""
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+"""631246C5DFB79829_A9E275C54E35F4EA_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCCC2(CN)CC2""",21,"""8FEF1A36AEF9EEC8"""
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+"""A8E140649A3BE317_92CAAA76883CE7C6_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCC(C(C)C)CN""",21,"""8FEF1A36AEF9EEC8"""
+"""EF315EF88193AF0D_A2F8BBCF7B5131EB_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCC2=CNCCO2""",21,"""8FEF1A36AEF9EEC8"""
+"""67615F64D9DF2893_9AA75454A38CB553_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCC2=CNCCC2""",21,"""8FEF1A36AEF9EEC8"""
+"""60F97525A63A2F61_F79A892F79F73652_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCCC2CC(N)C2""",21,"""8FEF1A36AEF9EEC8"""
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+"""C9C0314170F8B707_78BEE5B581E5561C_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCC2(CN)COC2""",21,"""8FEF1A36AEF9EEC8"""
+"""F66D7E029D64E2C7_53A06928CF3FE2DC_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCCCCCCN""",21,"""8FEF1A36AEF9EEC8"""
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+"""E66D186E481288F3_DC838BECFEB7615A_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OC[C@H]2CCCNC2""",21,"""8FEF1A36AEF9EEC8"""
+"""E9B9C069081219F1_75FF0F963C4ECEE0_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCC2CC(NC)C2""",21,"""8FEF1A36AEF9EEC8"""
+"""5A384F106CFE17F7_2540FF2C9021952D_6031_DP""","""COC1=CC(=CC=C1)CC(N)C(=O)OCCC2CCNC2""",21,"""8FEF1A36AEF9EEC8"""
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+"""EA586341017E89E2_679F3E9365983089_2267_UN""","""C(#CC1CCNCC1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""9075EE859C27B190"""
+"""E17375275EB65CD6_F94CB7C58A6F67DA_2267_UN""","""C(#CC1CCNCC1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""9075EE859C27B190"""
+"""F1E312C8260469F1_1DB24486685F7A7F_2267_UN""","""C(#CC1CCNCC1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""9075EE859C27B190"""
+"""575F3B7F51D95F98_7A84B268DBC1F9F4_2267_UN""","""C(#CC1CCNCC1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""9075EE859C27B190"""
+"""510F2FEA17C8A6D8_F105199A5DD330E5_2267_UN""","""C(#CC1CCNCC1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""9075EE859C27B190"""
+"""D7A71EFC8A6E0056_018E0B1DEB97D8B0_2267_UN""","""C(#CC1CCNCC1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""9075EE859C27B190"""
+"""ABE09D717D0CB3AD_C1810AC06145842B_2267_UN""","""C(#CC1CCNCC1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""9075EE859C27B190"""
+"""E3573E5BF9663989_86E490B81BD5A347_2267_UN""","""C(#CC1CCNCC1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""9075EE859C27B190"""
+"""4C9FD0CE6D0A1362_89C9C06D357F20AB_2267_UN""","""C(#CC1CCNCC1)C2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""9075EE859C27B190"""
+"""E7CA36343DF65F40_EF35FEA6946A4DCD_2267_UN""","""C(#CC1CCNCC1)C2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""9075EE859C27B190"""
+"""22AB45FE45F34037_45E14EE11AA95762_2267_UN""","""C(#CC1CCNCC1)C2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""9075EE859C27B190"""
+"""DDEF5EF5016EAD60_A5651DEC524B0FBC_2267_UN""","""C(#CC1CCNCC1)C2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""9075EE859C27B190"""
+"""2E089AA460017D23_C04ED21AB9D889B5_2267_UN""","""C(#CC1CCNCC1)C2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""9075EE859C27B190"""
+"""E48514F410195650_0264E6A4524843E7_2267_UN""","""C(#CC1CCNCC1)C3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""9075EE859C27B190"""
+"""33B730814D53549B_BCA9D94DF4435468_2267_UN""","""C(#CC1CCNCC1)C2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""9075EE859C27B190"""
+"""BC4188C8473C7661_9442C805EE063F65_2267_UN""","""C(#CC1CCNCC1)C2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""9075EE859C27B190"""
+"""2A0714CCE94DBCE1_573D3EECEC8EE45B_2267_UN""","""C(#CC1CCNCC1)C2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""9075EE859C27B190"""
+"""39C0390B52CF5DE6_822D1C507DC67A08_2267_UN""","""C(#CC1CCNCC1)C3=CC=C(CC2(C)NCCC2)C=C3""",21,"""9075EE859C27B190"""
+"""85ACF6CBF034AF97_2193555DF35F1D64_2267_UN""","""C(#CC1CCNCC1)C2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""9075EE859C27B190"""
+"""23BD7F9476B64EFE_0A9CF8490C215747_2267_UN""","""C(#CC1CCNCC1)C2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""9075EE859C27B190"""
+"""B55EB01E77474ED3_E611896A7C197E9A_2267_UN""","""C(#CC1CCNCC1)C2=CC=C(C=C2)C3NCCNC3=O""",21,"""9075EE859C27B190"""
+"""B82D2B0141A88EF1_1CAC92564231029C_2267_UN""","""C(#CC1CCNCC1)C2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""9075EE859C27B190"""
+"""E92234926E30CD1A_BAC0063360F4C558_2267_UN""","""C(#CC1CCNCC1)C(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""9075EE859C27B190"""
+"""EF6BE5D78773F0F9_30AD373C677A4E0C_2267_UN""","""C(#CC1CCNCC1)C2=C[N](CC(OCC)OCC)N=C2""",21,"""9075EE859C27B190"""
+"""3CAA5FE016EE22C5_EC3BF7EE02B1B447_2267_UN""","""C(#CC1CCNCC1)C2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""9075EE859C27B190"""
+"""36453FECEFEA5984_5A2963E80656DBEB_2267_UN""","""C(#CC1CCNCC1)C2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""9075EE859C27B190"""
+"""7884E42477B29A93_5F24FA936EA1BC7E_2267_UN""","""C(#CC1CCNCC1)C3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""9075EE859C27B190"""
+"""DC4C107D360000BD_A6E132DBDC791254_2267_UN""","""C(#CC1CCNCC1)C2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""9075EE859C27B190"""
+"""44833824B18ED757_823B36018AD719DC_2267_UN""","""C(#CC1CCNCC1)C2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""9075EE859C27B190"""
+"""E2F3A7F5E0A9DF1C_F5538B134D0273AB_2267_UN""","""C(#CC1CCNCC1)C2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""9075EE859C27B190"""
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+"""2F7C23788543E531_B1C08DD7F132F7F5_6036_UN""","""NCC(CN1C(CN)CC2([S]1(=O)=O)CC2)C3=CC=CC=C3""",21,"""91C3C228EA0F1B6A"""
+"""A1E726F444FDE9FC_163EA29F3295E4EF_6036_UN""","""NCC(CN([S](=O)(=O)C1CC1)C2CNC2)C3=CC=CC=C3""",21,"""91C3C228EA0F1B6A"""
+"""415EBFBF3AE5DB1E_2E7953CEEA24F6E0_6036_UN""","""NCC(CN1CC2(C[S]1(=O)=O)CCCC2)C3=CC=CC=C3""",21,"""91C3C228EA0F1B6A"""
+"""2ECD8526E99A4750_842751C433F99B46_6036_UN""","""NCC(CN([S](=O)(=O)C1CNC1)C2CC2)C3=CC=CC=C3""",21,"""91C3C228EA0F1B6A"""
+"""AA0F9AE8549FFB6F_2085D71C6D95723D_6036_UN""","""NCC(CN([S](C)(=O)=O)CC[S](=O)(=O)Cl)C1=CC=CC=C1""",21,"""91C3C228EA0F1B6A"""
+"""8BFE67CFC2A197A3_30C909603492B9D8_6036_UN""","""NCC(CN(CCC)[S](=O)(=O)C(F)(F)F)C1=CC=CC=C1""",21,"""91C3C228EA0F1B6A"""
+"""5133A042A0A62C60_792DEFA7B0038268_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](CC)(=O)=O)CC(=O)OC""",21,"""92F9A76FC9111CE7"""
+"""2438A30790D0555B_5A705A030FC06AF5_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""92F9A76FC9111CE7"""
+"""084B2A9A190E17B3_7007757ADD4B7753_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""92F9A76FC9111CE7"""
+"""39176A9A99A2838E_22B2629311D3C2CC_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""92F9A76FC9111CE7"""
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+"""DE0A86A3000087A7_9E00FBB3794F5432_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C)(=O)=O)C2CCCNC2""",21,"""92F9A76FC9111CE7"""
+"""ACD01540F12E3F74_4B47FC2A8AC9E978_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""92F9A76FC9111CE7"""
+"""E5FF440970C1A41D_F301C88F1C199403_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(CC)[S](=O)(=O)C2CCNC2""",21,"""92F9A76FC9111CE7"""
+"""7EE36814897D98C5_36A246B5A0D9BBFA_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""92F9A76FC9111CE7"""
+"""89D2AB7CD6A4E7A0_93F9D3D1E23CBC0D_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""92F9A76FC9111CE7"""
+"""AEDBF8686A23F352_9D68A49BDB5ACF82_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""92F9A76FC9111CE7"""
+"""5D335A395FF60D78_73F1C9AA6C656982_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C)(=O)=O)CCNC2CC2""",21,"""92F9A76FC9111CE7"""
+"""DE310F8A9D98307E_CC6D8CD5A571EA2A_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""92F9A76FC9111CE7"""
+"""70254EA934F3A473_7BE37CA6E70D0C23_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(C)[S](=O)(=O)C2CCNCC2""",21,"""92F9A76FC9111CE7"""
+"""E001F5E6F7A7376F_D5711FE63D1A038C_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""92F9A76FC9111CE7"""
+"""888D429D60F0D4D3_CD55CE0A0FDFCF3B_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""92F9A76FC9111CE7"""
+"""B31E8E0B714EDF70_2D19875C527D4C57_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""92F9A76FC9111CE7"""
+"""F02CC868E7F7C95F_61773A5F6E7B1073_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C)(=O)=O)C2CCNCC2""",21,"""92F9A76FC9111CE7"""
+"""7F18CB787E36C2C9_1E6CEF1EF15FDD1D_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""92F9A76FC9111CE7"""
+"""BFF976C553D0F761_CE13BC1CAB70F5FB_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""92F9A76FC9111CE7"""
+"""ACA78A7F7A63C8DB_1C226F4EC3DC55F3_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""92F9A76FC9111CE7"""
+"""DF25F8950D8F54FB_A773B6D5CB4B7AB7_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""92F9A76FC9111CE7"""
+"""97DF2C565B0E2F83_55D2EDC68350A48D_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""92F9A76FC9111CE7"""
+"""2A564836CA29F1FA_75C6F94F8390E4B1_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C)(=O)=O)CC2CNCC2""",21,"""92F9A76FC9111CE7"""
+"""A02AB8E2490BB6C8_49BA4259D4654B07_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""92F9A76FC9111CE7"""
+"""B3E9EF98FC66C537_40F25FC0A9633A78_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""92F9A76FC9111CE7"""
+"""23C4F8F95FC74314_E2C78618D4B492F3_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""92F9A76FC9111CE7"""
+"""12C899778206FA78_F3D3553BC7C1A1C7_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""92F9A76FC9111CE7"""
+"""4A1FECE50BA8A4A7_06656B173D5A4FFC_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(CCCN)[S](=O)(=O)C2CC2""",21,"""92F9A76FC9111CE7"""
+"""0C6557EF33000371_3A615F0E754D5992_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2CCCC(CC=C)[S]2(=O)=O""",21,"""92F9A76FC9111CE7"""
+"""2D5C9211ED44B4DC_D3176529646393CD_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N(CCCN)[S](=O)(=O)C(F)F""",21,"""92F9A76FC9111CE7"""
+"""974E62F34F01191A_2017CFC4FE7C7C19_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""92F9A76FC9111CE7"""
+"""EC651C07CAF7E10C_2979DF270769E3A6_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2CCCCNCC[S]2(=O)=O""",21,"""92F9A76FC9111CE7"""
+"""6BF48FFC4A26F747_5D21188404403F0E_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""92F9A76FC9111CE7"""
+"""5A1AADBD71DCAC31_B2FAE890D22CF078_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""92F9A76FC9111CE7"""
+"""DDCD849D2B04F3D5_1504C7D8118BE362_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""92F9A76FC9111CE7"""
+"""DE646CA926E37735_2D433689C93AF16D_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""92F9A76FC9111CE7"""
+"""73D624C56C6C22F3_871D348310E79CCB_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""92F9A76FC9111CE7"""
+"""69C68E0A3BFCCD30_23BFB25B4E8B75B0_6036_UN""","""CC(C1=C(C=CC(=C1)N)F)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""92F9A76FC9111CE7"""
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+"""B0CB538D7D3BD0C4_FD365DA6389D20B3_2267_UN""","""CN(CC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O)C2CC2""",21,"""940F04E62ED5F6F9"""
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+"""BDDFA0C284B0DE26_829E7ADBA927E42E_2267_UN""","""CN(CC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""E374F6F92DD4075E_8DB32A0E878D67C2_2267_UN""","""CN(CC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""F3ECFE63BDA7919A_EB4F14C526980AA4_2267_UN""","""CN(CC#CC1=C(C(NCC(O)=O)=O)C=CC=C1)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""626EB915C8587C11_419BA482A85B100B_2267_UN""","""CN(CC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""D1CECD59E6609EDC_A11FF78FE0B948D5_2267_UN""","""CN(CC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2)C3CC3""",21,"""940F04E62ED5F6F9"""
+"""5BA021F0C0377B9B_C43438790B2ACEDC_2267_UN""","""CN(CC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""7161FB2197772223_061E0CC7E0BA048E_2267_UN""","""CN(CC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2)C3CC3""",21,"""940F04E62ED5F6F9"""
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+"""1A5A203732BF2EA7_5347D48F5E7CA332_2267_UN""","""CN(CC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N)C2CC2""",21,"""940F04E62ED5F6F9"""
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+"""F2FAA97BBABE7FC6_25E9BF3E41AD5A0D_2267_UN""","""CN(CC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12)C3CC3""",21,"""940F04E62ED5F6F9"""
+"""40BB364E747118A7_0EE6122ABED3102E_2267_UN""","""CN(CC#CC1=C(C)C=C(C(=C1)C)C2OCCO2)C3CC3""",21,"""940F04E62ED5F6F9"""
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+"""70112AD24BF7C87C_18D67835F0C345F5_2267_UN""","""CN(CC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2)C3CC3""",21,"""940F04E62ED5F6F9"""
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+"""985D215DA472BDBE_E8411D8DB043F32E_2267_UN""","""CN(CC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12)C3CC3""",21,"""940F04E62ED5F6F9"""
+"""243CE504FC1B9B02_5E53898BB4A49C82_2267_UN""","""CN(CC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""DBDC489B66715019_5B5E10F0DC53FB17_2267_UN""","""CN(CC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2)C3CC3""",21,"""940F04E62ED5F6F9"""
+"""3935D21FF3127D19_A29BD8B86E8B553D_2267_UN""","""CN(CC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3)C4CC4""",21,"""940F04E62ED5F6F9"""
+"""6D04332F0B74F160_8641DC6238255EB5_2267_UN""","""CN(CC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2)C3CC3""",21,"""940F04E62ED5F6F9"""
+"""27CAED3053C918B1_F1296170FFF034C2_2267_UN""","""CN(CC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""05F488A82E60D8A0_27628552372FEDF3_2267_UN""","""CN(CC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""0D6D7D614D71620D_03FD7ABA0FD13748_2267_UN""","""CN(CC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""6E8924174A6488BB_8CED8D26CE5D56C1_2267_UN""","""CN(CC#CC1=CC(=CC=C1)CC2=CC=CC=C2)C3CC3""",21,"""940F04E62ED5F6F9"""
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+"""5215FB9ACA681564_19DC9AF57E727758_2267_UN""","""CN(CC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""FD44750A4DE21A21_D66E8E0369EA9AE9_2267_UN""","""CN(CC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2)C3CC3""",21,"""940F04E62ED5F6F9"""
+"""C5BEACDCCFD490C3_924479A6FEC44E3F_2267_UN""","""CN(CC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O)C3CC3""",21,"""940F04E62ED5F6F9"""
+"""4AA05B375434F17E_E9E2F7FB16B46B6F_2267_UN""","""CN(CC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2)C3CC3""",21,"""940F04E62ED5F6F9"""
+"""D54484F9596E7DCA_DB444F636D5B4335_2267_UN""","""CN(CC#CC1=CC=C(CCCCC(O)=O)C=C1)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""9CB1E4BD7A30B15F_EE6747A45B2E383A_2267_UN""","""CN(CC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3)C4CC4""",21,"""940F04E62ED5F6F9"""
+"""CFF263BE93C04DD1_B6D58DFE9B72CD2F_2267_UN""","""CN(CC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O)C2CC2""",21,"""940F04E62ED5F6F9"""
+"""FF51186E9D71C763_EEB3FA90852034B6_2267_UN""","""CN(CC#CC2=NC1=C(OC)C=CC(=C1S2)OC)C3CC3""",21,"""940F04E62ED5F6F9"""
+"""857A5CD02814B9B9_7FEE045608ABAD6B_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](CC)(=O)=O)CC(=O)OC""",21,"""943A4C9E71B933E4"""
+"""847C98BA2CEA8572_5CB3B1F2B76845F6_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""943A4C9E71B933E4"""
+"""11122442B68186E7_76C49E8B65E35850_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""943A4C9E71B933E4"""
+"""548FB796265251C1_24718962A97BEDCF_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""943A4C9E71B933E4"""
+"""3BC60882BF5C353F_453A5AC119608E35_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2CCCNC2""",21,"""943A4C9E71B933E4"""
+"""701AF9DE1157FE0C_733866EB2B01C287_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)CC2CCCN2""",21,"""943A4C9E71B933E4"""
+"""5EF55E2B6859911D_57E7255680BAB291_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""943A4C9E71B933E4"""
+"""53921B7A3E097092_98C31042C1E77B31_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2CCCNC2""",21,"""943A4C9E71B933E4"""
+"""B287BFDC5266A1F4_4D8417DB3261C67B_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""943A4C9E71B933E4"""
+"""74065EF8CD8A1B5F_F5C2237EA4B1BB00_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(CC)[S](=O)(=O)C2CCNC2""",21,"""943A4C9E71B933E4"""
+"""02A00E3C492DAC5E_3061AD44187194F9_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""943A4C9E71B933E4"""
+"""6CF9D47E5F0A35B1_953A38205A94930E_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""943A4C9E71B933E4"""
+"""3462A8DCA7DAF73F_9BAB4F6A63F2E081_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""943A4C9E71B933E4"""
+"""F34A8DCB24AA8378_7532225BD4CD4681_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C)(=O)=O)CCNC2CC2""",21,"""943A4C9E71B933E4"""
+"""70D38CAF33B13400_CAAE67241DD9C529_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""943A4C9E71B933E4"""
+"""54A460BBCD10B289_7D2097575FA52320_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2CCNCC2""",21,"""943A4C9E71B933E4"""
+"""2AD8D2DFD61A4ADC_D3B2F41785B22C8F_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""943A4C9E71B933E4"""
+"""8FCEA16B0FE5D331_CB9625FBB777E038_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""943A4C9E71B933E4"""
+"""BFAEC5CF7D7BD499_2BDA6CADEAD56354_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""943A4C9E71B933E4"""
+"""9894888E49F6BA63_67B4D1AED6D33F70_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2CCNCC2""",21,"""943A4C9E71B933E4"""
+"""6A939786CCDEB8BA_18AF04EF49F7F21E_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""943A4C9E71B933E4"""
+"""D7C6338AC23B3AE2_C8D057ED13D8DAF8_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""943A4C9E71B933E4"""
+"""0A1AC111EF2A64C4_1AE184BF7B747AF0_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""943A4C9E71B933E4"""
+"""7A35DBAACAFE5B10_A1B05D2473E355B4_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""943A4C9E71B933E4"""
+"""7DE14D241FE32DD2_531106373BF88B8E_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""943A4C9E71B933E4"""
+"""03E03982F7F1D2C0_730512BE3B38CBB2_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C)(=O)=O)CC2CNCC2""",21,"""943A4C9E71B933E4"""
+"""69E1DE223C5F7A8F_4F79A9A86CCD6404_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""943A4C9E71B933E4"""
+"""77B58FF19BA7725F_4631B43111CB157B_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""943A4C9E71B933E4"""
+"""4D1B018FDA86CCB1_E4046DE96C1CBDF0_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""943A4C9E71B933E4"""
+"""791F10D42AA19E7B_F510BECA7F698EC4_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""943A4C9E71B933E4"""
+"""3F3D4DD002957C3E_00A680E685F260FF_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(CCCN)[S](=O)(=O)C2CC2""",21,"""943A4C9E71B933E4"""
+"""76E9CFC9C86A2760_3CA2B4FFCDE57691_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2CCCC(CC=C)[S]2(=O)=O""",21,"""943A4C9E71B933E4"""
+"""C0ABCE3CE6CEBFF5_D5D48ED8DCCBBCCE_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(CCCN)[S](=O)(=O)C(F)F""",21,"""943A4C9E71B933E4"""
+"""A5C6741DEC724D92_26D4243546D4531A_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""943A4C9E71B933E4"""
+"""609A72C4DE629A79_2FBA34D6BFC1CCA5_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2CCCCNCC[S]2(=O)=O""",21,"""943A4C9E71B933E4"""
+"""48758806ECA0D0A6_5BE2F375BCE8100D_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""943A4C9E71B933E4"""
+"""041015998E32D018_B43903616A84DF7B_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""943A4C9E71B933E4"""
+"""2E3A6E9B0A903AF4_13C72C29A923CC61_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""943A4C9E71B933E4"""
+"""FBCA129F0E6E8DD8_2B80DD787192DE6E_6036_UN""","""C(COC1=CC(=CC=C1)Br)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""943A4C9E71B933E4"""
+"""1376AA4EC0BF6E4B_81DEDF72A84FB3C8_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""943A4C9E71B933E4"""
+"""620906C7D60FC31C_257C59AAF6235AB3_6036_UN""","""C(COC1=CC(=CC=C1)Br)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""943A4C9E71B933E4"""
+"""C78E7F416D0CFDF0_353087D6AF249156_6036_UN""","""C(COC1=CC(=CC=C1)Br)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""943A4C9E71B933E4"""
+"""07C77F575461F356_262A5DE1348704D1_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC(C(OC)=O)N""",21,"""946215F6D6B7D6D8"""
+"""09368C3715836B8D_5832521602A226CB_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC3CCNCC3""",21,"""946215F6D6B7D6D8"""
+"""83CEDDE06CE3E9FC_B4A1283E03E95CC5_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC3CCCNC3""",21,"""946215F6D6B7D6D8"""
+"""E8C6FCC82C9EF3AA_297BD7B16CE259D2_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC3NCCNC3""",21,"""946215F6D6B7D6D8"""
+"""29915973E69C2625_CD27650CD4B620CC_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC(CC=CC)N""",21,"""946215F6D6B7D6D8"""
+"""44EFD92C85A88284_8F4D47CF6CE67F56_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC(CC(C)C)N""",21,"""946215F6D6B7D6D8"""
+"""2B5A0838059306EE_4F9BEE9B88A3CA27_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC3(N)CCCC3""",21,"""946215F6D6B7D6D8"""
+"""9A32037C807C9906_CC226086EAD03E96_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)C[C@@H]3CCCNC3""",21,"""946215F6D6B7D6D8"""
+"""40CE601B873DE11A_A6A55B53FBD94E28_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)C[C@@H]3CCCCN3""",21,"""946215F6D6B7D6D8"""
+"""7518D9F9B856DB5C_E5441653D0B5D4CB_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC3OCCNC3""",21,"""946215F6D6B7D6D8"""
+"""C6F5584A6E4376D8_2421691C49566C1E_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CCC3(CNC3)N""",21,"""946215F6D6B7D6D8"""
+"""EA4C788190804101_6627AA2EF8975EE7_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC(N)CC(F)F""",21,"""946215F6D6B7D6D8"""
+"""A7180F0BF4ADD567_046CC99F78DAA58E_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)C[C@@H](C(OC)=O)N""",21,"""946215F6D6B7D6D8"""
+"""1518BC03B33F659B_E20322CE4A914D5D_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC3COCCN3""",21,"""946215F6D6B7D6D8"""
+"""D4D46FFBF5F978F1_589D3A9B095DE7B1_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC(CCN)(C)C""",21,"""946215F6D6B7D6D8"""
+"""CE61C809B1852A3B_D39E8D376D4C1433_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC3(CCNC3)C""",21,"""946215F6D6B7D6D8"""
+"""1B46B09D561CEDDF_63676785ACC39E9F_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC34CC(N)(C3)C4""",21,"""946215F6D6B7D6D8"""
+"""8138024BBC70A4D1_2E39AF61DCDDECE0_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CCCNC3CC3""",21,"""946215F6D6B7D6D8"""
+"""B9CBF02CD44400F6_0C8F5B298226507D_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC(=C3CNC3)F""",21,"""946215F6D6B7D6D8"""
+"""AFF2B25E3E3C3FB2_5F5FBBF55DC2F4F2_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)CC[C@H]3CCCN3""",21,"""946215F6D6B7D6D8"""
+"""8E0F128FFF55076D_5C02DD346E8BFDD8_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)C[C@H]3CC[C@@H](N)C3""",21,"""946215F6D6B7D6D8"""
+"""55E54875FD8012D3_01F45F0B40514E44_6031_DP""","""O(C(=O)C1(CCNCC1)[N]2C=CC=N2)C[C@H]3COC[C@H]3N""",21,"""946215F6D6B7D6D8"""
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+"""0B1171807B6158CD_C99F1079A83D6C8A_2267_UN""","""CN1C(CCC1)C#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""9868B408C71DD3A1"""
+"""588944482CBF8DBA_15BB2A1B97BA5200_2267_UN""","""CN1C(CCC1)C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""9868B408C71DD3A1"""
+"""7DE1EA6F8791632B_DA093EED8022BFB1_2267_UN""","""CN1C(CCC1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""9868B408C71DD3A1"""
+"""B4F5E20FFB385D43_9E23C948170C6B67_2267_UN""","""CN1C(CCC1)C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""9868B408C71DD3A1"""
+"""3CA186F2DBCC174A_E5854715FF7C4E37_2267_UN""","""CN1C(CCC1)C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""9868B408C71DD3A1"""
+"""E602D733B5E3CA1E_D723FF8D8493666D_2267_UN""","""CN1C(CCC1)C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""9868B408C71DD3A1"""
+"""2B7CA25ADF76E276_E200F74AB2E61D62_2267_UN""","""CN1C(CCC1)C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""9868B408C71DD3A1"""
+"""ADE428D8784A1899_BAB23D1072BAE877_2267_UN""","""CN1C(CCC1)C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""9868B408C71DD3A1"""
+"""4CCB5C47439CD704_E2D44A7E6CE811EE_2267_UN""","""CN1C(CCC1)C#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""9868B408C71DD3A1"""
+"""4E4F2A3DCA425B01_FDC8B04833F4BB62_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""987C4483061E6BF6"""
+"""B5DDEC4495F47E6E_D0C917DE14028E5E_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=C(C(C)C)C=C2""",21,"""987C4483061E6BF6"""
+"""9D92B480C557A55B_724AD0EFC41BA59B_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC3=C(C=C2)CCC3""",21,"""987C4483061E6BF6"""
+"""270710629C5E6544_D2989023DB73DF39_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=CC(=C2)C#CC""",21,"""987C4483061E6BF6"""
+"""57557EABB84F6EC1_D29C1451CA1BF4A6_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=CC(=C2)CSC""",21,"""987C4483061E6BF6"""
+"""5114044DBFC867B7_5272A47F680CD8A3_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""987C4483061E6BF6"""
+"""EB4DEF42EA2AC319_0A29A653CE942A89_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CSC=C2C(F)(F)F""",21,"""987C4483061E6BF6"""
+"""C67ABA348E3C1B4E_232243397E1B2F08_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC(=CC=C2)C(=O)O""",21,"""987C4483061E6BF6"""
+"""5A0F0E071085AF2A_C12EB6384B2A608B_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""987C4483061E6BF6"""
+"""9B3E1BC9BBA4739D_02CE0368EA73119C_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=C(C=C(C)C=C2F)F""",21,"""987C4483061E6BF6"""
+"""16D736170CCBDC33_B6757D605D2830C7_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=CC3=NON=C23""",21,"""987C4483061E6BF6"""
+"""D368EA30C3331610_F10F2338302263BF_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=C(C(=C(C)C=C2)F)F""",21,"""987C4483061E6BF6"""
+"""490FF7D25FA704EC_B0C468F93ABF4E3B_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C3=C[N]2C=NN=C2C=C3""",21,"""987C4483061E6BF6"""
+"""2DFD422F6D5654A2_5EF28B31B8819D97_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC(=C(C=C2)F)OC""",21,"""987C4483061E6BF6"""
+"""F05C30B52A6946CA_482FC8807F1402EB_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=C(C=C(C)C=C2C)C""",21,"""987C4483061E6BF6"""
+"""E9BF5D564A6A8C45_3DE497CF38C06467_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=C(OC)C=CC=C2F""",21,"""987C4483061E6BF6"""
+"""4093F2BA39CBC70D_EDB737CC361E534B_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=C(C(N)=O)C=C2""",21,"""987C4483061E6BF6"""
+"""FAF8DE335312460B_37C81EF08C09B6FE_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC(=C(OC)C=C2)F""",21,"""987C4483061E6BF6"""
+"""4888ED753B28645D_6F601D35DC645A22_6006_DP""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C3=C2[N](CCNC2)N=C3""",21,"""987C4483061E6BF6"""
+"""C67ABA348E3C1B4E_63317F6D27C20F39_6006_DP""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=CC(=C2)C(O)=O""",21,"""987C4483061E6BF6"""
+"""EB555F8D2BAB5205_4A9A155BD5B01F42_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=CC(=C2F)OC""",21,"""987C4483061E6BF6"""
+"""87B1E4667F4DA3F9_FD0562251D41DD2A_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=C(C=CC(=C2)OC)C""",21,"""987C4483061E6BF6"""
+"""2EFB63FFB9EE51E7_EC5DCEC27C05AC27_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C3=C2OC=CC2=CC=C3""",21,"""987C4483061E6BF6"""
+"""113BFE91054CA762_55ACCA677D7B9811_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=C(OC)C=C(C=C2)F""",21,"""987C4483061E6BF6"""
+"""E780D30DDD90C5AC_55F1D62F23C00ED8_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC(=C(OC)C=C2)C""",21,"""987C4483061E6BF6"""
+"""BDFD16C18978729B_45B6B96794CC6147_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=C(C(C)O)C=C2""",21,"""987C4483061E6BF6"""
+"""1F2D7A3A4E68767C_4D9205D8ABE82666_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=COC(=C2)C(F)(F)F""",21,"""987C4483061E6BF6"""
+"""08D559BB1C7B3E44_5367435D147A7195_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC(=CS2)C(F)(F)F""",21,"""987C4483061E6BF6"""
+"""1D301110E5188965_D0F64199959B478E_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CN=C(N(C)C)N=C2""",21,"""987C4483061E6BF6"""
+"""1271A14ADBC0E1B3_0577A80DA3809F4D_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C3=CC2=C(C=CC=N2)S3""",21,"""987C4483061E6BF6"""
+"""1F6EBD7D25EC004C_B20228B2ABF39935_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=C(C(=CC=C2O)F)F""",21,"""987C4483061E6BF6"""
+"""F56D057F5ED8E48D_55411238FAB59A2F_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CSC3=C2C=CC=C3""",21,"""987C4483061E6BF6"""
+"""AB2266969BA9CA23_2A47AE8D3D82E8B8_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=C[N]3N=CC=C23""",21,"""987C4483061E6BF6"""
+"""22FC65DAE7473353_93ED870CBCC4030F_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CN=C(C=C2)C(F)F""",21,"""987C4483061E6BF6"""
+"""9E7BEDF0E15513BD_F8F65B079EA3F383_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC3=C(C=C2)CCO3""",21,"""987C4483061E6BF6"""
+"""C04965994417867E_AE3521F3AAD9A000_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""987C4483061E6BF6"""
+"""3E4F3DCCB3FFCAEA_55FB255665FA159B_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""987C4483061E6BF6"""
+"""FF2CCFBD22EFE154_F14F46D6142347D9_6006_UN""","""C[Si](C)(C)C#CC1=CC(=NC=C1)C2=CC=C(S2)C(F)(F)F""",21,"""987C4483061E6BF6"""
+"""BCFF285A542DB84C_1568E68C5F1E4DB5_6014_UN""","""C(#CC1=CC(=NC=C1)Cl)C(CNCC2=CC=C(Cl)C=C2)=C""",21,"""987C4483061E6BF6"""
+"""8FBED17433DFF3BB_2572CF46D356660F_6014_UN""","""C(#CC1=CC(=NC=C1)Cl)C=CC2=CC=CC(=C2)C(F)(F)F""",21,"""987C4483061E6BF6"""
+"""C39386B092BB989F_9A68C6F85573B90D_6014_UN""","""C(#CC1=CC(=NC=C1)Cl)C2=CC(N(CC(OC)=O)C=C2)=O""",21,"""987C4483061E6BF6"""
+"""6656A4872662078E_ADC7DA38F67A9B33_6014_UN""","""C(#CC1=CC(=NC=C1)Cl)C3=CC=C2C(=O)OCCN2C3=O""",21,"""987C4483061E6BF6"""
+"""5FE8CE0442CF6105_7398CFA85B12DA0A_7019_UN""","""C(CC1=CN=CC=C1)=CC2=CSC(=N2)C3=CC=C(Cl)C=C3""",21,"""9A8516C131B66973"""
+"""4F05C6B63086272D_4B6D75D91E46423A_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC2=CC=CC(=C2N=C3Cl)C""",21,"""9A8516C131B66973"""
+"""4F25994D715036EC_2C7580C5A0D038D9_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC2=C(C=C(C)C=C2)N=C3Cl""",21,"""9A8516C131B66973"""
+"""31FA46F3098AB8B7_4FDA8CAC0B6C144D_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC=C(C2=CC=C(Cl)C=C2)O3""",21,"""9A8516C131B66973"""
+"""4134C34DCA3EF41E_57D24068BF3DFDC1_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC(=C2OCCCOC2=C3)Cl""",21,"""9A8516C131B66973"""
+"""01D37051C9AF5ED2_805EA8A40CF946A4_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(Cl)N=C(S2)N3CCCCC3""",21,"""9A8516C131B66973"""
+"""C31DA6BFC73E6FF3_E613022425A59C14_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC2=C(C=CC(=C2)C)N=C3Cl""",21,"""9A8516C131B66973"""
+"""F74D0CFCDCE38945_9354013341573F80_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC=C(C2=CC=C(Cl)C=C2)S3""",21,"""9A8516C131B66973"""
+"""E035F873DF3FA991_4DC41D9946DE074C_7019_UN""","""C(CC1=CN=CC=C1)=CC3=C[N](C2=CC=C(Cl)C=C2)N=C3""",21,"""9A8516C131B66973"""
+"""622D6A5EECB4EA93_54E991E2599BBCB2_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC2=C(C(=CC(=C2)Cl)Cl)OC3""",21,"""9A8516C131B66973"""
+"""7FE57843E3AF4BFA_A4FD53BA7BB0A204_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC=C(C2=CC=CC(=C2)Cl)S3""",21,"""9A8516C131B66973"""
+"""7FCD3B929EBD6A93_AE9BA5354B0399C3_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(OC(F)F)C(=CC(=C2)Cl)Cl""",21,"""9A8516C131B66973"""
+"""98D4B94EC9696CD7_B00285502EEE0215_7019_UN""","""C(CC1=CN=CC=C1)=CC2=CC(=C(OCC)C(=C2)Cl)OC""",21,"""9A8516C131B66973"""
+"""4A23B9BE15CDE600_232194BCECBCB9A6_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC2=C([N](N=C2C)C)N=C3Cl""",21,"""9A8516C131B66973"""
+"""DEFD3EAD7FBD8F0F_C592EDCC1E8A1DC8_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C[NH]N=C2C3=CC=CC(=C3)Cl""",21,"""9A8516C131B66973"""
+"""805C982316FCEE54_0AACCC5798DFF3CE_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(Cl)C=CC=C2N3CCCC3""",21,"""9A8516C131B66973"""
+"""6EDCD909E7885CD9_188E41ADBF0BC73F_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC(=C2C=CC=CC2=C3O)Cl""",21,"""9A8516C131B66973"""
+"""7D20975404FE5558_1DCE2A7CB317EC71_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C([S](CC)(=O)=O)C(=CC=C2)Cl""",21,"""9A8516C131B66973"""
+"""998FD15C4F8E3B1C_8AC0F1A9ECD7BF59_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(C=CC(=C2)Cl)OCC3CC3""",21,"""9A8516C131B66973"""
+"""79F45AA85E33FFB0_1EF8A8CAE561756C_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C[NH]N=C2C3=CC=C(Cl)C=C3""",21,"""9A8516C131B66973"""
+"""15A4C3E088B182DA_FCA0525588575D65_7019_UN""","""C(CC1=CN=CC=C1)=CC2=CC(=C(C(=C2)Cl)OC)OCC""",21,"""9A8516C131B66973"""
+"""D6A06665E6F5E409_54EFA8542D92D67A_7019_UN""","""C(CC1=CN=CC=C1)=CC3=N[N](C2=CC=C(Cl)C=C2)N=C3""",21,"""9A8516C131B66973"""
+"""52BA23C632083C93_6D5D632E6D556139_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CN=C(C2=CC=CC(=C2)Cl)S3""",21,"""9A8516C131B66973"""
+"""6F764B4257E7546F_851681D65A8C189B_7019_UN""","""C(CC1=CN=CC=C1)=CC2=CC(=C(OC(C)C)C=C2Cl)Cl""",21,"""9A8516C131B66973"""
+"""D71CE5A55C739540_6DA7F0696653B94D_7019_DP""","""C(CC1=CN=CC=C1)=CC3=C(N=C(N2CCNCC2)S3)Cl""",21,"""9A8516C131B66973"""
+"""AE9984A0C3150844_40B6991AB27A3E0E_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC2=C(C=CC(=C2)F)N=C3Cl""",21,"""9A8516C131B66973"""
+"""AB5EEB7E5A9F9A45_87F242E304611F27_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC2=C(C=C(F)C=C2)N=C3Cl""",21,"""9A8516C131B66973"""
+"""68403DACC1255F64_9564FAB8BDB73CB2_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC=C(C2=C(Cl)C=CC=C2)S3""",21,"""9A8516C131B66973"""
+"""2F7C042967C2C7AE_EEED66D5DFF972DB_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(Cl)N=C(S2)N3CCOCC3""",21,"""9A8516C131B66973"""
+"""4BE81FE7380DF38F_960D3FE3518A4672_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C[NH]C3=CC(=C(OC)C=C23)Cl""",21,"""9A8516C131B66973"""
+"""5F127ED9380981DA_E65E6822C965F399_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(Cl)[N](N=C2)C3=CC=CC=C3""",21,"""9A8516C131B66973"""
+"""8F36DFEBEA59FBD3_205166CA2BE71948_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(Cl)[NH]C3=C2C=C(C(=C3)Cl)Cl""",21,"""9A8516C131B66973"""
+"""E92BCED563E151AD_7DFB0B9B58BC795A_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(C=C(Cl)C=C2)[N]3C=NC=N3""",21,"""9A8516C131B66973"""
+"""16D65B9F635A27D0_C9AD7506C4C031E2_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC=C(C2=C(Cl)C=CC=C2)O3""",21,"""9A8516C131B66973"""
+"""92807E3393A52427_F5876B71F9136E5B_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CN=C(C2=CC=C(Cl)C=C2)S3""",21,"""9A8516C131B66973"""
+"""AAE5A779418D8E64_69A9568B5648BED6_7019_UN""","""C(CC1=CN=CC=C1)=CC3=C[N](C2=CC=CC(=C2)Cl)N=C3""",21,"""9A8516C131B66973"""
+"""F7A460D2DBAA2E81_91EAB51F3E61DB68_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(C(=C(F)C=C2)C(F)(F)F)Cl""",21,"""9A8516C131B66973"""
+"""94A311D9C97400C7_7768B5EED63025D3_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(C=C(OC)C=C2CCl)OC""",21,"""9A8516C131B66973"""
+"""5CE0CB5BC7087285_F5AE19890091499C_7019_UN""","""C(CC1=CN=CC=C1)=CC2=CC(=C(OC(F)(F)F)C=C2)Cl""",21,"""9A8516C131B66973"""
+"""E3DD4661E5678CD8_A28F3DF238E73A82_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(Cl)C=CC=C2[N]3C=CN=C3""",21,"""9A8516C131B66973"""
+"""E9E288F15579DD43_8AF7BB88D0F30B5D_7019_UN""","""C(CC1=CN=CC=C1)=CC3=CC(=C2OCOCC2=C3)CCl""",21,"""9A8516C131B66973"""
+"""8583073E7381DDC1_42CF38BA62EF9653_7019_UN""","""C(CC1=CN=CC=C1)=CC2=C(Cl)C=CC=C2[N]3C=CC=N3""",21,"""9A8516C131B66973"""
+"""F67379B4F16416A2_711B169D54866E49_6036_UN""","""NCCN1CC(CC1)CCN([S](CC)(=O)=O)CC(=O)OC""",21,"""9ACF5E552D94F0C6"""
+"""9D3F6854CC270AC7_5246A339EB4586D4_6036_UN""","""NCCN1CC(CC1)CCN([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""9ACF5E552D94F0C6"""
+"""618ABD7366A2D6B2_78318C4039CE9B72_6036_UN""","""NCCN1CC(CC1)CCN(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""9ACF5E552D94F0C6"""
+"""A1D974269F0A41EB_2A849BA9F5562EED_6036_UN""","""NCCN1CC(CC1)CCN2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""9ACF5E552D94F0C6"""
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+"""F981DC67D249CCC8_E67653196596DD56_2267_UN""","""OC(=O)CSCC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""9C1E105B106D1395"""
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+"""F98177E1D754B5A4_6B6B509F7C28A71D_2267_UN""","""NC1CC(CC1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""9C81808985972604"""
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+"""204167CDF8F4C891_A99173E04BFB9828_2267_UN""","""NC1CC(CC1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""9C81808985972604"""
+"""09CC2B15BD455D39_CCBABC16A0681E21_2267_UN""","""NC1CC(CC1)C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""9C81808985972604"""
+"""E2581BF2A9C7E5B5_0E9088A84BF8D473_2267_UN""","""NC1CC(CC1)C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""9C81808985972604"""
+"""2CCEC1BE34BF6E5C_B05DB741EDF3C3FC_2267_UN""","""NC1CC(CC1)C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""9C81808985972604"""
+"""43699D951512AE06_98B6A609F7B6A8F1_2267_UN""","""NC1CC(CC1)C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""9C81808985972604"""
+"""52B069485CB082E3_5BC950E0F53E73CF_2267_UN""","""NC1CC(CC1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""9C81808985972604"""
+"""5132818047F32F88_8ED9725C6476ED9C_2267_UN""","""NC1CC(CC1)C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""9C81808985972604"""
+"""F1A00D1B035421CA_2D673B51EAEF8AF0_2267_UN""","""NC1CC(CC1)C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""9C81808985972604"""
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+"""0C398516EFE6440D_7BB4B182491500B5_6036_UN""","""CN1CCC(CC1)NCCN([S](C)(=O)=O)CC2CNCC2""",21,"""9C8BEFA20394F8E3"""
+"""7E078610BF509F1D_47C80A941EE0AF03_6036_UN""","""CN1CCC(CC1)NCCN([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""9C8BEFA20394F8E3"""
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+"""561C3F326366FD94_FDA11DF60D4445C3_6036_UN""","""CN1CCC(CC1)NCCN(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""9C8BEFA20394F8E3"""
+"""A9A3FDE5E6F60935_081723DAF7DFABF8_6036_UN""","""CN1CCC(CC1)NCCN(CCCN)[S](=O)(=O)C2CC2""",21,"""9C8BEFA20394F8E3"""
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+"""D16BC2347BFB86DE_2E65870934F9981D_6036_UN""","""CN1CCC(CC1)NCCN2[S](C3(CC2CI)CC3)(=O)=O""",21,"""9C8BEFA20394F8E3"""
+"""BD1B7DB7EB117ED8_270B97EACDEC07A2_6036_UN""","""CN1CCC(CC1)NCCN2CCCCNCC[S]2(=O)=O""",21,"""9C8BEFA20394F8E3"""
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+"""BD9179D000317760_BC88A05D18A9147C_6036_UN""","""CN1CCC(CC1)NCCN2C(CN)CC3([S]2(=O)=O)CC3""",21,"""9C8BEFA20394F8E3"""
+"""0E2F7948AE2BE2CE_1B768F15DB0E0766_6036_UN""","""CN1CCC(CC1)NCCN([S](=O)(=O)C2CC2)C3CNC3""",21,"""9C8BEFA20394F8E3"""
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+"""1C5181FAF25D4EB8_896F7C4EDA6278CF_6036_UN""","""CN1CCC(CC1)NCCN([S](=O)(=O)C2CNC2)C3CC3""",21,"""9C8BEFA20394F8E3"""
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+"""F7D54F270914E59B_E88403E2B1DB2104_7019_DP""","""OC1=CC(=CC=C1)C=CC2=C(Cl)N=C(S2)N3CCOCC3""",21,"""9CEC73F65F943AAC"""
+"""D76A9F21CA6D8EFE_90645AD43FA815AD_7019_DP""","""OC1=CC(=CC=C1)C=CC2=C[NH]C3=CC(=C(OC)C=C23)Cl""",21,"""9CEC73F65F943AAC"""
+"""9DB7FE62870C48F1_E0370D15A747A046_7019_DP""","""OC1=CC(=CC=C1)C=CC2=C(Cl)[N](N=C2)C3=CC=CC=C3""",21,"""9CEC73F65F943AAC"""
+"""70F52C79537A918F_263803FD45C54A97_7019_DP""","""OC1=CC(=CC=C1)C=CC2=C(Cl)[NH]C3=C2C=C(C(=C3)Cl)Cl""",21,"""9CEC73F65F943AAC"""
+"""B74F03EEF57194CA_7B926EAC369E2A85_7019_DP""","""OC1=CC(=CC=C1)C=CC2=C(C=C(Cl)C=C2)[N]3C=NC=N3""",21,"""9CEC73F65F943AAC"""
+"""EB79B0FDA79948AF_CFC41031AAE2623D_7019_DP""","""OC1=CC(=CC=C1)C=CC3=CC=C(C2=C(Cl)C=CC=C2)O3""",21,"""9CEC73F65F943AAC"""
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+"""CBC132C2183C58D7_DF02DF5F3E0154F1_2267_UN""","""C[N]1C=CC(=N1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""9D6355BA793E38E1"""
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+"""F44D39BDA14A7648_D2281E3F3AB08D2D_2267_UN""","""C[N]1C=CC(=N1)C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""9D6355BA793E38E1"""
+"""06B49F41CBBE55E9_E70B16F80CC5F622_2267_UN""","""C[N]1C=CC(=N1)C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""9D6355BA793E38E1"""
+"""653D4E8A69F777F0_BFB9DCA2CC990337_2267_UN""","""C[N]1C=CC(=N1)C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""9D6355BA793E38E1"""
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+"""A043F631E1A339CD_746A6D7A88BA7E7C_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=CSC(=N2)C3=CC=C(Cl)C=C3""",21,"""9D77B413E21ECD05"""
+"""DE6A97970D0B64AF_4C9FD70BCDEEE64C_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC2=CC=CC(=C2N=C3Cl)C""",21,"""9D77B413E21ECD05"""
+"""2A322BB6A786929D_2B87221773789CAF_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC2=C(C=C(C)C=C2)N=C3Cl""",21,"""9D77B413E21ECD05"""
+"""490366314BD63FDA_48282E7ED8C4B03B_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC=C(C2=CC=C(Cl)C=C2)O3""",21,"""9D77B413E21ECD05"""
+"""54A85FD1B16E0121_5020E2BA6C9559B7_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC(=C2OCCCOC2=C3)Cl""",21,"""9D77B413E21ECD05"""
+"""3D0B7C25AE2FA834_87AC0A76DF51E2D2_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(Cl)N=C(S2)N3CCCCC3""",21,"""9D77B413E21ECD05"""
+"""55FF7A96F88ABF50_E1E1A0F6F60D3862_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC2=C(C=CC(=C2)C)N=C3Cl""",21,"""9D77B413E21ECD05"""
+"""5D02CD2A3D87755B_94A6A3E192FF9BF6_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC=C(C2=CC=C(Cl)C=C2)S3""",21,"""9D77B413E21ECD05"""
+"""85E07EC14CB46934_4A36BF4B9576A33A_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=C[N](C2=CC=C(Cl)C=C2)N=C3""",21,"""9D77B413E21ECD05"""
+"""7453C9AB8087BD26_531B33308A3318C4_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC2=C(C(=CC(=C2)Cl)Cl)OC3""",21,"""9D77B413E21ECD05"""
+"""3E0970D30562CAB6_A30FF168A8180672_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC=C(C2=CC=CC(=C2)Cl)S3""",21,"""9D77B413E21ECD05"""
+"""5A8DA96F2CC087CF_A96907E798AB3DB5_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(OC(F)F)C(=CC(=C2)Cl)Cl""",21,"""9D77B413E21ECD05"""
+"""BFF03354867AC52D_B7F02782FD46A663_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=CC(=C(OCC)C(=C2)Cl)OC""",21,"""9D77B413E21ECD05"""
+"""5D159270CEAD6269_24D3366E3F141DD0_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC2=C([N](N=C2C)C)N=C3Cl""",21,"""9D77B413E21ECD05"""
+"""FE390D67B57329A3_C2604F1ECD22B9BE_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C[NH]N=C2C3=CC=CC(=C3)Cl""",21,"""9D77B413E21ECD05"""
+"""973FB6BE00A838F5_0D5E6E854B7757B8_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(Cl)C=CC=C2N3CCCC3""",21,"""9D77B413E21ECD05"""
+"""4ADB269DB1884340_1F7CE37F6CA36349_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC(=C2C=CC=CC2=C3O)Cl""",21,"""9D77B413E21ECD05"""
+"""EB30B6A8513ECFB3_1A3C88AE60BF4807_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C([S](CC)(=O)=O)C(=CC=C2)Cl""",21,"""9D77B413E21ECD05"""
+"""2F407B57DAC64D5E_8D32537B3F7F1B2F_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(C=CC(=C2)Cl)OCC3CC3""",21,"""9D77B413E21ECD05"""
+"""37AE0380C0F6DE3D_190A0A1836C9D11A_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C[NH]N=C2C3=CC=C(Cl)C=C3""",21,"""9D77B413E21ECD05"""
+"""19977DF0C55475E1_FB52F0875BFFF913_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=CC(=C(C(=C2)Cl)OC)OCC""",21,"""9D77B413E21ECD05"""
+"""7CC84B060D5D03F9_531D0A86FE3A720C_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=N[N](C2=CC=C(Cl)C=C2)N=C3""",21,"""9D77B413E21ECD05"""
+"""4EFBE141B7EAE642_6AAFC1FCBEFDC54F_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CN=C(C2=CC=CC(=C2)Cl)S3""",21,"""9D77B413E21ECD05"""
+"""25F10EFCF1BB9CD6_82E423048924BCED_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=CC(=C(OC(C)C)C=C2Cl)Cl""",21,"""9D77B413E21ECD05"""
+"""F12424735E5F2BFC_6A5552BBB5FB1D3B_7019_DP""","""C(CCC1=C[NH]N=C1)=CC3=C(N=C(N2CCNCC2)S3)Cl""",21,"""9D77B413E21ECD05"""
+"""ABF50C4FDDBEC1CF_47443BC861D29A78_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC2=C(C=CC(=C2)F)N=C3Cl""",21,"""9D77B413E21ECD05"""
+"""704A6307F35C485A_8000E031D7C9BB51_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC2=C(C=C(F)C=C2)N=C3Cl""",21,"""9D77B413E21ECD05"""
+"""C94172749E699357_9296586A6E1F98C4_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC=C(C2=C(Cl)C=CC=C2)S3""",21,"""9D77B413E21ECD05"""
+"""CDEB6D8365922DF2_E91FC4070C51D6AD_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(Cl)N=C(S2)N3CCOCC3""",21,"""9D77B413E21ECD05"""
+"""282E47DC1022571D_91FF9D318222E204_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C[NH]C3=CC(=C(OC)C=C23)Cl""",21,"""9D77B413E21ECD05"""
+"""0295ED0C1C477067_E1ACCAF01ACD57EF_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(Cl)[N](N=C2)C3=CC=CC=C3""",21,"""9D77B413E21ECD05"""
+"""2540F8AC92B3BADD_27A3C418F84FBD3E_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(Cl)[NH]C3=C2C=C(C(=C3)Cl)Cl""",21,"""9D77B413E21ECD05"""
+"""B31FB62C8DBCFD9C_7A09A9498B14DD2C_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(C=C(Cl)C=C2)[N]3C=NC=N3""",21,"""9D77B413E21ECD05"""
+"""07BEFFD93FE91D06_CE5FD7D417689594_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC=C(C2=C(Cl)C=CC=C2)O3""",21,"""9D77B413E21ECD05"""
+"""7E943D62F5C9C1BA_F275C9A32ABBCA2D_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CN=C(C2=CC=C(Cl)C=C2)S3""",21,"""9D77B413E21ECD05"""
+"""9019A04B5D801E61_6E5BF45985E01AA0_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=C[N](C2=CC=CC(=C2)Cl)N=C3""",21,"""9D77B413E21ECD05"""
+"""8863EDCA13F4396C_961817CDEDC97F1E_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(C(=C(F)C=C2)C(F)(F)F)Cl""",21,"""9D77B413E21ECD05"""
+"""13D3D9A02E04715B_709A173C059881A5_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(C=C(OC)C=C2CCl)OC""",21,"""9D77B413E21ECD05"""
+"""BAC4B50BA991F5A4_F25CBB5BD339EDEA_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=CC(=C(OC(F)(F)F)C=C2)Cl""",21,"""9D77B413E21ECD05"""
+"""264C839884CB7F48_A57D9F20EB4F9EF4_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(Cl)C=CC=C2[N]3C=CN=C3""",21,"""9D77B413E21ECD05"""
+"""F47C6C4EA8BFBACD_8D05195A035BAF2B_7019_UN""","""C(CCC1=C[NH]N=C1)=CC3=CC(=C2OCOCC2=C3)CCl""",21,"""9D77B413E21ECD05"""
+"""FC3B921FD828AA70_453D9A68B1473225_7019_UN""","""C(CCC1=C[NH]N=C1)=CC2=C(Cl)C=CC=C2[N]3C=CC=N3""",21,"""9D77B413E21ECD05"""
+"""3BE1946BE1F66B3C_69A9EAC7556379E7_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""9E433AD1ACDCF8FE"""
+"""08B565B20340EC0F_F77A6391BA942EB4_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""9E433AD1ACDCF8FE"""
+"""D3B4F4DC24F1DE00_138490D258A43311_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""9E433AD1ACDCF8FE"""
+"""203C3DF3A604A74D_74B2663CEB3AB09A_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""9E433AD1ACDCF8FE"""
+"""91E07505FCC89BD1_FF33CDCE6D28798B_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""9E433AD1ACDCF8FE"""
+"""F92C3E2ADCAE05B9_0FB8DF49DB6C91DE_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""9E433AD1ACDCF8FE"""
+"""B53B9F7F212329CB_CFB7DE9451BECD45_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""9E433AD1ACDCF8FE"""
+"""DB6478414C36D7F9_88D244EC2B2EEA29_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""9E433AD1ACDCF8FE"""
+"""6EEE4ACFE80E842A_87FF1439058469C5_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""9E433AD1ACDCF8FE"""
+"""AECEF5D169751749_E1032AF2A49104A3_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""9E433AD1ACDCF8FE"""
+"""F3F639598D029B0D_4BD79AB52A521E0C_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""9E433AD1ACDCF8FE"""
+"""BF240BBB33BCFD3E_AB53C9B862B046D2_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""9E433AD1ACDCF8FE"""
+"""B7ABC0457EECF4EE_CE78064E8923C0DB_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""9E433AD1ACDCF8FE"""
+"""DC2C9A3C2ACEFBCA_0C5232F062B30A89_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""9E433AD1ACDCF8FE"""
+"""2D0221AE11F3CD92_B29F0D19C4B81D06_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""9E433AD1ACDCF8FE"""
+"""B85D32D94D0348B6_9A741C51DEFD760B_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""9E433AD1ACDCF8FE"""
+"""5397E97D5A34A54F_590BEAB8DC75AD35_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""9E433AD1ACDCF8FE"""
+"""4A1778BA01878BA8_8C1BC8044D3D3366_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""9E433AD1ACDCF8FE"""
+"""5B3C419203484846_2FA58109C3A4540A_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""9E433AD1ACDCF8FE"""
+"""ABCD33B91F039613_04AA2C1D3CDA1E29_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""9E433AD1ACDCF8FE"""
+"""CDE04C6222727432_E8275D3E4CE237F4_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""9E433AD1ACDCF8FE"""
+"""799B659F47B00433_129A460272CA4BF2_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""9E433AD1ACDCF8FE"""
+"""39B89DA92EC8238A_B4F6D267500F8C36_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""9E433AD1ACDCF8FE"""
+"""BCF6514A22D8A2A1_3E9BE36857810762_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""9E433AD1ACDCF8FE"""
+"""AF098ADA316FDC2D_E20D23BA324AFD29_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""9E433AD1ACDCF8FE"""
+"""E0AF6B6F10ED8792_541FB7BC36AD9285_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""9E433AD1ACDCF8FE"""
+"""796F59B9D8F5005D_51122EC75E5AF510_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""9E433AD1ACDCF8FE"""
+"""3F175EE15E788BE7_A8D7E68FEC825B3A_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""9E433AD1ACDCF8FE"""
+"""634E8EC91191BB8F_8C0DE255BA2C50B2_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""9E433AD1ACDCF8FE"""
+"""7E7B3CD5254FD6F4_FB655F477DF93AC5_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""9E433AD1ACDCF8FE"""
+"""6C18FD619FB7DBAD_2D2EBB65B526E3F4_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""9E433AD1ACDCF8FE"""
+"""D5DAE57AE6CE5649_09B1448D8DD8394F_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""9E433AD1ACDCF8FE"""
+"""657E25AC7A47F983_86A1B3114C5458C6_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""9E433AD1ACDCF8FE"""
+"""993FF2E4438BE37B_CFB49EA0C3FC47D5_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""9E433AD1ACDCF8FE"""
+"""3EC6F12C1DABBE52_1390A4C2FC7B795F_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""9E433AD1ACDCF8FE"""
+"""21097F5494DC4A4B_DC22B034EBE394EE_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""9E433AD1ACDCF8FE"""
+"""F370CAFD984A689B_980847917CCD4038_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""9E433AD1ACDCF8FE"""
+"""99F1BA6D681831D7_E3AEC9CC94BD6568_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""9E433AD1ACDCF8FE"""
+"""2D7E5997B681681C_D1087154EF524D32_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""9E433AD1ACDCF8FE"""
+"""60DA383F3763A85C_E42B7993D927363D_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""9E433AD1ACDCF8FE"""
+"""A9436D7BA827C5BD_BC99B3C9197BC328_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""9E433AD1ACDCF8FE"""
+"""DE2045E67F55417E_E4FFC4A707293AB1_2267_UN""","""Cl[C@@H]1CCO[C@@H]1C#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""9E433AD1ACDCF8FE"""
+"""938481B82D74F8A5_2C315C307D700CB2_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)CC(C(OC)=O)N""",21,"""9E7914279F40DEBB"""
+"""861AC3F8755B9594_522953C74B552EA8_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)CC3CCNCC3""",21,"""9E7914279F40DEBB"""
+"""CB90985BB510F66B_BEBA29EF4A1E54A6_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)CC3CCCNC3""",21,"""9E7914279F40DEBB"""
+"""924A2FAA57D3D2AF_2360D660251551B1_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)CC3NCCNC3""",21,"""9E7914279F40DEBB"""
+"""A84E7DFE3C75174D_C73C64DD9D4128AF_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)CC(CC=CC)N""",21,"""9E7914279F40DEBB"""
+"""8D4A38F854AAF6DE_8556461E25117735_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)CC(CC(C)C)N""",21,"""9E7914279F40DEBB"""
+"""9B0FFCF5A66FEED3_4580EF4AC154C244_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)CC3(N)CCCC3""",21,"""9E7914279F40DEBB"""
+"""32E0198843548928_C6396157A32736F5_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)C[C@@H]3CCCNC3""",21,"""9E7914279F40DEBB"""
+"""1B30144DA05F2ABD_ACBE5A82B22E464B_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)C[C@@H]3CCCCN3""",21,"""9E7914279F40DEBB"""
+"""25CC2A87D43E9DCF_EF5F17829942DCA8_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)CC3OCCNC3""",21,"""9E7914279F40DEBB"""
+"""510F5C886BC2A849_2E3A68CD00A1647D_6031_DP""","""O(C(=O)C1=CN=C(S1)C2CCNCC2)CCC3(CNC3)N""",21,"""9E7914279F40DEBB"""
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+"""CF5E79D15A8B4DCD_6C6F0C3736EC1749_6036_UN""","""N[C@H](CN1[S](=O)(=O)C2(C1)CCOCC2)CC3=CC=CC=C3""",21,"""A3B7B3DCFBBD34A0"""
+"""8EE017AC5F042AA3_83B4FC23E080D83F_6036_UN""","""N[C@H](CN1C(CN)CC2([S]1(=O)=O)CC2)CC3=CC=CC=C3""",21,"""A3B7B3DCFBBD34A0"""
+"""FD5335F856DAD0C6_244AD36B2327CB25_6036_UN""","""N[C@H](CN([S](=O)(=O)C1CC1)C2CNC2)CC3=CC=CC=C3""",21,"""A3B7B3DCFBBD34A0"""
+"""1FF4E4A97AD9F32B_1C0D223AFB96D92A_6036_UN""","""N[C@H](CN1CC2(C[S]1(=O)=O)CCCC2)CC3=CC=CC=C3""",21,"""A3B7B3DCFBBD34A0"""
+"""49BCA28277A8C9E5_B6532030224BB48C_6036_UN""","""N[C@H](CN([S](=O)(=O)C1CNC1)C2CC2)CC3=CC=CC=C3""",21,"""A3B7B3DCFBBD34A0"""
+"""7B4B5C4AC72A858E_12F1A6E87C275DF7_6036_UN""","""N[C@H](CN([S](C)(=O)=O)CC[S](=O)(=O)Cl)CC1=CC=CC=C1""",21,"""A3B7B3DCFBBD34A0"""
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+"""4D27D40600758980_710410551002F6AE_6031_DP""","""O(C(=O)C2=C1CNCCC1=C(C=C2)F)CC3[C@@H]4CNC[C@H]34""",21,"""A6DE3EE6CBF3EC6C"""
+"""C6F1CC18694C0219_A9D08E4E4F0AC98C_6031_DP""","""O(C(=O)C2=C1CNCCC1=C(C=C2)F)CC3(CNC3)C#N""",21,"""A6DE3EE6CBF3EC6C"""
+"""E7447E597F6219FF_BCB80FD647614D9A_6031_DP""","""O(C(=O)C2=C1CNCCC1=C(C=C2)F)C[C@@H]3C[C@H](N)C=C3""",21,"""A6DE3EE6CBF3EC6C"""
+"""FA2DD774E7CA337B_F5B2AF3C9BBD63FE_6031_DP""","""O(C(=O)C2=C1CNCCC1=C(C=C2)F)C[C@H]3CCCNC3""",21,"""A6DE3EE6CBF3EC6C"""
+"""76E198FD72CD1498_5CCE2B465944CC44_6031_DP""","""O(C(=O)C2=C1CNCCC1=C(C=C2)F)CC3CC(NC)C3""",21,"""A6DE3EE6CBF3EC6C"""
+"""628BF52C9548C33D_0C71DBFCF52B9789_6031_DP""","""O(C(=O)C2=C1CNCCC1=C(C=C2)F)CCC3CCNC3""",21,"""A6DE3EE6CBF3EC6C"""
+"""347E7547285BB14C_E72A966401462FDB_6031_DP""","""O(C(=O)C2=C1CNCCC1=C(C=C2)F)C[C@@H]3OCCNC3""",21,"""A6DE3EE6CBF3EC6C"""
+"""A1765FAF3A2E4631_5FF5F9F9E1605645_2267_UN""","""OC1(CCCC1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""A81F29EF18DFD75C"""
+"""B97E7234EE1539EC_C12670AF0E970116_2267_UN""","""OC1(CCCC1)C#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""A81F29EF18DFD75C"""
+"""513F69DFF89D3361_25D883ECECA71CB3_2267_UN""","""OC1(CCCC1)C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""A81F29EF18DFD75C"""
+"""C5064D55DE082CB7_42EE75025F399F38_2267_UN""","""OC1(CCCC1)C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""A81F29EF18DFD75C"""
+"""2D0083D08148984E_C96FDEF0D92B5629_2267_UN""","""OC1(CCCC1)C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""A81F29EF18DFD75C"""
+"""EA28F7EDE8483943_39E4CC776F6FBE7C_2267_UN""","""OC1(CCCC1)C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""A81F29EF18DFD75C"""
+"""E908380126C75BBB_F9EBCDAAE5BDE2E7_2267_UN""","""OC1(CCCC1)C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""A81F29EF18DFD75C"""
+"""3169C030088A899C_BE8E57D29F2DC58B_2267_UN""","""OC1(CCCC1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""A81F29EF18DFD75C"""
+"""27727B8D1D7C13E5_B1A30707B1874667_2267_UN""","""OC1(CCCC1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""A81F29EF18DFD75C"""
+"""7023CE018D59390E_D75F39CC10922B01_2267_UN""","""OC1(CCCC1)C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""A81F29EF18DFD75C"""
+"""B21E4D1F8BB1F648_7D8B898B9E5131AE_2267_UN""","""OC1(CCCC1)C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""A81F29EF18DFD75C"""
+"""90A13340A8815679_9D0FDA86D6B36970_2267_UN""","""OC1(CCCC1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""A81F29EF18DFD75C"""
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+"""5ABDCD2691C8575D_1C1AFF50F88A00D2_6036_UN""","""NC1C(N(CCC1)CCN2[S](C3(CC2CI)CC3)(=O)=O)=O""",21,"""AEF497FBCFE7602C"""
+"""66529346E39D8FA7_1574EFB3019F9F6D_6036_UN""","""NC1C(N(CCC1)CCN2CCCCNCC[S]2(=O)=O)=O""",21,"""AEF497FBCFE7602C"""
+"""7FE5CA3FAB84415E_612C281002B643C5_6036_UN""","""NC1C(N(CCC1)CCN2[S](=O)(=O)C3(C2)CCOCC3)=O""",21,"""AEF497FBCFE7602C"""
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+"""A609AAE8DF6FA1DD_BB1004171611E000_6036_UN""","""NC1C(N(CCC1)CCN([S](=O)(=O)C2CNC2)C3CC3)=O""",21,"""AEF497FBCFE7602C"""
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+"""91B49FC285F52DF4_0FFE5CB3117AC29E_6036_UN""","""NC1C(N(CCC1)CCN(CCC)[S](=O)(=O)C(F)(F)F)=O""",21,"""AEF497FBCFE7602C"""
+"""0978BC2A12A1A24B_5917812724D11712_2267_UN""","""CC(C)(C)C(N)C#CC1=CC=C(C(CCC(O)=O)=O)C=C1""",21,"""AEFD5131DD6E960B"""
+"""0B88591D8E7C4120_C7C40871CB264041_2267_UN""","""CC(C)(C)C(N)C#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O""",21,"""AEFD5131DD6E960B"""
+"""DD551DBF2F9E879D_233AFB3229165DE4_2267_UN""","""CC(C)(C)C(N)C#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""AEFD5131DD6E960B"""
+"""C791A62BFAD3AF6E_440C0DDC9A88DE6F_2267_UN""","""CC(C)(C)C(N)C#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""AEFD5131DD6E960B"""
+"""50E8BB7DECD2216E_CF8DA62E1C9A177E_2267_UN""","""CC(C)(C)C(N)C#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""AEFD5131DD6E960B"""
+"""FD57910A6A1A684A_3F06B4A9AADEFF2B_2267_UN""","""CC(C)(C)C(N)C#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""AEFD5131DD6E960B"""
+"""A4158F1FF23307EA_FF09B574200CA3B0_2267_UN""","""CC(C)(C)C(N)C#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""AEFD5131DD6E960B"""
+"""281043126F8E4992_B86C2F0C5A9C84DC_2267_UN""","""CC(C)(C)C(N)C#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""AEFD5131DD6E960B"""
+"""529ED3074E7ABCC7_B7417FD974360730_2267_UN""","""CC(C)(C)C(N)C#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""AEFD5131DD6E960B"""
+"""9ED27360B41919BA_D1BD4112D5236A56_2267_UN""","""CC(C)(C)C(N)C#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""AEFD5131DD6E960B"""
+"""075A16A79B04D24D_7B69F1555BE070F9_2267_UN""","""CC(C)(C)C(N)C#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""AEFD5131DD6E960B"""
+"""32A440C428B69C82_9BEDA25813022827_2267_UN""","""CC(C)(C)C(N)C#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""AEFD5131DD6E960B"""
+"""D7C705A909F29BC4_FEC66DAEF891AE2E_2267_UN""","""CC(C)(C)C(N)C#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""AEFD5131DD6E960B"""
+"""87E9580BC4A31FC1_3CEC59101301647C_2267_UN""","""CC(C)(C)C(N)C#CC2=C1CCC(C(OC)=O)CC1=N[NH]2""",21,"""AEFD5131DD6E960B"""
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+"""4300771E21A5D2BC_AACA77B1AF4F18FE_2267_UN""","""CC(C)(C)C(N)C#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""AEFD5131DD6E960B"""
+"""62DFB26433033C95_69B58158ADC7C3C0_2267_UN""","""CC(C)(C)C(N)C#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""AEFD5131DD6E960B"""
+"""E99D9B9A29DA90B9_BCA5A3E43C8F5D93_2267_UN""","""CC(C)(C)C(N)C#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""AEFD5131DD6E960B"""
+"""E7488EC2CD3BD9DD_1F1BEAE9B2163AFF_2267_UN""","""CC(C)(C)C(N)C#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""AEFD5131DD6E960B"""
+"""92322C9D5BEDD0C4_341447FD4D6870DC_2267_UN""","""CC(C)(C)C(N)C#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""AEFD5131DD6E960B"""
+"""4DAEB7961E4580D8_D89936DE3D505901_2267_UN""","""CC(C)(C)C(N)C#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""AEFD5131DD6E960B"""
+"""D81EC15C395F3338_22242DE203782507_2267_UN""","""CC(C)(C)C(N)C#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""AEFD5131DD6E960B"""
+"""9F98FB5C4DEEAA72_8448B98721BDE2C3_2267_UN""","""CC(C)(C)C(N)C#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""AEFD5131DD6E960B"""
+"""CDF7C6C06FB1559F_0E25888826336997_2267_UN""","""CC(C)(C)C(N)C#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""AEFD5131DD6E960B"""
+"""D8BEF6F39B07B6C0_D2B3485A43F893DC_2267_UN""","""CC(C)(C)C(N)C#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""AEFD5131DD6E960B"""
+"""A26DC56AA6B8F14F_64A1DC5C471FFC70_2267_UN""","""CC(C)(C)C(N)C#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""AEFD5131DD6E960B"""
+"""A2FC0C512EDCF5F6_61AC45272FE89BE5_2267_UN""","""CC(C)(C)C(N)C#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""AEFD5131DD6E960B"""
+"""976F7749B064773F_98698D6F9D3035CF_2267_UN""","""CC(C)(C)C(N)C#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""AEFD5131DD6E960B"""
+"""469077E375C03D69_BCB389B5CB9E3E47_2267_UN""","""CC(C)(C)C(N)C#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""AEFD5131DD6E960B"""
+"""9A79648EF9468687_CBDB34A70C4B5430_2267_UN""","""CC(C)(C)C(N)C#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""AEFD5131DD6E960B"""
+"""0DDF5D3E5D79492C_1D90D085C4948D01_2267_UN""","""CC(C)(C)C(N)C#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""AEFD5131DD6E960B"""
+"""C1634FC8E44A25EF_390F2F6DFC6A57BA_2267_UN""","""CC(C)(C)C(N)C#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""AEFD5131DD6E960B"""
+"""F04EC4EA4F4F0AE0_B61FD8F13DE63633_2267_UN""","""CC(C)(C)C(N)C#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""AEFD5131DD6E960B"""
+"""843EC323DD1B95E6_FF0AF540B24E2920_2267_UN""","""CC(C)(C)C(N)C#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""AEFD5131DD6E960B"""
+"""DFC35F8F3E3B3E4E_232ECF228DC917AA_2267_UN""","""CC(C)(C)C(N)C#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""AEFD5131DD6E960B"""
+"""EDA70E7320DA823E_EC9CDBD49A51FA1B_2267_UN""","""CC(C)(C)C(N)C#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""AEFD5131DD6E960B"""
+"""7A019D6A06470AE4_A8B62C710D7F2ECD_2267_UN""","""CC(C)(C)C(N)C#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""AEFD5131DD6E960B"""
+"""6398F617E39BAB40_D310A22CE50F0B9D_2267_UN""","""CC(C)(C)C(N)C#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""AEFD5131DD6E960B"""
+"""2373D55A46FEF8FF_E1B61AB49EE023C7_2267_UN""","""CC(C)(C)C(N)C#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""AEFD5131DD6E960B"""
+"""729D9A97FCEF3D9D_D4951273A89558C8_2267_UN""","""CC(C)(C)C(N)C#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""AEFD5131DD6E960B"""
+"""71069531992A0C5D_8C27D82968C9ADDD_2267_UN""","""CC(C)(C)C(N)C#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""AEFD5131DD6E960B"""
+"""DA49DB4CF7BA903D_D441AF47769B5444_2267_UN""","""CC(C)(C)C(N)C#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""AEFD5131DD6E960B"""
+"""835482FEBBCBD7FD_58F15E7137A7570A_2267_UN""","""FC1(CCNC1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""AF1B8E67CE18D613"""
+"""2E1E9E56EE3D1753_C622D727D8500059_2267_UN""","""FC1(CCNC1)C#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""AF1B8E67CE18D613"""
+"""87273876261DB195_22DC24643A601DFC_2267_UN""","""FC1(CCNC1)C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""AF1B8E67CE18D613"""
+"""BBFD38EAAE4DB6AD_45EAD28A89FE9E77_2267_UN""","""FC1(CCNC1)C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""AF1B8E67CE18D613"""
+"""41B089781342382E_CE6B79780FEC5766_2267_UN""","""FC1(CCNC1)C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""AF1B8E67CE18D613"""
+"""807D00F1DD42E541_3EE06BFFB9A8BF33_2267_UN""","""FC1(CCNC1)C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""AF1B8E67CE18D613"""
+"""2316202D771AFF61_FEEF6A22337AE3A8_2267_UN""","""FC1(CCNC1)C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""AF1B8E67CE18D613"""
+"""CA31ACA952205767_B98AF05A49EAC4C4_2267_UN""","""FC1(CCNC1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""AF1B8E67CE18D613"""
+"""87787AD9FF3F31B4_B6A7A08F67404728_2267_UN""","""FC1(CCNC1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""AF1B8E67CE18D613"""
+"""79580A6BD84236A2_D05B9E44C6552A4E_2267_UN""","""FC1(CCNC1)C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""AF1B8E67CE18D613"""
+"""C97B2947D76CE3DD_7A8F2E03489630E1_2267_UN""","""FC1(CCNC1)C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""AF1B8E67CE18D613"""
+"""05A9592D42E218E2_9A0B7D0E0074683F_2267_UN""","""FC1(CCNC1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""AF1B8E67CE18D613"""
+"""F7500CDCBAAF574D_FF20B2F8EBE7EE36_2267_UN""","""FC1(CCNC1)C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""AF1B8E67CE18D613"""
+"""F243A590E5BD09A7_3D0A864600772464_2267_UN""","""FC1(CCNC1)C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""AF1B8E67CE18D613"""
+"""E886FD4CEBEDC91D_83C7B9AFA67C33EB_2267_UN""","""FC1(CCNC1)C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""AF1B8E67CE18D613"""
+"""621E7C6D9CE22B59_AB2CA8E7BC3958E6_2267_UN""","""FC1(CCNC1)C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""AF1B8E67CE18D613"""
+"""27214DBFC11EA885_68535E0EBEB183D8_2267_UN""","""FC1(CCNC1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""AF1B8E67CE18D613"""
+"""46276B05F254853F_BD437CB22FF91D8B_2267_UN""","""FC1(CCNC1)C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""AF1B8E67CE18D613"""
+"""98F2017F0B74A24F_1EFD35BFA1607AE7_2267_UN""","""FC1(CCNC1)C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""AF1B8E67CE18D613"""
+"""9AFD24770A63A4F2_35F298AB5E1E30C4_2267_UN""","""FC1(CCNC1)C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""AF1B8E67CE18D613"""
+"""CC1D0AE70DF32810_D97FE9882E261919_2267_UN""","""FC1(CCNC1)C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""AF1B8E67CE18D613"""
+"""C2F3A86242323E43_23C2F2B4100E651F_2267_UN""","""FC1(CCNC1)C#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""AF1B8E67CE18D613"""
+"""FC7092145A5ED439_85AE66D132CBA2DB_2267_UN""","""FC1(CCNC1)C#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""AF1B8E67CE18D613"""
+"""4973FE17EE0E34DD_0FC357DE3545298F_2267_UN""","""FC1(CCNC1)C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""AF1B8E67CE18D613"""
+"""AF1E4E9B2852F6B9_D355970C508ED3C4_2267_UN""","""FC1(CCNC1)C#CC2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""AF1B8E67CE18D613"""
+"""5307C59729A5A683_6547030A5469BC68_2267_UN""","""FC1(CCNC1)C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""AF1B8E67CE18D613"""
+"""1E1D160B216D09BD_604A9A713C9EDBFD_2267_UN""","""FC1(CCNC1)C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""AF1B8E67CE18D613"""
+"""D85E06A8A5C07E4B_998F52398E4675D7_2267_UN""","""FC1(CCNC1)C#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""AF1B8E67CE18D613"""
+"""46A5B9C2DFC44E96_BD5556E3D8E87E5F_2267_UN""","""FC1(CCNC1)C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""AF1B8E67CE18D613"""
+"""F6114DD7AD6560DB_CA3DEBF11F3D1428_2267_UN""","""FC1(CCNC1)C#CC2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""AF1B8E67CE18D613"""
+"""6C0AF4F38AB9F2F7_1C760FD3D7E2CD19_2267_UN""","""FC1(CCNC1)C#CC2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""AF1B8E67CE18D613"""
+"""4215296E953D8816_38E9F03BEF1C17A2_2267_UN""","""FC1(CCNC1)C#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""AF1B8E67CE18D613"""
+"""6522ABC985C424D8_B7F907A72E90762B_2267_UN""","""FC1(CCNC1)C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""AF1B8E67CE18D613"""
+"""4A8F750E75FBBA69_FEEC2A16A1386938_2267_UN""","""FC1(CCNC1)C#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""AF1B8E67CE18D613"""
+"""2B8A9E35BBDB4E3E_22C810749EBF57B2_2267_UN""","""FC1(CCNC1)C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""AF1B8E67CE18D613"""
+"""880257D25F4A9CC4_ED7A04828927BA03_2267_UN""","""FC1(CCNC1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""AF1B8E67CE18D613"""
+"""065B74BD16D270B8_A950F3271E096ED5_2267_UN""","""FC1(CCNC1)C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""AF1B8E67CE18D613"""
+"""63620A4F00875AE9_D2F67D7AF6794B85_2267_UN""","""FC1(CCNC1)C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""AF1B8E67CE18D613"""
+"""E59EABF031762298_E050C5E28D9663DF_2267_UN""","""FC1(CCNC1)C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""AF1B8E67CE18D613"""
+"""A29DFD67FB2282C0_D573CD25BBE318D0_2267_UN""","""FC1(CCNC1)C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""AF1B8E67CE18D613"""
+"""E91D52FF52C5BDE6_8DC1077F7BBFEDC5_2267_UN""","""FC1(CCNC1)C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""AF1B8E67CE18D613"""
+"""AC6370BAE607D169_D5A7701165ED145C_2267_UN""","""FC1(CCNC1)C#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""AF1B8E67CE18D613"""
+"""DE08707D794E6D92_5DA9A31454964E25_1171_UN""","""COC(C)C1=NC(=CS1)C2=CC=C(NC(CCC)=O)C=C2""",21,"""AF53DEB975119F3E"""
+"""4179BF61064FA872_70C65727E945F82B_1171_UN""","""COC(C)C1=NC(=CS1)C2=C([N](CCCOC)C(=C2)C)C""",21,"""AF53DEB975119F3E"""
+"""0443F8EC6CE4CD47_857EE9AED82C01A3_1171_UN""","""COC(C)C1=NC(=CS1)C2=C([NH]C(=C2C(OCC)=O)C)C""",21,"""AF53DEB975119F3E"""
+"""6734ACC6065E8744_828AC26810864B45_1171_UN""","""COC(C)C1=NC(=CS1)C2=CC=C(CCCCCC)C=C2""",21,"""AF53DEB975119F3E"""
+"""BC408B6702617430_EAA21FAD7C946B32_1171_UN""","""COC(C)C1=NC(=C(C)S1)C2=C(C(=C(C)[NH]2)C(OC)=O)C""",21,"""AF53DEB975119F3E"""
+"""26E65DE88AD11633_D75C1B27EEBF60F8_1171_UN""","""COC(C)C1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NC=N[NH]3""",21,"""AF53DEB975119F3E"""
+"""13CDFB3FBC9DF90C_1924669D736220BA_1171_UN""","""COC(C)C1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NOC=C3""",21,"""AF53DEB975119F3E"""
+"""060C01B34D372F25_253E3C1E3AF798F8_1171_UN""","""COC(C)C1=NC(=CS1)C2=CC(=C(C=C2)OC(F)F)OC""",21,"""AF53DEB975119F3E"""
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+"""56FCB29B0938B469_225A273CA1E7507F_2267_UN""","""NC(CC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""3B8D359DF1CA0A58_456CD1D21279D3F4_2267_UN""","""NC(CC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
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+"""B8BFA9E3C8064D74_3E6668A7222FF2B0_2267_UN""","""NC(CC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
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+"""316336E7FF582807_B621A3D7FCC70AAB_2267_UN""","""NC(CC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""D5252616B758A1C9_D0DD9D1C5DD267CD_2267_UN""","""NC(CC#CC1=C(C(NCC(O)=O)=O)C=CC=C1)C(=O)O""",21,"""AF9D8D3F559F9B90"""
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+"""B287BBB208E4102C_9A8D7E569BF325BC_2267_UN""","""NC(CC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""083A14569AC78339_FFA6B1A07060A3B5_2267_UN""","""NC(CC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""9A851C652602FBC0_3D8C851E9BF069E7_2267_UN""","""NC(CC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""984CE3765ABB6201_8341BAF73DFB7E68_2267_UN""","""NC(CC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""7A5E403B9ADF16C6_ABAAABBF27BE1565_2267_UN""","""NC(CC#CC1=C(C(OCC)=O)C=N[N]1C(C)C)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""720C688241799732_68D55D562536CE5B_2267_UN""","""NC(CC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""AB5C98D5FAE1952C_BDC57FEAB47E5008_2267_UN""","""NC(CC#CC2=CC=C(CC1(C)NCCC1)C=C2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""7E5822D4C62E9311_1E7B36E73AE73764_2267_UN""","""NC(CC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""B9061FA7197F8DF4_35749BF3C5997D47_2267_UN""","""NC(CC#CC1=C(C)C=C(C(=C1)C)C2OCCO2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""6E67BA7F57A2818E_D9F9EAD0B5A1549A_2267_UN""","""NC(CC#CC1=CC=C(C=C1)C2NCCNC2=O)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""B3EB525F04A0DF86_2344F1EC8B89289C_2267_UN""","""NC(CC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""C483203E4259C014_85286589A94CEF58_2267_UN""","""NC(CC#CC(B1OC(CN(C)CC(O1)=O)=O)=C)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""13CE3F9E74B39D48_0F455486AEC2640C_2267_UN""","""NC(CC#CC1=C[N](CC(OCC)OCC)N=C1)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""F7D6403E1AA58763_D3D39454CB099E47_2267_UN""","""NC(CC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""ADC8839815FB7DD0_65C10052CFEEF1EB_2267_UN""","""NC(CC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""A9F4E991DA548340_60CC9929A719967E_2267_UN""","""NC(CC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""B77DC7E163997EA7_9909516115C13854_2267_UN""","""NC(CC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""5DE5E7ECE5C14913_BDD355BB436F33DC_2267_UN""","""NC(CC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""4B0A3CA77E119237_CABBE8A984BA59AB_2267_UN""","""NC(CC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""CD99A8E83929F408_1CF00C8B4C65809A_2267_UN""","""NC(CC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""7B24FEC4FCB7792A_386FF363749B5A21_2267_UN""","""NC(CC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""6D5054C9432D9725_B77F04FFB5173BA8_2267_UN""","""NC(CC#CC1=CC(=CC=C1)CC2=CC=CC=C2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""6DFBC92C64717845_FE6A294E3ABF24BB_2267_UN""","""NC(CC#CC1=CC=C(C=C1)CN2CCCCC2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""06758902048697AE_224E132C05381A31_2267_UN""","""NC(CC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""75ED2B7E8FF9F234_EDFC07DA12A0F780_2267_UN""","""NC(CC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""510377413885CBF1_A9D6F07F858E2356_2267_UN""","""NC(CC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""EC8EF83AA90F6492_D2707E226DFE0606_2267_UN""","""NC(CC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""D4F44AB9F314241F_E0D6C6BA16112E5C_2267_UN""","""NC(CC#CC1=CC=C(CCCCC(O)=O)C=C1)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""E9B498BD3AEEAD39_D5F5CE7D20645553_2267_UN""","""NC(CC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""E7066D6A304F1605_8D470427E038A046_2267_UN""","""NC(CC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""CC5A55F867CD24B5_D5217349FE6A59DF_2267_UN""","""NC(CC#CC2=NC1=C(OC)C=CC(=C1S2)OC)C(=O)O""",21,"""AF9D8D3F559F9B90"""
+"""E71973E8CCAA91A4_443C86691C83818E_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](CC)(=O)=O)CC(=O)OC""",21,"""AFE8CEA165911F01"""
+"""EFF1759E82077C22_676133CDA3406913_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""AFE8CEA165911F01"""
+"""2B96110CAB2F690D_4D161CB471CB74B5_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""AFE8CEA165911F01"""
+"""2921B8B89D998709_1FA30B5DBD53C12A_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""AFE8CEA165911F01"""
+"""8D9766C02A1D5D1F_7EE8D8FE0D48A2D0_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2CCCNC2""",21,"""AFE8CEA165911F01"""
+"""A3BAB52631FF082C_48EAE4D43F29EE62_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)CC2CCCN2""",21,"""AFE8CEA165911F01"""
+"""79C416AB0DE22104_6C35A76994929E74_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""AFE8CEA165911F01"""
+"""5C8E2D5916A68411_A311927DD5CF57D4_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2CCCNC2""",21,"""AFE8CEA165911F01"""
+"""8C1DA008CDEDA1C4_765695E42649EA9E_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""AFE8CEA165911F01"""
+"""7D1CDDCFB20961AA_CE10A141B09997E5_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(CC)[S](=O)(=O)C2CCNC2""",21,"""AFE8CEA165911F01"""
+"""FCBE17710B60EF61_0BB32F7B0C59B81C_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""AFE8CEA165911F01"""
+"""CEA05B43DAE47A00_AEE8BA1F4EBCBFEB_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""AFE8CEA165911F01"""
+"""62AA3D987DD2648A_A079CD5577DACC64_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""AFE8CEA165911F01"""
+"""8B1C7BC66C7F197E_4EE0A064C0E56A64_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CCNC2CC2""",21,"""AFE8CEA165911F01"""
+"""D640E49532081CCD_F17CE51B09F1E9CC_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""AFE8CEA165911F01"""
+"""3117541D9A0B4712_46F215684B8D0FC5_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2CCNCC2""",21,"""AFE8CEA165911F01"""
+"""18C9AB0B90474EF9_E8607628919A006A_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""AFE8CEA165911F01"""
+"""C92004E72E11ED3A_F044A7C4A35FCCDD_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""AFE8CEA165911F01"""
+"""7D65EF84BF92B0AC_1008EE92FEFD4FB1_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""AFE8CEA165911F01"""
+"""456A135B0B22038F_5C665391C2FB1395_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2CCNCC2""",21,"""AFE8CEA165911F01"""
+"""E397FC29E19AFC02_237D86D05DDFDEFB_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""AFE8CEA165911F01"""
+"""E0AEE062CA36A3E9_F302D5D207F0F61D_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""AFE8CEA165911F01"""
+"""1F9AB5635657B834_213306806F5C5615_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""AFE8CEA165911F01"""
+"""5F69F6A831451D7E_9A62DF1B67CB7951_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""AFE8CEA165911F01"""
+"""021578AC7FFAEAE4_68C384082FD0A76B_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""AFE8CEA165911F01"""
+"""2F72F75A6A4D1D9F_48D790812F10E757_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](C)(=O)=O)CC2CNCC2""",21,"""AFE8CEA165911F01"""
+"""4F38FC751150D78E_74AB2B9778E548E1_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""AFE8CEA165911F01"""
+"""90DDCEBF2FFBAB83_7DE3360E05E3399E_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""AFE8CEA165911F01"""
+"""9CD82D60C7C1072C_DFD6EFD678349115_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""AFE8CEA165911F01"""
+"""384CC314ED1D2A99_CEC23CF56B41A221_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""AFE8CEA165911F01"""
+"""3351D71AF1D495AB_3B7402D991DA4C1A_6036_UN""","""C(CNC1=CC=C(C=C1)Br)N(CCCN)[S](=O)(=O)C2CC2""",21,"""AFE8CEA165911F01"""
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+"""400EF75AA0EC72A1_6174DB565508D03B_6036_UN""","""NCC2CCN(CCN(C)[S](=O)(=O)C1CCCNC1)CC2""",21,"""B074CD093DD16DEA"""
+"""A784563F35B38F87_5776E77C67699C89_6036_UN""","""NCC2CCN(CCN(C)[S](=O)(=O)CC1CCCN1)CC2""",21,"""B074CD093DD16DEA"""
+"""626CC14E814D39A3_73A9A4C1CCD2EC9F_6036_UN""","""NCC2CCN(CCN(C)[S](=O)(=O)C1=CC=C(Cl)S1)CC2""",21,"""B074CD093DD16DEA"""
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+"""567433403BD155AD_69CA964C7E099875_6036_UN""","""NCC2CCN(CCN([S](C)(=O)=O)C1=NN=C(N)S1)CC2""",21,"""B074CD093DD16DEA"""
+"""2CF4C19388724B69_D18CA2E9E8D9E50E_6036_UN""","""NCC2CCN(CCN(CC)[S](=O)(=O)C1CCNC1)CC2""",21,"""B074CD093DD16DEA"""
+"""8406A14CC0FBB8EF_142F2CD35419CAF7_6036_UN""","""NCC1CCN(CCN([S](C(C)(C)C)(=O)=O)CC=C)CC1""",21,"""B074CD093DD16DEA"""
+"""41A70B16AB1DFA97_B174B9B716FCCD00_6036_UN""","""NCC1CCN(CCN(C)[S](=O)(=O)CC[S](=O)(=O)C)CC1""",21,"""B074CD093DD16DEA"""
+"""45437014168812C7_BFE5CEFD2F9ABE8F_6036_UN""","""NCC1CCN(CCN(C(C)(C)C)[S](=O)(=O)CCN)CC1""",21,"""B074CD093DD16DEA"""
+"""F7AB2C9B7D0043D7_517CA3CC98A5188F_6036_UN""","""NCC2CCN(CCN([S](C)(=O)=O)CCNC1CC1)CC2""",21,"""B074CD093DD16DEA"""
+"""D3CC4753E83E1354_EEE0E6B351B19B27_6036_UN""","""NCC1CCN(CCN([S](C)(=O)=O)C(=O)CN=[N]#N)CC1""",21,"""B074CD093DD16DEA"""
+"""4221B6D95695937B_596E16C013CD7D2E_6036_UN""","""NCC2CCN(CCN(C)[S](=O)(=O)C1CCNCC1)CC2""",21,"""B074CD093DD16DEA"""
+"""26199B750E241565_F7FC7580C9DA7281_6036_UN""","""NCC2CCN(CCN1[S](CCC1C(OC)=O)(=O)=O)CC2""",21,"""B074CD093DD16DEA"""
+"""80BEF0877733EF77_EFD8A46CFB1FBE36_6036_UN""","""NCC3CCN(CCN1[S](=O)(=O)C2=C(C1)C=CC=C2)CC3""",21,"""B074CD093DD16DEA"""
+"""69E921E45ED5FB31_0F94ED3AA6BD3D5A_6036_UN""","""NCC2CCN(CCN([S](C)(=O)=O)CC1=CC=NO1)CC2""",21,"""B074CD093DD16DEA"""
+"""DF92274DF8CF64E5_43FA50399ABB617E_6036_UN""","""NCC2CCN(CCN([S](C)(=O)=O)C1CCNCC1)CC2""",21,"""B074CD093DD16DEA"""
+"""AD89EA48ACE50697_3CE18578059FAC10_6036_UN""","""NCC2CCN(CCN([S](C)(=O)=O)C1=NC=CC=C1)CC2""",21,"""B074CD093DD16DEA"""
+"""75B2D831AAADB963_EC9ED67A5FB084F6_6036_UN""","""NCC2CCN(CCN(C)[S](=O)(=O)C1=CN=CC=C1)CC2""",21,"""B074CD093DD16DEA"""
+"""DFB03A59A9A839FB_3EAF0528371C24FE_6036_UN""","""NCC1CCN(CCN(C(C)(C)C(=N)N)[S](=O)(=O)C)CC1""",21,"""B074CD093DD16DEA"""
+"""C9E6734C10EB5DCF_85FEDCB33F8B0BBA_6036_UN""","""NCC2CCN(CCN(C)[S](=O)(=O)C1=C[N](C)C=N1)CC2""",21,"""B074CD093DD16DEA"""
+"""4E4C35B2E09271E9_775F87A07790D580_6036_UN""","""NCC2CCN(CCN1CCCC(C(C)C)[S]1(=O)=O)CC2""",21,"""B074CD093DD16DEA"""
+"""2B3AF5D04A01541A_574B9329775095BC_6036_UN""","""NCC2CCN(CCN([S](C)(=O)=O)CC1CNCC1)CC2""",21,"""B074CD093DD16DEA"""
+"""5C6B74EE1825C621_6B37283F20A53A0A_6036_UN""","""NCC2CCN(CCN([S](C)(=O)=O)[C@@H]1CNCCC1)CC2""",21,"""B074CD093DD16DEA"""
+"""A1CADCDA76D89FAE_627F35A65DA34B75_6036_UN""","""NCC2CCN(CCN(CCCCl)[S](=O)(=O)C1CC1)CC2""",21,"""B074CD093DD16DEA"""
+"""BB3EB8CC595C6E28_C04AEC7E2074E3FE_6036_UN""","""NCC3CCN(CCN1C(=O)C2=C([S]1(=O)=O)C=CS2)CC3""",21,"""B074CD093DD16DEA"""
+"""A3360397D2CA1A5A_D15E3F5D3301D0CA_6036_UN""","""NCC1CCN(CCN(C(C(C)(C)N)=O)[S](=O)(=O)C)CC1""",21,"""B074CD093DD16DEA"""
+"""3090A873F3FBE51F_24E80171C99A3EF1_6036_UN""","""NCC2CCN(CCN(CCCN)[S](=O)(=O)C1CC1)CC2""",21,"""B074CD093DD16DEA"""
+"""24D011CB5B51AD07_18EC3568818D289F_6036_UN""","""NCC2CCN(CCN1CCCC(CC=C)[S]1(=O)=O)CC2""",21,"""B074CD093DD16DEA"""
+"""EA297F7261F35F3B_F19A0F4F90A3E2C0_6036_UN""","""NCC1CCN(CCN(CCCN)[S](=O)(=O)C(F)F)CC1""",21,"""B074CD093DD16DEA"""
+"""27E2B11DE6A4DA1E_029AA5A20ABC0D14_6036_UN""","""NCC3CCN(CCN1[S](C2(CC1CI)CC2)(=O)=O)CC3""",21,"""B074CD093DD16DEA"""
+"""9212C37CC50167AE_0BF4B541F3A992AB_6036_UN""","""NCC2CCN(CCN1CCCCNCC[S]1(=O)=O)CC2""",21,"""B074CD093DD16DEA"""
+"""73B4042D7D541D1D_7FAC72E2F0804E03_6036_UN""","""NCC3CCN(CCN1[S](=O)(=O)C2(C1)CCOCC2)CC3""",21,"""B074CD093DD16DEA"""
+"""AD3DCE1FB933471E_907782F626EC8175_6036_UN""","""NCC3CCN(CCN1C(CN)CC2([S]1(=O)=O)CC2)CC3""",21,"""B074CD093DD16DEA"""
+"""F7CFC5CE60A9559F_3789ADBEE54B926F_6036_UN""","""NCC3CCN(CCN([S](=O)(=O)C1CC1)C2CNC2)CC3""",21,"""B074CD093DD16DEA"""
+"""B52A2B73D12B8845_0FCE5CEF3DFA8060_6036_UN""","""NCC3CCN(CCN1CC2(C[S]1(=O)=O)CCCC2)CC3""",21,"""B074CD093DD16DEA"""
+"""9151342A0B1192CD_A5905EE5E427EDC6_6036_UN""","""NCC3CCN(CCN([S](=O)(=O)C1CNC1)C2CC2)CC3""",21,"""B074CD093DD16DEA"""
+"""BF7CB2568703AD7F_0132D83DBA4B04BD_6036_UN""","""NCC1CCN(CCN([S](C)(=O)=O)CC[S](=O)(=O)Cl)CC1""",21,"""B074CD093DD16DEA"""
+"""029B09CFDE09CFD4_117E0641E34CCF58_6036_UN""","""NCC1CCN(CCN(CCC)[S](=O)(=O)C(F)(F)F)CC1""",21,"""B074CD093DD16DEA"""
+"""FE47E2F551935632_4772431062A8E982_2267_UN""","""C(#CC1=CN=CN=C1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""B09893069B17689B"""
+"""D0957D05393B734B_D9A1CA468D5FBED1_2267_UN""","""C(#CC1=CN=CN=C1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""B09893069B17689B"""
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+"""6719982A8DD733BA_E2A3EBA29BD1FD33_2267_UN""","""OC(=O)COCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""B3570FE766B3C888"""
+"""E969389402625EE2_A5C671DAE141DA5F_2267_UN""","""OC(=O)COCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""B3570FE766B3C888"""
+"""119AE5F51A6D104E_AAEB210FCFEB59B3_2267_UN""","""OC(=O)COCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""B3570FE766B3C888"""
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+"""D75504CDFBB865C0_0B4C344BBD198A65_6036_UN""","""CC2=CC=C(CNCCN([S](C)(=O)=O)CC1=CC=NO1)O2""",21,"""B4AC14782675DAD5"""
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+"""37160E5438BC1465_E8460F0B441433C9_6036_UN""","""CC2=CC=C(CNCCN(C)[S](=O)(=O)C1=CN=CC=C1)O2""",21,"""B4AC14782675DAD5"""
+"""77038C6C72E37066_3A77DC592CB893C1_6036_UN""","""CC1=CC=C(CNCCN(C(C)(C)C(=N)N)[S](=O)(=O)C)O1""",21,"""B4AC14782675DAD5"""
+"""518EFAE6D38ABE0F_812605C2242FBC85_6036_UN""","""CC2=CC=C(CNCCN(C)[S](=O)(=O)C1=C[N](C)C=N1)O2""",21,"""B4AC14782675DAD5"""
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+"""5673B5C9BC9E3197_E4FA4D6C3559EDC4_6036_UN""","""NCC(C1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""B810561F573804D8"""
+"""1C12FB10E80F15C1_36CB9E3E5DF54DCC_6036_UN""","""NCC(C1=CC(=CC=C1)F)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""B810561F573804D8"""
+"""A9DF6A5C87DF12E9_8D9A47A555626288_6036_UN""","""NCC(C1=CC(=CC=C1)F)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""B810561F573804D8"""
+"""5F4C15A4D472A86C_7F3B1CB61D79BCB2_6036_UN""","""NCC(C1=CC(=CC=C1)F)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""B810561F573804D8"""
+"""B225BD08434AFAB7_5F2F083F1DB9FC8E_6036_UN""","""NCC(C1=CC(=CC=C1)F)N([S](C)(=O)=O)CC2CNCC2""",21,"""B810561F573804D8"""
+"""F4322F6252F17875_6353B3294A4C5338_6036_UN""","""NCC(C1=CC(=CC=C1)F)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""B810561F573804D8"""
+"""C81443413FEC6C6D_6A1BAEB0374A2247_6036_UN""","""NCC(C1=CC(=CC=C1)F)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""B810561F573804D8"""
+"""C9FBF13225E194DB_C82E77684A9D8ACC_6036_UN""","""NCC(C1=CC(=CC=C1)F)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""B810561F573804D8"""
+"""6637962612321060_D93AA44B59E8B9F8_6036_UN""","""NCC(C1=CC(=CC=C1)F)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""B810561F573804D8"""
+"""CB8D84D6F303CEAE_2C8C9A67A37357C3_6036_UN""","""NCC(C1=CC(=CC=C1)F)N(CCCN)[S](=O)(=O)C2CC2""",21,"""B810561F573804D8"""
+"""655F283E9ACEEFA3_1088AE7EEB6441AD_6036_UN""","""NCC(C1=CC(=CC=C1)F)N2CCCC(CC=C)[S]2(=O)=O""",21,"""B810561F573804D8"""
+"""C2550873098EF5E2_F9FE9459FA4A8BF2_6036_UN""","""NCC(C1=CC(=CC=C1)F)N(CCCN)[S](=O)(=O)C(F)F""",21,"""B810561F573804D8"""
+"""902B1606FB3BDEC4_0AFE3EB460556426_6036_UN""","""NCC(C1=CC(=CC=C1)F)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""B810561F573804D8"""
+"""45B13948E9A3FCA2_03902E579940FB99_6036_UN""","""NCC(C1=CC(=CC=C1)F)N2CCCCNCC[S]2(=O)=O""",21,"""B810561F573804D8"""
+"""AE354EF82D171811_77C8E9F49A692731_6036_UN""","""NCC(C1=CC(=CC=C1)F)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""B810561F573804D8"""
+"""2FA5591DE820A491_981319E04C05E847_6036_UN""","""NCC(C1=CC(=CC=C1)F)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""B810561F573804D8"""
+"""4AC1AA523BA11284_3FED36A88FA2FB5D_6036_UN""","""NCC(C1=CC(=CC=C1)F)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""B810561F573804D8"""
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+"""FB01BC03098663CD_2BFB9F10D9A8C9AC_2267_UN""","""CCNC(C)(C)C#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""BC09E14CF8AC081D"""
+"""CCBC117E2FB3ED10_A4EB688C1824A825_2267_UN""","""CCNC(C)(C)C#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""BC09E14CF8AC081D"""
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+"""A01219A5628FA411_77C1471EE40F6408_6031_UN""","""O(C(=O)C13CC(C1)(C2=CC=C(C=C2)Br)C3(F)F)CCC#C""",21,"""BDF42989A2B12575"""
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+"""1D5C41B5CED4B05C_C5008B763B23C557_6031_UN""","""O(C(=O)C13CC(C1)(C2=CC=C(C=C2)Br)C3(F)F)CC(C)Br""",21,"""BDF42989A2B12575"""
+"""869ACF0CC0178C19_10A0ED62163D5215_6031_UN""","""O(C(=O)C13CC(C1)(C2=CC=C(C=C2)Br)C3(F)F)CCCI""",21,"""BDF42989A2B12575"""
+"""D71A980D8F066051_DAE4613C0212D656_6043_UN""","""OC(=O)C13CC(C1)(C2=CC=C(C=C2)N[S](C)(=O)=O)C3(F)F""",21,"""BDF42989A2B12575"""
+"""177F9F79B238CFCC_558D5A26451A0AEB_6036_UN""","""COC(=O)C1C(CCCN1)N([S](CC)(=O)=O)CC(=O)OC""",21,"""BE5912EE3C089464"""
+"""24153C8ADB56C582_76D0EF82FAD9E276_6036_UN""","""COC(=O)C1C(CCCN1)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""BE5912EE3C089464"""
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+"""D40F76258EE90854_7D847B26CD0B1511_6036_UN""","""COC(=O)C1C(CCCN1)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""BE5912EE3C089464"""
+"""C0F0C439856CE61D_B2A04E328C56DCB1_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C)(=O)=O)C2CCCNC2""",21,"""BE5912EE3C089464"""
+"""93FF0FFD8175DD8A_67E749AB7FD061FB_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""BE5912EE3C089464"""
+"""74F1FDC2716B8090_DFA17D0EE9001C80_6036_UN""","""COC(=O)C1C(CCCN1)N(CC)[S](=O)(=O)C2CCNC2""",21,"""BE5912EE3C089464"""
+"""AC833F87769110CC_1A02F33455C03379_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""BE5912EE3C089464"""
+"""A1D863040CD66FAF_BF5966501725348E_6036_UN""","""COC(=O)C1C(CCCN1)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""BE5912EE3C089464"""
+"""5AB6612823E4A793_B1C8111A2E434701_6036_UN""","""COC(=O)C1C(CCCN1)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""BE5912EE3C089464"""
+"""4A7B88924B0BFB90_5F517C2B997CE101_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C)(=O)=O)CCNC2CC2""",21,"""BE5912EE3C089464"""
+"""8E4EC510A79F23C2_E0CD3954506862A9_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""BE5912EE3C089464"""
+"""7C77E01A0340AEF1_5743C927121484A0_6036_UN""","""COC(=O)C1C(CCCN1)N(C)[S](=O)(=O)C2CCNCC2""",21,"""BE5912EE3C089464"""
+"""A87002EB66042F73_F9D1AA67C8038B0F_6036_UN""","""COC(=O)C1C(CCCN1)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""BE5912EE3C089464"""
+"""52B535966C973087_E1F57B8BFAC647B8_6036_UN""","""COC(=O)C1C(CCCN1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""BE5912EE3C089464"""
+"""65AB5BD1FB570C8D_01B932DDA764C4D4_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""BE5912EE3C089464"""
+"""5452BB978224B626_4DD78FDE9B6298F0_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C)(=O)=O)C2CCNCC2""",21,"""BE5912EE3C089464"""
+"""74F3BA32F62A30B3_32CC5A9F0446559E_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""BE5912EE3C089464"""
+"""E2512B16AA739F79_E2B3099D5E697D78_6036_UN""","""COC(=O)C1C(CCCN1)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""BE5912EE3C089464"""
+"""37400D1E18CCE7D3_3082DACF36C5DD70_6036_UN""","""COC(=O)C1C(CCCN1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""BE5912EE3C089464"""
+"""538A9FAC8F127414_8BD303543E52F234_6036_UN""","""COC(=O)C1C(CCCN1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""BE5912EE3C089464"""
+"""C74A8F91DE6E950E_7972584776492C0E_6036_UN""","""COC(=O)C1C(CCCN1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""BE5912EE3C089464"""
+"""46372A3F54A77F35_59664CCE76896C32_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C)(=O)=O)CC2CNCC2""",21,"""BE5912EE3C089464"""
+"""4C1116D3F0CAF520_651AF7D8217CC384_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""BE5912EE3C089464"""
+"""B509F22796C1B770_6C52EA415C7AB2FB_6036_UN""","""COC(=O)C1C(CCCN1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""BE5912EE3C089464"""
+"""9F217F6A3619C469_CE67339921AD1A70_6036_UN""","""COC(=O)C1C(CCCN1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""BE5912EE3C089464"""
+"""B9200868BB5D61CE_DF73E0BA32D82944_6036_UN""","""COC(=O)C1C(CCCN1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""BE5912EE3C089464"""
+"""0AB32FCD84C7D751_2AC5DE96C843C77F_6036_UN""","""COC(=O)C1C(CCCN1)N(CCCN)[S](=O)(=O)C2CC2""",21,"""BE5912EE3C089464"""
+"""F47B87A20246884B_16C1EA8F8054D111_6036_UN""","""COC(=O)C1C(CCCN1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""BE5912EE3C089464"""
+"""168421621036B554_FFB7D0A8917A1B4E_6036_UN""","""COC(=O)C1C(CCCN1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""BE5912EE3C089464"""
+"""35596597FA9CAFDB_0CB77A450B65F49A_6036_UN""","""COC(=O)C1C(CCCN1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""BE5912EE3C089464"""
+"""4962FE66EE333777_05D96AA6F2706B25_6036_UN""","""COC(=O)C1C(CCCN1)N2CCCCNCC[S]2(=O)=O""",21,"""BE5912EE3C089464"""
+"""E07C531BC76C8D48_7181AD05F159B78D_6036_UN""","""COC(=O)C1C(CCCN1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""BE5912EE3C089464"""
+"""F5137EA57059EAA9_9E5A5D11273578FB_6036_UN""","""COC(=O)C1C(CCCN1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""BE5912EE3C089464"""
+"""BC4868C7D331D57A_39A47259E4926BE1_6036_UN""","""COC(=O)C1C(CCCN1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""BE5912EE3C089464"""
+"""2E29DA396E30770F_01E383083C2379EE_6036_UN""","""COC(=O)C1C(CCCN1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""BE5912EE3C089464"""
+"""2A05DB9F2AC9F76D_ABBD8102E5FE1448_6036_UN""","""COC(=O)C1C(CCCN1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""BE5912EE3C089464"""
+"""3CB347FFE03B0ECD_0F1F07DABB92FD33_6036_UN""","""COC(=O)C1C(CCCN1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""BE5912EE3C089464"""
+"""7BB7E53A7450663A_1F53D9A6E29536D6_6036_UN""","""COC(=O)C1C(CCCN1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""BE5912EE3C089464"""
+"""B16E1F2CAAD0FCAA_550757855F8CDEA0_6036_UN""","""NCC(CN([S](CC)(=O)=O)CC(=O)OC)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""A7C1279F3F7342A6_765AE221E04F363D_6036_UN""","""NCC(CN([C@H](C(OC)=O)C)[S](=O)(=O)C)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""412796FE08B0351A_5C2DCD5832C42B9B_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=CC=C(Br)S1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""2494B8EE0EB9DFA1_0E98DAB1FE5C9E04_6036_UN""","""NCC(CN1C2=C(C[S]1(=O)=O)C=CC=C2)CC3=CC=CO3""",21,"""BED31F4D269E402F"""
+"""53DC65C54BA5A7B6_6FD309124E47FDFE_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1CCCNC1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""178DE9BDF917AA3A_59D135387C26B14C_6036_UN""","""NCC(CN(C)[S](=O)(=O)CC1CCCN1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""1B43561897D33581_7D0E7685D79DC15A_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=CC=C(Cl)S1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""216C81B9B1AEFFF5_B22A439196C008FA_6036_UN""","""NCC(CN([S](C)(=O)=O)C1CCCNC1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""F7D66C6D0D8105E9_676D44086546B5B0_6036_UN""","""NCC(CN([S](C)(=O)=O)C1=NN=C(N)S1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""1922C4223E79C234_DF2B70ADF396C8CB_6036_UN""","""NCC(CN(CC)[S](=O)(=O)C1CCNC1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""079AE31EF736E9B8_1A88FE974F56E732_6036_UN""","""NCC(CN([S](C(C)(C)C)(=O)=O)CC=C)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""704789997F33CC0E_BFD36BF30DB3E0C5_6036_UN""","""NCC(CN(C)[S](=O)(=O)CC[S](=O)(=O)C)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""C4C59E3817D50BDF_B1421CB934D5934A_6036_UN""","""NCC(CN(C(C)(C)C)[S](=O)(=O)CCN)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""497189BC7695E6FC_5FDB718883EA354A_6036_UN""","""NCC(CN([S](C)(=O)=O)CCNC1CC1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""9BD3C3224B34B400_E04734F74AFEB6E2_6036_UN""","""NCC(CN([S](C)(=O)=O)C(=O)CN=[N]#N)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""68FE2BF51A89FA75_57C9C484088250EB_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1CCNCC1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""C86E098CEDBB1311_F95BA7C4D2955F44_6036_UN""","""NCC(CN1[S](CCC1C(OC)=O)(=O)=O)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""A3FFD396F6BE3B2A_E17F7628E05093F3_6036_UN""","""NCC(CN1[S](=O)(=O)C2=C(C1)C=CC=C2)CC3=CC=CO3""",21,"""BED31F4D269E402F"""
+"""C2CA4E9025D4D38E_01333F7EBDF2109F_6036_UN""","""NCC(CN([S](C)(=O)=O)CC1=CC=NO1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""4DD263B88605C5A4_4D5D827D81F44CBB_6036_UN""","""NCC(CN([S](C)(=O)=O)C1CCNCC1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""545EE298DAB202B6_3246573C1ED081D5_6036_UN""","""NCC(CN([S](C)(=O)=O)C1=NC=CC=C1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""4630D48EB34F51CB_E239043E44FFA933_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=CN=CC=C1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""D6A0B246E79CAFE9_3008D76C2C53093B_6036_UN""","""NCC(CN(C(C)(C)C(=N)N)[S](=O)(=O)C)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""932733DAF2B182A0_8B590EF724C4267F_6036_UN""","""NCC(CN(C)[S](=O)(=O)C1=C[N](C)C=N1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""A0960417322ABAA5_79F855E46CDFF845_6036_UN""","""NCC(CN1CCCC(C(C)C)[S]1(=O)=O)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""4D10CFF05A494A37_59EC416D6C1FB879_6036_UN""","""NCC(CN([S](C)(=O)=O)CC1CNCC1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""9E1E28D75BCF9595_6590FA7B3BEA17CF_6036_UN""","""NCC(CN([S](C)(=O)=O)[C@@H]1CNCCC1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""9941E1117F5A8DB5_6CD8E7E246EC66B0_6036_UN""","""NCC(CN(CCCCl)[S](=O)(=O)C1CC1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""0260B960633A13C0_CEED3E3A3B3BCE3B_6036_UN""","""NCC(CN1C(=O)C2=C([S]1(=O)=O)C=CS2)CC3=CC=CO3""",21,"""BED31F4D269E402F"""
+"""F203063EA88FB00E_DFF9ED19284EFD0F_6036_UN""","""NCC(CN(C(C(C)(C)N)=O)[S](=O)(=O)C)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""C198EFEC779B97AA_2A4FD335D2D51334_6036_UN""","""NCC(CN(CCCN)[S](=O)(=O)C1CC1)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""86F1223871582294_164BE72C9AC2055A_6036_UN""","""NCC(CN1CCCC(CC=C)[S]1(=O)=O)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""34673EB33DAC1977_FF3DDD0B8BECCF05_6036_UN""","""NCC(CN(CCCN)[S](=O)(=O)C(F)F)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""EB9F48A5E7A9FC7F_0C3D77E611F320D1_6036_UN""","""NCC(CN1[S](C2(CC1CI)CC2)(=O)=O)CC3=CC=CO3""",21,"""BED31F4D269E402F"""
+"""BFF3FAA5FA784FAC_05536705E8E6BF6E_6036_UN""","""NCC(CN1CCCCNCC[S]1(=O)=O)CC2=CC=CO2""",21,"""BED31F4D269E402F"""
+"""07F7CADC4ACDD752_710BA0A6EBCF63C6_6036_UN""","""NCC(CN1[S](=O)(=O)C2(C1)CCOCC2)CC3=CC=CO3""",21,"""BED31F4D269E402F"""
+"""2AE7B2B07DA44A18_9ED050B23DA3ACB0_6036_UN""","""NCC(CN1C(CN)CC2([S]1(=O)=O)CC2)CC3=CC=CO3""",21,"""BED31F4D269E402F"""
+"""BB7562906FA72244_392E7FFAFE04BFAA_6036_UN""","""NCC(CN([S](=O)(=O)C1CC1)C2CNC2)CC3=CC=CO3""",21,"""BED31F4D269E402F"""
+"""9EBCA10B524F9B91_01698EAB26B5ADA5_6036_UN""","""NCC(CN1CC2(C[S]1(=O)=O)CCCC2)CC3=CC=CO3""",21,"""BED31F4D269E402F"""
+"""6E1E88662DBEB8F9_AB378CA1FF68C003_6036_UN""","""NCC(CN([S](=O)(=O)C1CNC1)C2CC2)CC3=CC=CO3""",21,"""BED31F4D269E402F"""
+"""90A3AB8C6693C094_0F950A79A1042978_6036_UN""","""NCC(CN([S](C)(=O)=O)CC[S](=O)(=O)Cl)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""4D769CDB2B69ABD5_1FD9D405F803E29D_6036_UN""","""NCC(CN(CCC)[S](=O)(=O)C(F)(F)F)CC1=CC=CO1""",21,"""BED31F4D269E402F"""
+"""51B638B485E1C672_A54E9AA713C6F9CE_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC(=C(C(=C2)F)F)F""",21,"""C0FA6E6C262C295A"""
+"""9FFA4C4054568AC0_884F3D313430CCF2_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=C(C(C)C)C=C2""",21,"""C0FA6E6C262C295A"""
+"""06132A3C55BB2743_2ACCFA00E429E737_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC3=C(C=C2)CCC3""",21,"""C0FA6E6C262C295A"""
+"""BFEC1DE73B55AA46_8A1EBACCFB419D95_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=CC(=C2)C#CC""",21,"""C0FA6E6C262C295A"""
+"""1BFB84D7996FF521_8A1A3EBEEA29B60A_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=CC(=C2)CSC""",21,"""C0FA6E6C262C295A"""
+"""44DD15B189EB629E_0AF48E90483E9A0F_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CN=C(C=C2)[N](=O)=O""",21,"""C0FA6E6C262C295A"""
+"""66FEBFAFCCD5D9D4_52AF8CBCEEA66825_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CSC=C2C(F)(F)F""",21,"""C0FA6E6C262C295A"""
+"""824872C79FC2F8D5_7BA469D65E296DA4_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC(=CC=C2)C(=O)O""",21,"""C0FA6E6C262C295A"""
+"""F342D987F8DF83E2_99A89CD76B182227_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C3=C2[NH]C=CC2=CC=C3""",21,"""C0FA6E6C262C295A"""
+"""056ABDAABA3A4DCE_5A482987CA415330_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=C(C=C(C)C=C2F)F""",21,"""C0FA6E6C262C295A"""
+"""CEDA0785D01E7706_EEF3578F7D1A726B_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=CC3=NON=C23""",21,"""C0FA6E6C262C295A"""
+"""14ADA97051703A10_A98909D710102113_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=C(C(=C(C)C=C2)F)F""",21,"""C0FA6E6C262C295A"""
+"""551B4E2F58306E5D_E84242161A8D0C97_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C3=C[N]2C=NN=C2C=C3""",21,"""C0FA6E6C262C295A"""
+"""5F554ED0BFDB160C_0674A1DE98B3DF3B_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC(=C(C=C2)F)OC""",21,"""C0FA6E6C262C295A"""
+"""C85070F67CFA8A63_10A9E26F5F264047_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=C(C=C(C)C=C2C)C""",21,"""C0FA6E6C262C295A"""
+"""9FBA876AA9EF17E4_6562BD2018F226CB_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=C(OC)C=CC=C2F""",21,"""C0FA6E6C262C295A"""
+"""C9187338F43A8DF1_B5311D23162C11E7_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=C(C(N)=O)C=C2""",21,"""C0FA6E6C262C295A"""
+"""D86C3B42C78EC029_6F4E341FAC3BF452_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC(=C(OC)C=C2)F""",21,"""C0FA6E6C262C295A"""
+"""91C4C973CC0AA4D5_37E637DAFC56188E_6006_DP""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C3=C2[N](CCNC2)N=C3""",21,"""C0FA6E6C262C295A"""
+"""824872C79FC2F8D5_3BB7558207F04D95_6006_DP""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=CC(=C2)C(O)=O""",21,"""C0FA6E6C262C295A"""
+"""2947D24081888CCA_121C3FB4F5825DEE_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=CC(=C2F)OC""",21,"""C0FA6E6C262C295A"""
+"""B404D9854D7737C6_A58348CA3D739F86_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=C(C=CC(=C2)OC)C""",21,"""C0FA6E6C262C295A"""
+"""5B1F808D9278CB9D_B4DBE42D5C37EE8B_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C3=C2OC=CC2=CC=C3""",21,"""C0FA6E6C262C295A"""
+"""BE604DA865059076_0D2AE0885D49DABD_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=C(OC)C=C(C=C2)F""",21,"""C0FA6E6C262C295A"""
+"""03F717FF0C925CFB_0D77FCC003F24C74_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC(=C(OC)C=C2)C""",21,"""C0FA6E6C262C295A"""
+"""A4CEB53D0CF9DF28_1D309388B4FE23EB_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=C(C(C)O)C=C2""",21,"""C0FA6E6C262C295A"""
+"""3AC5095064CAFC97_15142F378BDA64CA_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=COC(=C2)C(F)(F)F""",21,"""C0FA6E6C262C295A"""
+"""BFC82DCD884C250D_0BE169B234483339_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC(=CS2)C(F)(F)F""",21,"""C0FA6E6C262C295A"""
+"""4BB942C700D2FDDC_88706B76B5A90522_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CN=C(N(C)C)N=C2""",21,"""C0FA6E6C262C295A"""
+"""0BF6ABBDE6DE8532_5DF182E283B2DDE1_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C3=CC2=C(C=CC=N2)S3""",21,"""C0FA6E6C262C295A"""
+"""80C80F8F06FF14B4_EA84025D8BC1DB99_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=C(C(=CC=C2O)F)F""",21,"""C0FA6E6C262C295A"""
+"""F6D0AA6D695421A0_0DC738D7DA87D883_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CSC3=C2C=CC=C3""",21,"""C0FA6E6C262C295A"""
+"""4596B25B99CBF20E_72C184621DB0AA14_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=C[N]3N=CC=C23""",21,"""C0FA6E6C262C295A"""
+"""D338B30EE0684BEC_CB6BADE39CF641A3_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CN=C(C=C2)C(F)F""",21,"""C0FA6E6C262C295A"""
+"""EF4D3C100BB53866_A07071E8BE91B12F_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC3=C(C=C2)CCO3""",21,"""C0FA6E6C262C295A"""
+"""4B85F87150A272CF_F6B30B1C8AEBE2AC_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=C(C=C2)[N](=O)=O""",21,"""C0FA6E6C262C295A"""
+"""5441A2B48E0BFC5C_0D7D0FB945C85737_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC3=C(C=C2)C=N[NH]3""",21,"""C0FA6E6C262C295A"""
+"""AC228C6741E5989A_A9C96C3934110575_6006_UN""","""C[Si](C)(C)C#CC1=CC(=CN=C1)C2=CC=C(S2)C(F)(F)F""",21,"""C0FA6E6C262C295A"""
+"""665B18B379B4DDA9_4DEECC637F2C0F19_6014_UN""","""C(#CC1=CC(=CN=C1)Cl)C(CNCC2=CC=C(Cl)C=C2)=C""",21,"""C0FA6E6C262C295A"""
+"""26438FFBA9012572_7DF4E5A9F36424A3_6014_UN""","""C(#CC1=CC(=CN=C1)Cl)C=CC2=CC=CC(=C2)C(F)(F)F""",21,"""C0FA6E6C262C295A"""
+"""76DF3E888F0AD7CB_C2EEEC177541FBA1_6014_UN""","""C(#CC1=CC(=CN=C1)Cl)C2=CC(N(CC(OC)=O)C=C2)=O""",21,"""C0FA6E6C262C295A"""
+"""A939122667E483B4_F541F0D7D648D99F_6014_UN""","""C(#CC1=CC(=CN=C1)Cl)C3=CC=C2C(=O)OCCN2C3=O""",21,"""C0FA6E6C262C295A"""
+"""2C49AC643C3A2CEB_2AE02E5CC2A4252B_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](CC)(=O)=O)CC(=O)OC""",21,"""C1346694BBB6BBA4"""
+"""3C544BD099BBE04F_09BD9BF87D67CDB6_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""C1346694BBB6BBA4"""
+"""B2830A71C1383A8A_23CAB481AFECD010_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C)[S](=O)(=O)C3=CC=C(Br)S3""",21,"""C1346694BBB6BBA4"""
+"""2C97C34C8713CFD5_717FA3686374658F_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3C4=C(C[S]3(=O)=O)C=CC=C4""",21,"""C1346694BBB6BBA4"""
+"""F48075AA18F9FEFC_103470CBD36F0675_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C)[S](=O)(=O)C3CCCNC3""",21,"""C1346694BBB6BBA4"""
+"""15614464FBF9FD02_26364CE1E10E4AC7_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C)[S](=O)(=O)CC3CCCN3""",21,"""C1346694BBB6BBA4"""
+"""B37D1F7BB5054CA6_02E90F5C4AB53AD1_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C)[S](=O)(=O)C3=CC=C(Cl)S3""",21,"""C1346694BBB6BBA4"""
+"""35AE3CEC45196A4D_CDCD3A480BE8F371_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C)(=O)=O)C3CCCNC3""",21,"""C1346694BBB6BBA4"""
+"""37593FDDAC4B1BBD_188A3DD1F86E4E3B_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C)(=O)=O)C3=NN=C(N)S3""",21,"""C1346694BBB6BBA4"""
+"""B2D0B97CFA4D75C6_A0CC09746EBE3340_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(CC)[S](=O)(=O)C3CCNC3""",21,"""C1346694BBB6BBA4"""
+"""011BD330D1EFE12F_656F874ED27E1CB9_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""C1346694BBB6BBA4"""
+"""457B5704278647E6_C034122A909B1B4E_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""C1346694BBB6BBA4"""
+"""A10BB118E5CA5EF4_CEA56560A9FD68C1_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""C1346694BBB6BBA4"""
+"""7779C48C40F99E20_203C08511EC2CEC1_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C)(=O)=O)CCNC3CC3""",21,"""C1346694BBB6BBA4"""
+"""25296CF38E745A91_9FA04D2ED7D64D69_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""C1346694BBB6BBA4"""
+"""7062C7AA6A77DDC6_282EBD5D95AAAB60_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C)[S](=O)(=O)C3CCNCC3""",21,"""C1346694BBB6BBA4"""
+"""4E6F1EEA14653E1F_86BCDE1D4FBDA4CF_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3[S](CCC3C(OC)=O)(=O)=O""",21,"""C1346694BBB6BBA4"""
+"""D0C60D23577683B1_9E980FF17D786878_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3[S](=O)(=O)C4=C(C3)C=CC=C4""",21,"""C1346694BBB6BBA4"""
+"""D2C274AF700D6D99_7ED446A720DAEB14_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C)(=O)=O)CC3=CC=NO3""",21,"""C1346694BBB6BBA4"""
+"""6EA86B6B4B827A8D_32BAFBA41CDCB730_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C)(=O)=O)C3CCNCC3""",21,"""C1346694BBB6BBA4"""
+"""0B5F087B34838CD9_4DA12EE583F87A5E_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C)(=O)=O)C3=NC=CC=C3""",21,"""C1346694BBB6BBA4"""
+"""BE13AC1311D28861_9DDE7DE7D9D752B8_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C)[S](=O)(=O)C3=CN=CC=C3""",21,"""C1346694BBB6BBA4"""
+"""C1BE52E3A2DD6791_4FEFAEB5B17BF2B0_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""C1346694BBB6BBA4"""
+"""DBAA93A596924F52_F4BE772EB9ECDDF4_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C)[S](=O)(=O)C3=C[N](C)C=N3""",21,"""C1346694BBB6BBA4"""
+"""108FA8483E85889C_061F2C3DF1F703CE_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3CCCC(C(C)C)[S]3(=O)=O""",21,"""C1346694BBB6BBA4"""
+"""8E921B745A14C0A5_260B38B4F13743F2_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C)(=O)=O)CC3CNCC3""",21,"""C1346694BBB6BBA4"""
+"""162037C9F91E39CD_1A7783A2A6C2EC44_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C)(=O)=O)[C@@H]3CNCCC3""",21,"""C1346694BBB6BBA4"""
+"""0FDF285E7C2B7B0A_133F9E3BDBC49D3B_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(CCCCl)[S](=O)(=O)C3CC3""",21,"""C1346694BBB6BBA4"""
+"""CE73E22F10992875_B10A47E3A61335B0_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3C(=O)C4=C([S]3(=O)=O)C=CS4""",21,"""C1346694BBB6BBA4"""
+"""067D4D57FD68002F_A01E94C0B5660684_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""C1346694BBB6BBA4"""
+"""9807521B7CEFC2A3_55A8AAEC4FFDE8BF_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(CCCN)[S](=O)(=O)C3CC3""",21,"""C1346694BBB6BBA4"""
+"""07248D753AF53E36_69AC9EF507EAFED1_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3CCCC(CC=C)[S]3(=O)=O""",21,"""C1346694BBB6BBA4"""
+"""96C297DE30BD8195_80DAA4D216C4348E_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(CCCN)[S](=O)(=O)C(F)F""",21,"""C1346694BBB6BBA4"""
+"""19DD8CB67219E1A4_73DA0E3F8CDBDB5A_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3[S](C4(CC3CI)CC4)(=O)=O""",21,"""C1346694BBB6BBA4"""
+"""997CF64FF9EEA9DD_7AB41EDC75CE44E5_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3CCCCNCC[S]3(=O)=O""",21,"""C1346694BBB6BBA4"""
+"""CD8BEA70F76309C9_0EECD97F76E7984D_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3[S](=O)(=O)C4(C3)CCOCC4""",21,"""C1346694BBB6BBA4"""
+"""94C58164D697478B_E137296BA08B573B_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3C(CN)CC4([S]3(=O)=O)CC4""",21,"""C1346694BBB6BBA4"""
+"""FB9177FCF8349461_46C90623632C4421_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](=O)(=O)C3CC3)C4CNC4""",21,"""C1346694BBB6BBA4"""
+"""C30EF6D259D70AFE_7E8EF772BB9D562E_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N3CC4(C[S]3(=O)=O)CCCC4""",21,"""C1346694BBB6BBA4"""
+"""95264019F9AD88C3_D4D0F57862403B88_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](=O)(=O)C3CNC3)C4CC4""",21,"""C1346694BBB6BBA4"""
+"""FFF5883B4DCAB33E_707273A03C2CD2F3_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""C1346694BBB6BBA4"""
+"""2C12EBD1D706D842_603EADDC652B1916_6036_UN""","""NC1=CC2=C(C=C1)CC(C2)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""C1346694BBB6BBA4"""
+"""1A5D994CCDE49B02_369F69DEDBE0D567_2267_UN""","""N[C@@H](CC#CC1=CC=C(C(CCC(O)=O)=O)C=C1)C(=O)O""",21,"""C175B9C8225F547E"""
+"""8914F8929B3BC633_A84CE08834178234_2267_UN""","""N[C@@H](CC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O)C(=O)O""",21,"""C175B9C8225F547E"""
+"""C498CDFEED393AB9_4CB213CBD6279F91_2267_UN""","""N[C@@H](CC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O)C(=O)O""",21,"""C175B9C8225F547E"""
+"""BE7DDC3AFB253792_2B84E52565B91C1A_2267_UN""","""N[C@@H](CC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2)C(=O)O""",21,"""C175B9C8225F547E"""
+"""9E7638C518A72E28_A0054ED7E3ABD50B_2267_UN""","""N[C@@H](CC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O)C(=O)O""",21,"""C175B9C8225F547E"""
+"""D76C6EC853FEA607_508E5C5055EF3D5E_2267_UN""","""N[C@@H](CC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2)C(=O)O""",21,"""C175B9C8225F547E"""
+"""9D4286FDFF2E4D7A_90815D8DDF3D61C5_2267_UN""","""N[C@@H](CC#CC1=CC=C(C=C1)C(=O)C2CCCO2)C(=O)O""",21,"""C175B9C8225F547E"""
+"""FC9EF43327BF8B51_D7E4C7F5A5AD46A9_2267_UN""","""N[C@@H](CC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F)C(=O)O""",21,"""C175B9C8225F547E"""
+"""5878F6837F335E5F_D8C997208B07C545_2267_UN""","""N[C@@H](CC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F)C(=O)O""",21,"""C175B9C8225F547E"""
+"""6C0BE58C9B4FC3CE_BE35A9EB2A12A823_2267_UN""","""N[C@@H](CC#CC1=C(C(NCC(O)=O)=O)C=CC=C1)C(=O)O""",21,"""C175B9C8225F547E"""
+"""CEA5DD001DBA5110_14E119ACA4D1B28C_2267_UN""","""N[C@@H](CC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C)C(=O)O""",21,"""C175B9C8225F547E"""
+"""51D2900E2EEC6458_F4654AA1EC33EA52_2267_UN""","""N[C@@H](CC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2)C(=O)O""",21,"""C175B9C8225F547E"""
+"""2E53913EC0D8488F_914E855707A06C5B_2267_UN""","""N[C@@H](CC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F)C(=O)O""",21,"""C175B9C8225F547E"""
+"""FABB58F6A653DEDB_5364B1E9EC30A609_2267_UN""","""N[C@@H](CC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2)C(=O)O""",21,"""C175B9C8225F547E"""
+"""2F598E26D5DF11E1_EDA98E004A3BB186_2267_UN""","""N[C@@H](CC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O)C(=O)O""",21,"""C175B9C8225F547E"""
+"""A484D81F674086EA_C5429F48507EDA8B_2267_UN""","""N[C@@H](CC#CC1=C(C(OCC)=O)C=N[N]1C(C)C)C(=O)O""",21,"""C175B9C8225F547E"""
+"""036BB3D6530198D7_063D69A152F601B5_2267_UN""","""N[C@@H](CC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N)C(=O)O""",21,"""C175B9C8225F547E"""
+"""D6BFB08C68D3A08C_D32D4B1DC3BE9FE6_2267_UN""","""N[C@@H](CC#CC2=CC=C(CC1(C)NCCC1)C=C2)C(=O)O""",21,"""C175B9C8225F547E"""
+"""9352F79AB93FB98A_709302104D27F88A_2267_UN""","""N[C@@H](CC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12)C(=O)O""",21,"""C175B9C8225F547E"""
+"""8CBA025C736B92C7_5B9CAF04B259B2A9_2267_UN""","""N[C@@H](CC#CC1=C(C)C=C(C(=C1)C)C2OCCO2)C(=O)O""",21,"""C175B9C8225F547E"""
+"""E3D342D7D69CAA51_B711DE27C2619B74_2267_UN""","""N[C@@H](CC#CC1=CC=C(C=C1)C2NCCNC2=O)C(=O)O""",21,"""C175B9C8225F547E"""
+"""A92AEA4EC2D5B2E0_4DACC51BFC49E772_2267_UN""","""N[C@@H](CC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2)C(=O)O""",21,"""C175B9C8225F547E"""
+"""80A8ED7B9ED82395_EBC0517EDE8C20B6_2267_UN""","""N[C@@H](CC#CC(B1OC(CN(C)CC(O1)=O)=O)=C)C(=O)O""",21,"""C175B9C8225F547E"""
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+"""B9169E0C8BC70941_DD3912BB6055B1CA_6031_DP""","""O(C(=O)CC(CN)CC1=CC=CC=C1)C[C@@H]2C[C@H](N)C=C2""",21,"""C75F238BECC7103C"""
+"""F5972E062D19B556_9433B251BC899FAE_6031_DP""","""O(C(=O)CC(CN)CC1=CC=CC=C1)C[C@H]2CCCNC2""",21,"""C75F238BECC7103C"""
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+"""62872C6703F6E6FF_DF6A713B5D4F4F36_2267_UN""","""CC1=C(SC=N1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""C9FB0F06DABD5DE1"""
+"""DC52572CE3D602BC_D04721EE73E5CCDA_2267_UN""","""CC1=C(SC=N1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""C9FB0F06DABD5DE1"""
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+"""D26EEFAB3C01332D_B84E88E7FFFDA610_7019_UN""","""CC(C)OC(=O)OC=CC1=C(Cl)N=C(S1)N2CCOCC2""",21,"""CC26F8F311B2BDB8"""
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+"""F822AC4AB64D13C0_B0FD8610E9612752_7019_UN""","""CC(C)OC(=O)OC=CC1=C(Cl)[N](N=C1)C2=CC=CC=C2""",21,"""CC26F8F311B2BDB8"""
+"""C1EA5BC98BB063C7_76F288F80BE3CD83_7019_UN""","""CC(C)OC(=O)OC=CC1=C(Cl)[NH]C2=C1C=C(C(=C2)Cl)Cl""",21,"""CC26F8F311B2BDB8"""
+"""8927D503BF709294_2B58E5A978B8AD91_7019_UN""","""CC(C)OC(=O)OC=CC1=C(C=C(Cl)C=C1)[N]2C=NC=N2""",21,"""CC26F8F311B2BDB8"""
+"""D1CD0D762B1B75B4_9F0E9B34E4C4E529_7019_UN""","""CC(C)OC(=O)OC=CC2=CC=C(C1=C(Cl)C=CC=C1)O2""",21,"""CC26F8F311B2BDB8"""
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+"""710AD4708861B2B6_C7495B2D1E650FA3_7019_UN""","""CC(C)OC(=O)OC=CC1=C(C(=C(F)C=C1)C(F)(F)F)Cl""",21,"""CC26F8F311B2BDB8"""
+"""909F2242FBDA1299_21CB5BDCF634F118_7019_UN""","""CC(C)OC(=O)OC=CC1=C(C=C(OC)C=C1CCl)OC""",21,"""CC26F8F311B2BDB8"""
+"""209107D3DC04D20B_A30DF7BB20959D57_7019_UN""","""CC(C)OC(=O)OC=CC1=CC(=C(OC(F)(F)F)C=C1)Cl""",21,"""CC26F8F311B2BDB8"""
+"""D9FA620E477FB3D8_F42CD3C018E3EE49_7019_UN""","""CC(C)OC(=O)OC=CC1=C(Cl)C=CC=C1[N]2C=CN=C2""",21,"""CC26F8F311B2BDB8"""
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+"""05C41FBDDF8C85AC_146CD68842EB4298_7019_UN""","""CC(C)OC(=O)OC=CC1=C(Cl)C=CC=C1[N]2C=CC=N2""",21,"""CC26F8F311B2BDB8"""
+"""3BF18703843CB84D_3EAC36D61CB724C4_1171_DP""","""CNCCC1=NC(=CS1)C2=CC=C(NC(CCC)=O)C=C2""",21,"""CC564B7B3D30F5DF"""
+"""C5AA0183DBC0317A_13C3C2E5A16492CA_1171_DP""","""CNCCC1=NC(=CS1)C2=C([N](CCCOC)C(=C2)C)C""",21,"""CC564B7B3D30F5DF"""
+"""BB17AFE42F4BA0C6_E67B7C6C900D6B42_1171_DP""","""CNCCC1=NC(=CS1)C2=C([NH]C(=C2C(OCC)=O)C)C""",21,"""CC564B7B3D30F5DF"""
+"""7F31D7F162908CCB_E18F57AA58A721A4_1171_DP""","""CNCCC1=NC(=CS1)C2=CC=C(CCCCCC)C=C2""",21,"""CC564B7B3D30F5DF"""
+"""68134BACB1F997D7_89A78A6F34B501D3_1171_DP""","""CNCCC1=NC(=C(C)S1)C2=C(C(=C(C)[NH]2)C(OC)=O)C""",21,"""CC564B7B3D30F5DF"""
+"""32897025D6E12126_B4598EE5A69E0A19_1171_DP""","""CNCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NC=N[NH]3""",21,"""CC564B7B3D30F5DF"""
+"""03F6A831F71E5602_7A21F35F3B434A5B_1171_DP""","""CNCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)C3=NOC=C3""",21,"""CC564B7B3D30F5DF"""
+"""A7049E0B10BFA899_463BA9DC72D6F219_1171_DP""","""CNCCC1=NC(=CS1)C2=CC(=C(C=C2)OC(F)F)OC""",21,"""CC564B7B3D30F5DF"""
+"""14FF99777861D440_ABAEA2829BE7225A_1171_DP""","""CNCCC1=NC(=CS1)C2=CC=C(CCN[S](C)(=O)=O)S2""",21,"""CC564B7B3D30F5DF"""
+"""2AA6FEFDB66373EF_5F0068E9220A25AD_1171_DP""","""CNCCC1=NC(=CS1)C2=C(C(=C(C)[NH]2)C(OCC)=O)C""",21,"""CC564B7B3D30F5DF"""
+"""C839F1AFF2394190_539C465D14F5C0E3_1171_DP""","""CNCCC1=NC(=CS1)C2=CC=C(C(C)NC(=O)C)C=C2""",21,"""CC564B7B3D30F5DF"""
+"""EE574C9133A16AD5_D4086B6F6A3B6720_1171_DP""","""CNCCC1=NC(=CS1)C2=C([N](CCC(C)C)C(=C2)C)C""",21,"""CC564B7B3D30F5DF"""
+"""87B4A25C5856C401_B183A522A8423123_1171_DP""","""CNCCC1=NC(=CS1)C2=C(C)[N](C(=C2)C)CC(F)(F)F""",21,"""CC564B7B3D30F5DF"""
+"""1FD81E196E149A21_8FAC39224F02A954_1171_DP""","""CNCCC1=NC(=CS1)C2=C(C=C(C(C)C)C=C2)C(C)C""",21,"""CC564B7B3D30F5DF"""
+"""68DF1107B4A3C9A4_E723FA2D9414DE67_1171_DP""","""CNCCC1=NC(=CS1)C2=CC=C(NC(C(C)C)=O)C=C2""",21,"""CC564B7B3D30F5DF"""
+"""CEFC70397AD3E520_792C60E4502033FB_1171_DP""","""CNCCC1=NC(=CS1)C3=C(F)C=C2NC(CCC2=C3)=O""",21,"""CC564B7B3D30F5DF"""
+"""3D898ACC638F3C28_B313C5E47E1CCDAF_1171_DP""","""CNCCC1=NC(=CS1)C3=CC2=C(OC(C)C(N2)=O)C=C3""",21,"""CC564B7B3D30F5DF"""
+"""63A755667C57DA23_FE0452C79A90A127_1171_DP""","""CNCCC1=NC(=CS1)C3=CC2=C(NC(C2(C)C)=O)C=C3""",21,"""CC564B7B3D30F5DF"""
+"""6F38C5619A10783E_C8940E7E6C9F73DD_1171_DP""","""CNCCC1=NC(=CS1)C2=CC(=C(SC)C=C2)NC(=O)C""",21,"""CC564B7B3D30F5DF"""
+"""A5888E3FA61DC872_2C35942310A9AA14_1171_DP""","""CNCCC1=NC(=CS1)C2=CC=C(N(C)[S](=O)(=O)C)C=C2""",21,"""CC564B7B3D30F5DF"""
+"""121CE0C70B6C0FF7_4D2F89403AAAE0A5_1171_DP""","""CNCCC1=NC(=CS1)C3=CC2=C(N(C)C(=O)CC2)C=C3""",21,"""CC564B7B3D30F5DF"""
+"""5AC3ECCD04009FDC_CC78AFE3DDE12F75_1171_DP""","""CNCCC1=NC(=CS1)C3=C[N](C2=CC=CC(=C2)C)N=N3""",21,"""CC564B7B3D30F5DF"""
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+"""7A45A084FD5318E3_89EC9867E920A5F6_1171_DP""","""CNCCC1=NC(=CS1)C2=CC=C([S](N(C)C)(=O)=O)C=C2""",21,"""CC564B7B3D30F5DF"""
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+"""6F5B628BF0609BEB_3AC5BF277C1EC3EA_1171_DP""","""CNCCC1=NC(=CS1)C2=CC=C(CN(C)C(=O)C)C=C2""",21,"""CC564B7B3D30F5DF"""
+"""ED302F1037AE71A1_81437D9938B90F84_1171_DP""","""CNCCC1=NC(=CS1)C2=CC(=NO2)C3=CC=C(F)C=C3""",21,"""CC564B7B3D30F5DF"""
+"""281116E8893D31D0_C05C3B85E019A046_1171_DP""","""CNCCC2=NC(=C(CC1=CC=CC=C1)S2)C(OCC)=O""",21,"""CC564B7B3D30F5DF"""
+"""1EDEEFAE89297F87_347BEC0C8564A0B8_1171_DP""","""CNCCC1=NC(=CS1)C2=C([N](CC(OC)=O)C(=C2)C)C""",21,"""CC564B7B3D30F5DF"""
+"""2FD89876B12794F2_3031CFF65541188A_1171_DP""","""CNCCC1=NC(=CS1)C2=CC=CC(=C2)[S](N(C)C)(=O)=O""",21,"""CC564B7B3D30F5DF"""
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+"""933D0715150420C0_3F9AC007C01D8FCB_1171_DP""","""CNCCC1=NC(=CS1)C2=C(C)[N](N=C2)C3=CC=CC=C3""",21,"""CC564B7B3D30F5DF"""
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+"""5B3339E47C4053C6_977E6CE7F9B60322_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC(CC=CC)N""",21,"""CE3B1C1DFBB7F536"""
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+"""4B181D60200CDB0B_15C2E770A5A3E9C9_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC2(N)CCCC2""",21,"""CE3B1C1DFBB7F536"""
+"""712FC93A296517B6_967B696DC7D01D78_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)C[C@@H]2CCCNC2""",21,"""CE3B1C1DFBB7F536"""
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+"""376F1F25C4F3FF48_B85A2B2567916EB3_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC2COCCN2""",21,"""CE3B1C1DFBB7F536"""
+"""C219DF4208171F69_02C43370245DC45F_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC(CCN)(C)C""",21,"""CE3B1C1DFBB7F536"""
+"""5AD85609FB4ADA91_89C784DC404C37DD_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC2(CCNC2)C""",21,"""CE3B1C1DFBB7F536"""
+"""598CDAD755A9DA3E_393E6E6E81C3BD71_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC23CC(N)(C2)C3""",21,"""CE3B1C1DFBB7F536"""
+"""1AE949D5B3F35B5A_7460A68AF1DDCF0E_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CCCNC2CC2""",21,"""CE3B1C1DFBB7F536"""
+"""1EA3169996E4A8FD_56D652C2AF267393_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC(=C2CNC2)F""",21,"""CE3B1C1DFBB7F536"""
+"""5758032E4047926E_0506B21E70C2D71C_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC[C@H]2CCCN2""",21,"""CE3B1C1DFBB7F536"""
+"""439215867487E78B_065BD4DF438BDE36_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)C[C@H]2CC[C@@H](N)C2""",21,"""CE3B1C1DFBB7F536"""
+"""20944B9F36CDAD15_5BAD56E06D516DAA_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)C[C@H]2COC[C@H]2N""",21,"""CE3B1C1DFBB7F536"""
+"""D47C076FB1906989_188AB2525A823A19_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)C[C@H]2CCC[C@H]2N""",21,"""CE3B1C1DFBB7F536"""
+"""3442C6494743D106_3CA0C17E57959541_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC2C(CN2)(C)C""",21,"""CE3B1C1DFBB7F536"""
+"""A7BD2A9635E08E2D_40ED6D02039AB8F4_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CCCNC(C)C""",21,"""CE3B1C1DFBB7F536"""
+"""F3D3CE3663D7627B_E83673EE1B7BEF14_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CCC2(CN)CC2""",21,"""CE3B1C1DFBB7F536"""
+"""7BA685C771E229BF_FB82565DB568B17E_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC(C(C)C)ON""",21,"""CE3B1C1DFBB7F536"""
+"""C4BB758FD5D01857_D31EAC5DDD72FC38_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC(C(C)C)CN""",21,"""CE3B1C1DFBB7F536"""
+"""3D8034A09DC857D8_E32CBDE42E1F2A15_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC2=CNCCO2""",21,"""CE3B1C1DFBB7F536"""
+"""D1E6C5C0605DE007_DB73527FF6C2AEAD_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC2=CNCCC2""",21,"""CE3B1C1DFBB7F536"""
+"""A0C93E05515CC82D_B64E8F042CB92DAC_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CCC2CC(N)C2""",21,"""CE3B1C1DFBB7F536"""
+"""D77F80B485436542_D09B4C32E1623CEF_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)C[C@@H]2COCCN2""",21,"""CE3B1C1DFBB7F536"""
+"""494B737720452480_2F9FC8F1604B99F7_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CCCC(CC)N""",21,"""CE3B1C1DFBB7F536"""
+"""292F7069C2CBBD0B_396AE39ED4AB4DE2_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC2(CN)COC2""",21,"""CE3B1C1DFBB7F536"""
+"""C34F88484FA3445C_12746F039A71F922_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CCCCCCN""",21,"""CE3B1C1DFBB7F536"""
+"""2E9C70211FB786B6_19E132AE2046EFF4_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC2[C@@H]3CNC[C@H]23""",21,"""CE3B1C1DFBB7F536"""
+"""10D8CEDEE0F2A85D_C135ACB57F4ED0D6_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC2(CNC2)C#N""",21,"""CE3B1C1DFBB7F536"""
+"""1DA82DA718449C2C_D45D2D2D772554C0_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)C[C@@H]2C[C@H](N)C=C2""",21,"""CE3B1C1DFBB7F536"""
+"""B7083C8A793F155E_9D578DC7ABF97AA4_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)C[C@H]2CCCNC2""",21,"""CE3B1C1DFBB7F536"""
+"""BFF38307D1B9AD13_342B09BD6900D51E_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CC2CC(NC)C2""",21,"""CE3B1C1DFBB7F536"""
+"""27DE970025ECCE74_6494F907C56F8ED3_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)CCC2CCNC2""",21,"""CE3B1C1DFBB7F536"""
+"""B8B6222308382731_8FCFB49F31023681_6031_DP""","""O(C(=O)C(CN)CC1=CC(=CC=C1)F)C[C@@H]2OCCNC2""",21,"""CE3B1C1DFBB7F536"""
+"""E19B201219066E23_279CE40D3920F691_2267_UN""","""CC(=O)NCCC#CC1=CC=C(C(CCC(O)=O)=O)C=C1""",21,"""D076341BC09F7788"""
+"""67CABD297C80D2D3_B94F6D5BD6D7A1C2_2267_UN""","""CC(=O)NCCC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O""",21,"""D076341BC09F7788"""
+"""6C12DCF3DADD4D04_5DB19E1834E7BC67_2267_UN""","""CC(=O)NCCC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""D076341BC09F7788"""
+"""92CAF74BC5CF1ABC_3A8768F687793FEC_2267_UN""","""CC(=O)NCCC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""D076341BC09F7788"""
+"""114847072994D7F1_B106C304016BF6FD_2267_UN""","""CC(=O)NCCC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""D076341BC09F7788"""
+"""EAD11EAD009DBD74_418DD183B72F1EA8_2267_UN""","""CC(=O)NCCC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""D076341BC09F7788"""
+"""B956E9131DF20199_8182D05E3DFD4233_2267_UN""","""CC(=O)NCCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""D076341BC09F7788"""
+"""958AD1057C90781E_C6E74A26476D655F_2267_UN""","""CC(=O)NCCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""D076341BC09F7788"""
+"""E631FD79032E5580_C9CA1AF369C7E6B3_2267_UN""","""CC(=O)NCCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""D076341BC09F7788"""
+"""7D3A30D47FEDC9CB_AF362438C8D28BD5_2267_UN""","""CC(=O)NCCC#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""D076341BC09F7788"""
+"""C4DA184DF02A1438_05E2947F4611917A_2267_UN""","""CC(=O)NCCC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""D076341BC09F7788"""
+"""79DCE455C26DCFE8_E566C7720EF3C9A4_2267_UN""","""CC(=O)NCCC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""D076341BC09F7788"""
+"""FCC2C4AE5A27DA59_804D0884E5604FAD_2267_UN""","""CC(=O)NCCC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""D076341BC09F7788"""
+"""EBE101453BABA03E_42673C3A0EF085FF_2267_UN""","""CC(=O)NCCC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2""",21,"""D076341BC09F7788"""
+"""4FBA66015E6A153E_FCAA03D3A8FB9270_2267_UN""","""CC(=O)NCCC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""D076341BC09F7788"""
+"""05800AF2A83DDB9D_D441129BB2BEF97D_2267_UN""","""CC(=O)NCCC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""D076341BC09F7788"""
+"""5C561A85B0CB0448_173EE472B0362243_2267_UN""","""CC(=O)NCCC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""D076341BC09F7788"""
+"""A2F13F902B36EB2F_C22EC6CE217EBC10_2267_UN""","""CC(=O)NCCC#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""D076341BC09F7788"""
+"""0A80AD8A7908C9AC_61908FC3AFE7DB7C_2267_UN""","""CC(=O)NCCC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""D076341BC09F7788"""
+"""3EA94A2BFBB8AAC9_4A9F22D75099915F_2267_UN""","""CC(=O)NCCC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""D076341BC09F7788"""
+"""8D618E37C8F3067B_A61253F420A1B882_2267_UN""","""CC(=O)NCCC#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""D076341BC09F7788"""
+"""640BD9D6B150A45A_5CAF48C81E89C484_2267_UN""","""CC(=O)NCCC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""D076341BC09F7788"""
+"""26E65CFAF8C24B80_FAC3DCAD3C4C0340_2267_UN""","""CC(=O)NCCC#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""D076341BC09F7788"""
+"""8B51B4C338E22857_70AEEDA23BC28814_2267_UN""","""CC(=O)NCCC#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""D076341BC09F7788"""
+"""5D6529243E4D8537_AC382D705E09725F_2267_UN""","""CC(=O)NCCC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""D076341BC09F7788"""
+"""5D09290BD235B418_1A2AB9765AEE1DF3_2267_UN""","""CC(=O)NCCC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""D076341BC09F7788"""
+"""8E692574867D26D0_1F27200D32197A66_2267_UN""","""CC(=O)NCCC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""D076341BC09F7788"""
+"""7A41414CE1D2C787_E6E2E84580C1D44C_2267_UN""","""CC(=O)NCCC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""D076341BC09F7788"""
+"""B5F7819444D00950_C238EC9FD66FDFC4_2267_UN""","""CC(=O)NCCC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""D076341BC09F7788"""
+"""0CB64E782B5EC68C_B550518D11BAB5B3_2267_UN""","""CC(=O)NCCC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""D076341BC09F7788"""
+"""626E7DEA6B228353_631BB5AFD9656C82_2267_UN""","""CC(=O)NCCC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""D076341BC09F7788"""
+"""963561EC9C67C033_47844A47E19BB639_2267_UN""","""CC(=O)NCCC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""D076341BC09F7788"""
+"""3A8A6147D1521902_C894BDDB2017D7B0_2267_UN""","""CC(=O)NCCC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""D076341BC09F7788"""
+"""0A15C39F30BCDE7B_8181906AAFBFC8A3_2267_UN""","""CC(=O)NCCC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""D076341BC09F7788"""
+"""A347944CA09965C2_5DA5AA089038F629_2267_UN""","""CC(=O)NCCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""D076341BC09F7788"""
+"""96AAD50804EA8C08_9217BEFE87A01B98_2267_UN""","""CC(=O)NCCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""D076341BC09F7788"""
+"""53FE4D05D9575F78_D63D495B108ECF4E_2267_UN""","""CC(=O)NCCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""D076341BC09F7788"""
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+"""BD01FDFBDE980784_9018EBA4BAC76F78_2267_UN""","""CC1=C(N=CO1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""D2796141FDF80368"""
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+"""262843ADAE752A51_BBE4DD2B422219B3_2267_UN""","""COC(=O)CCC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O""",21,"""D2DD846B546ACFF9"""
+"""1383726B5E6243A6_5F1A2E68A0120416_2267_UN""","""COC(=O)CCC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""D2DD846B546ACFF9"""
+"""C1C980EFEE5DB4E1_382CD886138C879D_2267_UN""","""COC(=O)CCC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""D2DD846B546ACFF9"""
+"""9B491784647F98B3_B3AD7374959E4E8C_2267_UN""","""COC(=O)CCC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""D2DD846B546ACFF9"""
+"""214462D9813DB50D_432661F323DAA6D9_2267_UN""","""COC(=O)CCC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""D2DD846B546ACFF9"""
+"""8394F2C3E6D8E4B2_8329602EA908FA42_2267_UN""","""COC(=O)CCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""D2DD846B546ACFF9"""
+"""27B10CE41EB05B38_C44CFA56D398DD2E_2267_UN""","""COC(=O)CCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""D2DD846B546ACFF9"""
+"""2BA09002FEE94D66_CB61AA83FD325EC2_2267_UN""","""COC(=O)CCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""D2DD846B546ACFF9"""
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+"""664E74C526249881_82E6B8F47195F7DC_2267_UN""","""COC(=O)CCC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""D2DD846B546ACFF9"""
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+"""F45643C51032200F_FE01B3A33C0E2A01_2267_UN""","""COC(=O)CCC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""D2DD846B546ACFF9"""
+"""44680A4BB1761969_D6EAA2EB264B410C_2267_UN""","""COC(=O)CCC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""D2DD846B546ACFF9"""
+"""EBD086D6E20D8649_1595540224C39A32_2267_UN""","""COC(=O)CCC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""D2DD846B546ACFF9"""
+"""AF716EFC8EC37A71_C08576BEB58B0461_2267_UN""","""COC(=O)CCC#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""D2DD846B546ACFF9"""
+"""969334FFE58EEC3B_633B3FB33B12630D_2267_UN""","""COC(=O)CCC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""D2DD846B546ACFF9"""
+"""DD49CB176B452BDC_483492A7C46C292E_2267_UN""","""COC(=O)CCC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""D2DD846B546ACFF9"""
+"""31C4F5368EEDFECE_A4B9E384B45400F3_2267_UN""","""COC(=O)CCC#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""D2DD846B546ACFF9"""
+"""84FAF600D19B849E_5E04F8B88A7C7CF5_2267_UN""","""COC(=O)CCC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""D2DD846B546ACFF9"""
+"""5ECDD10CA6F96C20_F8686CDDA8B9BB31_2267_UN""","""COC(=O)CCC#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""D2DD846B546ACFF9"""
+"""2DEF1D41DB050E2F_72055DD2AF373065_2267_UN""","""COC(=O)CCC#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""D2DD846B546ACFF9"""
+"""BE44C7A06301B1E9_AE939D00CAFCCA2E_2267_UN""","""COC(=O)CCC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""D2DD846B546ACFF9"""
+"""59AD4B29957528A1_18810906CE1BA582_2267_UN""","""COC(=O)CCC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""D2DD846B546ACFF9"""
+"""5BC7E51576D22455_1D8C907DA6ECC217_2267_UN""","""COC(=O)CCC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""D2DD846B546ACFF9"""
+"""B293086C97EF537D_E449583514346C3D_2267_UN""","""COC(=O)CCC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""D2DD846B546ACFF9"""
+"""FCB57D6DA8167B96_C0935CEF429A67B5_2267_UN""","""COC(=O)CCC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""D2DD846B546ACFF9"""
+"""E21B2D2FAB8229F3_B7FBE1FD854F0DC2_2267_UN""","""COC(=O)CCC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""D2DD846B546ACFF9"""
+"""E4E91475E9A2F42C_61B005DF4D90D4F3_2267_UN""","""COC(=O)CCC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""D2DD846B546ACFF9"""
+"""3789B786C7C74C70_452FFA37756E0E48_2267_UN""","""COC(=O)CCC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""D2DD846B546ACFF9"""
+"""DC2CD429300305C9_CA3F0DABB4E26FC1_2267_UN""","""COC(=O)CCC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""D2DD846B546ACFF9"""
+"""8A858F8A39A8C794_832A201A3B4A70D2_2267_UN""","""COC(=O)CCC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""D2DD846B546ACFF9"""
+"""5DC816EF934D7D71_5F0E1A7804CD4E58_2267_UN""","""COC(=O)CCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""D2DD846B546ACFF9"""
+"""31D0C6DB695F563F_90BC0E8E1355A3E9_2267_UN""","""COC(=O)CCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""D2DD846B546ACFF9"""
+"""268B6543649795B6_D496F92B847B773F_2267_UN""","""COC(=O)CCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""D2DD846B546ACFF9"""
+"""5DB0466A85F502B0_AF3077766C0B526F_2267_UN""","""COC(=O)CCC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""D2DD846B546ACFF9"""
+"""EA740A618D27850A_9D96CFEE17E47A35_2267_UN""","""COC(=O)CCC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""D2DD846B546ACFF9"""
+"""7681A420E99E4032_A8B5C7292191013A_2267_UN""","""COC(=O)CCC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""D2DD846B546ACFF9"""
+"""3F24D2E0FCA81012_F0070D73E1CDF42F_2267_UN""","""COC(=O)CCC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""D2DD846B546ACFF9"""
+"""AB7D31D654119107_A8617A1DFF9F0DB6_2267_UN""","""COC(=O)CCC#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""D2DD846B546ACFF9"""
+"""467D445307099CF0_24A57FBEDD880711_2267_UN""","""CCC(N)(CC)C#CC1=CC=C(C(CCC(O)=O)=O)C=C1""",21,"""D34FAFA824378608"""
+"""55ED8199F935AFA8_BA76F6E8327F5042_2267_UN""","""CCC(N)(CC)C#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O""",21,"""D34FAFA824378608"""
+"""25E000B4068AE428_5E8805ABD04F4DE7_2267_UN""","""CCC(N)(CC)C#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""D34FAFA824378608"""
+"""DD663AC81A59171B_39BEF34563D1CE6C_2267_UN""","""CCC(N)(CC)C#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""D34FAFA824378608"""
+"""32EA4BF3286B5F5E_B23F58B7E5C3077D_2267_UN""","""CCC(N)(CC)C#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""D34FAFA824378608"""
+"""1A42E91E5024FEE4_42B44A305387EF28_2267_UN""","""CCC(N)(CC)C#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""D34FAFA824378608"""
+"""789943254DC2150B_82BB4BEDD955B3B3_2267_UN""","""CCC(N)(CC)C#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""D34FAFA824378608"""
+"""E89C77B81CE04557_C5DED195A3C594DF_2267_UN""","""CCC(N)(CC)C#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""D34FAFA824378608"""
+"""7B7E9806CFAD1CF7_CAF381408D6F1733_2267_UN""","""CCC(N)(CC)C#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""D34FAFA824378608"""
+"""F98737EE0FD8B11D_AC0FBF8B2C7A7A55_2267_UN""","""CCC(N)(CC)C#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""D34FAFA824378608"""
+"""FC35DC9427D6C70B_06DB0FCCA2B960FA_2267_UN""","""CCC(N)(CC)C#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""D34FAFA824378608"""
+"""194F220D723CE6BE_E65F5CC1EA5B3824_2267_UN""","""CCC(N)(CC)C#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""D34FAFA824378608"""
+"""681205BC7851FA4E_8374933701C8BE2D_2267_UN""","""CCC(N)(CC)C#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""D34FAFA824378608"""
+"""61BD3DF469495528_415EA789EA58747F_2267_UN""","""CCC(N)(CC)C#CC2=C1CCC(C(OC)=O)CC1=N[NH]2""",21,"""D34FAFA824378608"""
+"""4990FBF2D686979E_FF9398604C5363F0_2267_UN""","""CCC(N)(CC)C#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""D34FAFA824378608"""
+"""C5710D1FF0F7D997_D7788928561608FD_2267_UN""","""CCC(N)(CC)C#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""D34FAFA824378608"""
+"""5F0668CE1D3F6204_14077FC1549ED3C3_2267_UN""","""CCC(N)(CC)C#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""D34FAFA824378608"""
+"""6F97C1D01142D80A_C1175D7DC5D64D90_2267_UN""","""CCC(N)(CC)C#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""D34FAFA824378608"""
+"""61585BB885AF5352_62A914704B4F2AFC_2267_UN""","""CCC(N)(CC)C#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""D34FAFA824378608"""
+"""67E0352B5F73D33E_49A6B964B43160DF_2267_UN""","""CCC(N)(CC)C#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""D34FAFA824378608"""
+"""AB29F0F086D597FC_A52BC847C4094902_2267_UN""","""CCC(N)(CC)C#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""D34FAFA824378608"""
+"""0F784F105E52139B_5F96D37BFA213504_2267_UN""","""CCC(N)(CC)C#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""D34FAFA824378608"""
+"""58F05051515735A6_F9FA471ED8E4F2C0_2267_UN""","""CCC(N)(CC)C#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""D34FAFA824378608"""
+"""CA7E82C1EF21D5EC_73977611DF6A7994_2267_UN""","""CCC(N)(CC)C#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""D34FAFA824378608"""
+"""5E50FE25BAAC4892_AF01B6C3BAA183DF_2267_UN""","""CCC(N)(CC)C#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""D34FAFA824378608"""
+"""EEE12433DCFF238F_191322C5BE46EC73_2267_UN""","""CCC(N)(CC)C#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""D34FAFA824378608"""
+"""D7A7501922D01BEF_1C1EBBBED6B18BE6_2267_UN""","""CCC(N)(CC)C#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""D34FAFA824378608"""
+"""85F989603C06224F_E5DB73F6646925CC_2267_UN""","""CCC(N)(CC)C#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""D34FAFA824378608"""
+"""832E511A2FC8700A_C101772C32C72E44_2267_UN""","""CCC(N)(CC)C#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""D34FAFA824378608"""
+"""F70CF84328201CAD_B669CA3EF5124433_2267_UN""","""CCC(N)(CC)C#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""D34FAFA824378608"""
+"""A994489300209B97_60222E1C3DCD9D02_2267_UN""","""CCC(N)(CC)C#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""D34FAFA824378608"""
+"""A12AD1A41F5EBA06_44BDD1F4053347B9_2267_UN""","""CCC(N)(CC)C#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""D34FAFA824378608"""
+"""22A48F848CA17179_CBAD2668C4BF2630_2267_UN""","""CCC(N)(CC)C#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""D34FAFA824378608"""
+"""5F04F8B964B83BDE_82B80BD94B173923_2267_UN""","""CCC(N)(CC)C#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""D34FAFA824378608"""
+"""CAAB4A47B20D43F6_5E9C31BB749007A9_2267_UN""","""CCC(N)(CC)C#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""D34FAFA824378608"""
+"""4A918CA657835E1B_912E254D6308EA18_2267_UN""","""CCC(N)(CC)C#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""D34FAFA824378608"""
+"""22C37113410EF759_D504D2E8F4263ECE_2267_UN""","""CCC(N)(CC)C#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""D34FAFA824378608"""
+"""7C045D417705C62E_AEA25CB51C561B9E_2267_UN""","""CCC(N)(CC)C#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""D34FAFA824378608"""
+"""12371C2980DBF30A_9C04E42D67B933C4_2267_UN""","""CCC(N)(CC)C#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""D34FAFA824378608"""
+"""42F3AF4838C9FF23_A927ECEA51CC48CB_2267_UN""","""CCC(N)(CC)C#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""D34FAFA824378608"""
+"""E95100F8FD416790_F19526B09190BDDE_2267_UN""","""CCC(N)(CC)C#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""D34FAFA824378608"""
+"""093E3B2A6926832B_A9F351DE8FC24447_2267_UN""","""CCC(N)(CC)C#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""D34FAFA824378608"""
+"""44DDB5847B5CBCC5_3873A95D30977682_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](CC)(=O)=O)CC(=O)OC""",21,"""D3A7E1954985E80D"""
+"""7817691C127A058B_1B2E1CF98F549E1F_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""D3A7E1954985E80D"""
+"""7C8879B0955B7649_315933805DDF83B9_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""D3A7E1954985E80D"""
+"""55E3511A89146F83_63EC246991473626_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""D3A7E1954985E80D"""
+"""3DE94C92B42DA6A4_02A7F7CA215C55DC_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C)[S](=O)(=O)C2CCCNC2""",21,"""D3A7E1954985E80D"""
+"""624137A559C3E667_34A5CBE0133D196E_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C)[S](=O)(=O)CC2CCCN2""",21,"""D3A7E1954985E80D"""
+"""AB671654384DD409_107A885DB8866978_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""D3A7E1954985E80D"""
+"""06767E4F0530C1C8_DF5EBD49F9DBA0D8_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C)(=O)=O)C2CCCNC2""",21,"""D3A7E1954985E80D"""
+"""3E9F5DF215E74755_0A19BAD00A5D1D92_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""D3A7E1954985E80D"""
+"""D96E9EA36671BCB3_B25F8E759C8D60E9_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(CC)[S](=O)(=O)C2CCNC2""",21,"""D3A7E1954985E80D"""
+"""AEB026AD36E4381A_77FC004F204D4F10_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""D3A7E1954985E80D"""
+"""26BF15096CADBDBC_D2A7952B62A848E7_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""D3A7E1954985E80D"""
+"""1769707950F84AC0_DC36E2615BCE3B68_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""D3A7E1954985E80D"""
+"""35FD9839FBF6648D_32AF8F50ECF19D68_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C)(=O)=O)CCNC2CC2""",21,"""D3A7E1954985E80D"""
+"""90E84D6EFDA5FF8F_8D33CA2F25E51EC0_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""D3A7E1954985E80D"""
+"""BDFB83422B0DDB81_3ABD3A5C6799F8C9_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C)[S](=O)(=O)C2CCNCC2""",21,"""D3A7E1954985E80D"""
+"""D6D56FE48FF97CA3_942F591CBD8EF766_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""D3A7E1954985E80D"""
+"""BC1E87F8A84D2A18_8C0B88F08F4B3BD1_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""D3A7E1954985E80D"""
+"""D4E94297D8991843_6C47C1A6D2E9B8BD_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""D3A7E1954985E80D"""
+"""99B9B8ACC2CE6E0D_20297CA5EEEFE499_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C)(=O)=O)C2CCNCC2""",21,"""D3A7E1954985E80D"""
+"""27E7C06B2D1107B7_5F32A9E471CB29F7_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""D3A7E1954985E80D"""
+"""75BA16FA5FF158AA_8F4DFAE62BE40111_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""D3A7E1954985E80D"""
+"""9B0252168882C9C6_5D7C29B44348A119_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""D3A7E1954985E80D"""
+"""97CC3B370493252D_E62DF02F4BDF8E5D_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""D3A7E1954985E80D"""
+"""DE267EF41BAF8B56_148CAB3C03C45067_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""D3A7E1954985E80D"""
+"""93E6435B572438CC_3498BFB50304105B_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C)(=O)=O)CC2CNCC2""",21,"""D3A7E1954985E80D"""
+"""0F29FFE15A06BE6B_08E404A354F1BFED_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""D3A7E1954985E80D"""
+"""CBB4F3A7EE4550D5_01AC193A29F7CE92_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""D3A7E1954985E80D"""
+"""86C6D823C3CD91F5_A399C0E254206619_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""D3A7E1954985E80D"""
+"""3756879D31F34EC4_B28D13C14755552D_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""D3A7E1954985E80D"""
+"""D0B31724DEE5D531_473B2DEDBDCEBB16_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(CCCN)[S](=O)(=O)C2CC2""",21,"""D3A7E1954985E80D"""
+"""66C9FF697A8AAC82_7B3F19F4F5D9AD78_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""D3A7E1954985E80D"""
+"""556DAFDACF109E4B_924923D3E4F76727_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""D3A7E1954985E80D"""
+"""D17F05CEE24AAA5E_6149893E7EE888F3_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""D3A7E1954985E80D"""
+"""8BA2AD0C4F644C9B_682799DD87FD174C_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2CCCCNCC[S]2(=O)=O""",21,"""D3A7E1954985E80D"""
+"""A6125D000EC481DA_1C7F5E7E84D4CBE4_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""D3A7E1954985E80D"""
+"""B8C59E8E28E54AA0_F3A4AE6A52B80492_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""D3A7E1954985E80D"""
+"""4D2B2DBC8BF54464_545A8122911F1788_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""D3A7E1954985E80D"""
+"""FF27BCE14C71DF8C_6C1D707349AE0587_6036_UN""","""CC(N)C(C1=CC=NC=C1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""D3A7E1954985E80D"""
+"""2D0A2F2FA48571D6_C643727990736821_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""D3A7E1954985E80D"""
+"""16468FC79D462440_62E1F4A1CE1F815A_6036_UN""","""CC(N)C(C1=CC=NC=C1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""D3A7E1954985E80D"""
+"""B9E4565A566A0B2C_72AD2ADD97184ABF_6036_UN""","""CC(N)C(C1=CC=NC=C1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""D3A7E1954985E80D"""
+"""EE419FB3162A4F3C_3FD0E868F9636809_6036_UN""","""NCC(CN1CCCC1=O)N([S](CC)(=O)=O)CC(=O)OC""",21,"""D404A0A08071F686"""
+"""0031E7488CDEB113_1C8D5DCC46A08094_6036_UN""","""NCC(CN1CCCC1=O)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""D404A0A08071F686"""
+"""876AAF6FAF6713BB_36FA72B5942B9D32_6036_UN""","""NCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""D404A0A08071F686"""
+"""209784C46C41C8EE_644F655C58B328AD_6036_UN""","""NCC(CN1CCCC1=O)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""D404A0A08071F686"""
+"""F82ECE8199E23DE3_0504B6FFE8A84B57_6036_UN""","""NCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2CCCNC2""",21,"""D404A0A08071F686"""
+"""1B46DB79025CEDD5_33068AD5DAC907E5_6036_UN""","""NCC(CN1CCCC1=O)N(C)[S](=O)(=O)CC2CCCN2""",21,"""D404A0A08071F686"""
+"""BD2D9F5CF2552A67_17D9C968717277F3_6036_UN""","""NCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""D404A0A08071F686"""
+"""DDBF3F968893107F_D8FDFC7C302FBE53_6036_UN""","""NCC(CN1CCCC1=O)N([S](C)(=O)=O)C2CCCNC2""",21,"""D404A0A08071F686"""
+"""A408ADFBDDC4E6C9_0DBAFBE5C3A90319_6036_UN""","""NCC(CN1CCCC1=O)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""D404A0A08071F686"""
+"""178615DD240B5330_B5FCCF4055797E62_6036_UN""","""NCC(CN1CCCC1=O)N(CC)[S](=O)(=O)C2CCNC2""",21,"""D404A0A08071F686"""
+"""AADE0B72DA8C4401_705F417AE9B9519B_6036_UN""","""NCC(CN1CCCC1=O)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""D404A0A08071F686"""
+"""57E5117B532AEAF5_D504D41EAB5C566C_6036_UN""","""NCC(CN1CCCC1=O)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""D404A0A08071F686"""
+"""7B27AFFCD81A1FC9_DB95A354923A25E3_6036_UN""","""NCC(CN1CCCC1=O)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""D404A0A08071F686"""
+"""A778D13778042979_350CCE65250583E3_6036_UN""","""NCC(CN1CCCC1=O)N([S](C)(=O)=O)CCNC2CC2""",21,"""D404A0A08071F686"""
+"""6D716BD91274F1E1_8A908B1AEC11004B_6036_UN""","""NCC(CN1CCCC1=O)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""D404A0A08071F686"""
+"""C896EAC33FE8FB4A_3D1E7B69AE6DE642_6036_UN""","""NCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2CCNCC2""",21,"""D404A0A08071F686"""
+"""ED1DB46F39517396_938C1829747AE9ED_6036_UN""","""NCC(CN1CCCC1=O)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""D404A0A08071F686"""
+"""A2397D3EE3E10820_8BA8C9C546BF255A_6036_UN""","""NCC(CN1CCCC1=O)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""D404A0A08071F686"""
+"""0ED1CF79816A3FEF_6BE480931B1DA636_6036_UN""","""NCC(CN1CCCC1=O)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""D404A0A08071F686"""
+"""84F9F71C61D0F160_278A3D90271BFA12_6036_UN""","""NCC(CN1CCCC1=O)N([S](C)(=O)=O)C2CCNCC2""",21,"""D404A0A08071F686"""
+"""E0A38625405691E9_5891E8D1B83F377C_6036_UN""","""NCC(CN1CCCC1=O)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""D404A0A08071F686"""
+"""D5482A7EEC840E0A_88EEBBD3E2101F9A_6036_UN""","""NCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""D404A0A08071F686"""
+"""B8DE8867409F3C54_5ADF68818ABCBF92_6036_UN""","""NCC(CN1CCCC1=O)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""D404A0A08071F686"""
+"""38F16BF8ADA2AB1F_E18EB11A822B90D6_6036_UN""","""NCC(CN1CCCC1=O)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""D404A0A08071F686"""
+"""BC0A0F204DE2D042_132FEA09CA304EEC_6036_UN""","""NCC(CN1CCCC1=O)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""D404A0A08071F686"""
+"""299D18D09C36A89B_333BFE80CAF00ED0_6036_UN""","""NCC(CN1CCCC1=O)N([S](C)(=O)=O)CC2CNCC2""",21,"""D404A0A08071F686"""
+"""9DF039558BFB2E59_0F4745969D05A166_6036_UN""","""NCC(CN1CCCC1=O)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""D404A0A08071F686"""
+"""E9BB68465EF8EDD2_060F580FE003D019_6036_UN""","""NCC(CN1CCCC1=O)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""D404A0A08071F686"""
+"""DD6DF3D3554AB5A3_A43A81D79DD47892_6036_UN""","""NCC(CN1CCCC1=O)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""D404A0A08071F686"""
+"""4D2D71425A03A31A_B52E52F48EA14BA6_6036_UN""","""NCC(CN1CCCC1=O)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""D404A0A08071F686"""
+"""B0E491719A9EAC0C_40986CD8743AA59D_6036_UN""","""NCC(CN1CCCC1=O)N(CCCN)[S](=O)(=O)C2CC2""",21,"""D404A0A08071F686"""
+"""B8AE77C587C85A8D_7C9C58C13C2DB3F3_6036_UN""","""NCC(CN1CCCC1=O)N2CCCC(CC=C)[S]2(=O)=O""",21,"""D404A0A08071F686"""
+"""D2EF043B71926031_95EA62E62D0379AC_6036_UN""","""NCC(CN1CCCC1=O)N(CCCN)[S](=O)(=O)C(F)F""",21,"""D404A0A08071F686"""
+"""FCA1B6897058C1E0_66EAC80BB71C9678_6036_UN""","""NCC(CN1CCCC1=O)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""D404A0A08071F686"""
+"""BC2A7753E9229A34_6F84D8E84E0909C7_6036_UN""","""NCC(CN1CCCC1=O)N2CCCCNCC[S]2(=O)=O""",21,"""D404A0A08071F686"""
+"""3C814D9701B8D499_1BDC1F4B4D20D56F_6036_UN""","""NCC(CN1CCCC1=O)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""D404A0A08071F686"""
+"""4CE6D3EAED424E72_F407EF5F9B4C1A19_6036_UN""","""NCC(CN1CCCC1=O)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""D404A0A08071F686"""
+"""EA58FAA177683E04_53F9C01758EB0903_6036_UN""","""NCC(CN1CCCC1=O)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""D404A0A08071F686"""
+"""F7BEA5C2B24C8785_6BBE3146805A1B0C_6036_UN""","""NCC(CN1CCCC1=O)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""D404A0A08071F686"""
+"""C10F523A3B048045_C1E0334C598776AA_6036_UN""","""NCC(CN1CCCC1=O)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""D404A0A08071F686"""
+"""353FAD218E3CEA18_6542B59407EB9FD1_6036_UN""","""NCC(CN1CCCC1=O)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""D404A0A08071F686"""
+"""5D65931A56F46FA8_750E6BE85EEC5434_6036_UN""","""NCC(CN1CCCC1=O)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""D404A0A08071F686"""
+"""9B81A5DA34194454_239F12CF3620A082_2267_UN""","""CC1=NC(=CS1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""D475C2D9CF9F219B"""
+"""4362AB5C6A8E85E7_BD4C9B99D9D7F7D1_2267_UN""","""CC1=NC(=CS1)C#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""D475C2D9CF9F219B"""
+"""15199828AF17FD97_59B268DA3BE7EA74_2267_UN""","""CC1=NC(=CS1)C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""D475C2D9CF9F219B"""
+"""039D1D66F274CACF_3E849E34887969FF_2267_UN""","""CC1=NC(=CS1)C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""D475C2D9CF9F219B"""
+"""88D2B76ABE07D88C_B50535C60E6BA0EE_2267_UN""","""CC1=NC(=CS1)C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""D475C2D9CF9F219B"""
+"""7269CCF12723301A_458E2741B82F48BB_2267_UN""","""CC1=NC(=CS1)C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""D475C2D9CF9F219B"""
+"""F228E97939DD5080_8581269C32FD1420_2267_UN""","""CC1=NC(=CS1)C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""D475C2D9CF9F219B"""
+"""944D280D14A5E684_C2E4BCE4486D334C_2267_UN""","""CC1=NC(=CS1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""D475C2D9CF9F219B"""
+"""EE0762A7B797C4B2_CDC9EC3166C7B0A0_2267_UN""","""CC1=NC(=CS1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""D475C2D9CF9F219B"""
+"""379EECB5603A0486_AB35D2FAC7D2DDC6_2267_UN""","""CC1=NC(=CS1)C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""D475C2D9CF9F219B"""
+"""56FFE3A3CCA6AC49_01E162BD4911C769_2267_UN""","""CC1=NC(=CS1)C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""D475C2D9CF9F219B"""
+"""ADBD2638E4317569_E16531B001F39FB7_2267_UN""","""CC1=NC(=CS1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""D475C2D9CF9F219B"""
+"""CCF22BFEE149CC7C_844EFE46EA6019BE_2267_UN""","""CC1=NC(=CS1)C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""D475C2D9CF9F219B"""
+"""5735890325EBC466_4664CAF801F0D3EC_2267_UN""","""CC1=NC(=CS1)C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""D475C2D9CF9F219B"""
+"""8D7B4B1872CC97F5_F8A9F511A7FBC463_2267_UN""","""CC1=NC(=CS1)C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""D475C2D9CF9F219B"""
+"""62B9119F546A7DB7_D042E459BDBEAF6E_2267_UN""","""CC1=NC(=CS1)C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""D475C2D9CF9F219B"""
+"""23B0CFF53A455E4A_133D12B0BF367450_2267_UN""","""CC1=NC(=CS1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""D475C2D9CF9F219B"""
+"""BE3EC6D9E993ECB9_C62D300C2E7EEA03_2267_UN""","""CC1=NC(=CS1)C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""D475C2D9CF9F219B"""
+"""7331C48147C3A90A_65937901A0E78D6F_2267_UN""","""CC1=NC(=CS1)C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""D475C2D9CF9F219B"""
+"""654F55F0EB925A0D_4E9CD4155F99C74C_2267_UN""","""CC1=NC(=CS1)C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""D475C2D9CF9F219B"""
+"""561E0B4145EE4EAD_A211A5362FA1EE91_2267_UN""","""CC1=NC(=CS1)C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""D475C2D9CF9F219B"""
+"""29D2429A673FA368_58ACBE0A11899297_2267_UN""","""CC1=NC(=CS1)C#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""D475C2D9CF9F219B"""
+"""53955AB6D9055222_FEC02A6F334C5553_2267_UN""","""CC1=NC(=CS1)C#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""D475C2D9CF9F219B"""
+"""079E24D493AE253F_74AD1B6034C2DE07_2267_UN""","""CC1=NC(=CS1)C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""D475C2D9CF9F219B"""
+"""C8439F4838EEB815_A83BDBB25109244C_2267_UN""","""CC1=NC(=CS1)C#CC2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""D475C2D9CF9F219B"""
+"""5DC19B8631F9F34E_1E294FB455EE4BE0_2267_UN""","""CC1=NC(=CS1)C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""D475C2D9CF9F219B"""
+"""09E2BF8B612218EA_1B24D6CF3D192C75_2267_UN""","""CC1=NC(=CS1)C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""D475C2D9CF9F219B"""
+"""01082A9434C7B5B5_E2E11E878FC1825F_2267_UN""","""CC1=NC(=CS1)C#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""D475C2D9CF9F219B"""
+"""D3FDC16126AC68AD_C63B1A5DD96F89D7_2267_UN""","""CC1=NC(=CS1)C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""D475C2D9CF9F219B"""
+"""06DFC67B182CA009_B153A74F1EBAE3A0_2267_UN""","""CC1=NC(=CS1)C#CC2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""D475C2D9CF9F219B"""
+"""EA561E70C79F34CD_6718436DD6653A91_2267_UN""","""CC1=NC(=CS1)C#CC2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""D475C2D9CF9F219B"""
+"""FC09FC811CD296BD_4387BC85EE9BE02A_2267_UN""","""CC1=NC(=CS1)C#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""D475C2D9CF9F219B"""
+"""EB02130992C8EA2D_CC974B192F1781A3_2267_UN""","""CC1=NC(=CS1)C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""D475C2D9CF9F219B"""
+"""B480E65A3A83D322_858266A8A0BF9EB0_2267_UN""","""CC1=NC(=CS1)C#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""D475C2D9CF9F219B"""
+"""C5E065C03384BF0A_59A65CCA9F38A03A_2267_UN""","""CC1=NC(=CS1)C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""D475C2D9CF9F219B"""
+"""ECBA6DDAAC0A769B_9614483C88A04D8B_2267_UN""","""CC1=NC(=CS1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""D475C2D9CF9F219B"""
+"""B87A7D56E8474548_D23EBF991F8E995D_2267_UN""","""CC1=NC(=CS1)C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""D475C2D9CF9F219B"""
+"""D24AFE4D317036A5_A99831C4F7FEBC0D_2267_UN""","""CC1=NC(=CS1)C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""D475C2D9CF9F219B"""
+"""DD911741A8DC977C_9B3E895C8C119457_2267_UN""","""CC1=NC(=CS1)C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""D475C2D9CF9F219B"""
+"""C5501CFEF123B6FC_AE1D819BBA64EF58_2267_UN""","""CC1=NC(=CS1)C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""D475C2D9CF9F219B"""
+"""3660674D88990E35_F6AF4BC17A381A4D_2267_UN""","""CC1=NC(=CS1)C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""D475C2D9CF9F219B"""
+"""C592B29DAB1932AC_AEC93CAF646AE3D4_2267_UN""","""CC1=NC(=CS1)C#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""D475C2D9CF9F219B"""
+"""5EB58F8485603303_3F3CFCCFD657F20C_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](CC)(=O)=O)CC(=O)OC""",21,"""D4E8B407AF456C83"""
+"""8B7E54BB8ED2D942_1C61496B69941A91_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""D4E8B407AF456C83"""
+"""CED830FFAF65D45B_36166612BB1F0737_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""D4E8B407AF456C83"""
+"""C76E7E80F4F3F1E6_64A371FB7787B2A8_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""D4E8B407AF456C83"""
+"""6FF0822FF4A073EE_05E8A258C79CD152_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C)[S](=O)(=O)C2CCCNC2""",21,"""D4E8B407AF456C83"""
+"""23FF3E4DAE34B5E3_33EA9E72F5FD9DE0_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C)[S](=O)(=O)CC2CCCN2""",21,"""D4E8B407AF456C83"""
+"""7E4A253E663816BD_1735DDCF5E46EDF6_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""D4E8B407AF456C83"""
+"""3FADA298F293262A_D811E8DB1F1B2456_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C)(=O)=O)C2CCCNC2""",21,"""D4E8B407AF456C83"""
+"""4310200D74BD5E9F_0D56EF42EC9D991C_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""D4E8B407AF456C83"""
+"""CA132DA0FF3DA65C_B510DBE77A4DE467_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(CC)[S](=O)(=O)C2CCNC2""",21,"""D4E8B407AF456C83"""
+"""E88ED7541637506F_70B355DDC68DCB9E_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""D4E8B407AF456C83"""
+"""2DAB9C90B698BD9D_D5E8C0B98468CC69_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""D4E8B407AF456C83"""
+"""AFCF9E72BAACD0A3_DB79B7F3BD0EBFE6_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""D4E8B407AF456C83"""
+"""34B9A7B7D7E8928C_35E0DAC20A3119E6_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C)(=O)=O)CCNC2CC2""",21,"""D4E8B407AF456C83"""
+"""7C5A1FA597E57867_8A7C9FBDC3259A4E_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""D4E8B407AF456C83"""
+"""D19D1180FD2D2E2E_3DF26FCE81597C47_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C)[S](=O)(=O)C2CCNCC2""",21,"""D4E8B407AF456C83"""
+"""07EFBE42856A5815_93600C8E5B4E73E8_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""D4E8B407AF456C83"""
+"""FAB67FC1965F0FFF_8B44DD62698BBF5F_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""D4E8B407AF456C83"""
+"""14C45CBE1B1E3687_6B08943434293C33_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""D4E8B407AF456C83"""
+"""D1FD6EC10FA80CDB_27662937082F6017_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C)(=O)=O)C2CCNCC2""",21,"""D4E8B407AF456C83"""
+"""DB4F70AFD6DDF86D_587DFC76970BAD79_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""D4E8B407AF456C83"""
+"""D1041A48DCDD17FC_8802AF74CD24859F_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""D4E8B407AF456C83"""
+"""B3E86AE4D7F90675_5A337C26A5882597_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""D4E8B407AF456C83"""
+"""A9BA86EDF4AB346E_E162A5BDAD1F0AD3_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""D4E8B407AF456C83"""
+"""1383E2B33D117ADD_13C3FEAEE504D4E9_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""D4E8B407AF456C83"""
+"""77445799633230FC_33D7EA27E5C494D5_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C)(=O)=O)CC2CNCC2""",21,"""D4E8B407AF456C83"""
+"""E601AF91985F21D1_0FAB5131B2313B63_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""D4E8B407AF456C83"""
+"""5C51EEFFF9566AD4_06E34CA8CF374A1C_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""D4E8B407AF456C83"""
+"""8D4140FF23120355_A4D69570B2E0E297_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""D4E8B407AF456C83"""
+"""8348C2B06C83E1E3_B5C24653A195D1A3_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""D4E8B407AF456C83"""
+"""E4D296FF5C19E01C_4074787F5B0E3F98_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(CCCN)[S](=O)(=O)C2CC2""",21,"""D4E8B407AF456C83"""
+"""5FF2A69D6E308552_7C704C66131929F6_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2CCCC(CC=C)[S]2(=O)=O""",21,"""D4E8B407AF456C83"""
+"""15B2EFCC90E57C72_950676410237E3A9_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(CCCN)[S](=O)(=O)C(F)F""",21,"""D4E8B407AF456C83"""
+"""717BE0D393E7DDEF_6606DCAC98280C7D_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""D4E8B407AF456C83"""
+"""63FF5250CF86B96C_6F68CC4F613D93C2_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2CCCCNCC[S]2(=O)=O""",21,"""D4E8B407AF456C83"""
+"""8229B3626CE06156_1B300BEC62144F6A_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""D4E8B407AF456C83"""
+"""881FB827AE595C74_F4EBFBF8B478801C_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""D4E8B407AF456C83"""
+"""2D81854C87F4AD96_5315D4B077DF9306_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""D4E8B407AF456C83"""
+"""5FAEED3FE52594AB_6B5225E1AF6E8109_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""D4E8B407AF456C83"""
+"""5496F19AD38973F0_C10C27EB76B3ECAF_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""D4E8B407AF456C83"""
+"""A3D313D009AF0D35_65AEA13328DF05D4_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""D4E8B407AF456C83"""
+"""6E5857C2614F1F84_75E27F4F71D8CE31_6036_UN""","""C(C1=CC(=C(C(=C1)Br)Cl)Br)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""D4E8B407AF456C83"""
+"""C36801260686BEB9_207D99ECFBA8D1D6_2267_UN""","""NC(CC1CC1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""D79749FA021750CF"""
+"""3B4FECB8E12B16D2_BEAE10BA145F8685_2267_UN""","""NC(CC1CC1)C#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""D79749FA021750CF"""
+"""90D314225C36B03F_5A50E3F9F66F9B20_2267_UN""","""NC(CC1CC1)C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""D79749FA021750CF"""
+"""71CAD7667221A7CC_3D66151745F118AB_2267_UN""","""NC(CC1CC1)C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""D79749FA021750CF"""
+"""7F05BFD3E5B3662A_B6E7BEE5C3E3D1BA_2267_UN""","""NC(CC1CC1)C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""D79749FA021750CF"""
+"""F2424F223EBCC6D0_466CAC6275A739EF_2267_UN""","""NC(CC1CC1)C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""D79749FA021750CF"""
+"""242B5301043A14EA_8663ADBFFF756574_2267_UN""","""NC(CC1CC1)C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""D79749FA021750CF"""
+"""A31705B407D2A406_C10637C785E54218_2267_UN""","""NC(CC1CC1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""D79749FA021750CF"""
+"""9E368EACC399D9AB_CE2B6712AB4FC1F4_2267_UN""","""NC(CC1CC1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""D79749FA021750CF"""
+"""BBB709635D8019D4_A8D759D90A5AAC92_2267_UN""","""NC(CC1CC1)C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""D79749FA021750CF"""
+"""F50A302D6D0DB6BA_0203E99E8499B63D_2267_UN""","""NC(CC1CC1)C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""D79749FA021750CF"""
+"""5A38A5F6D6F735CD_E287BA93CC7BEEE3_2267_UN""","""NC(CC1CC1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""D79749FA021750CF"""
+"""1A6766EB1BC76573_87AC756527E868EA_2267_UN""","""NC(CC1CC1)C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""D79749FA021750CF"""
+"""AD7B64332B1CC4F7_458641DBCC78A2B8_2267_UN""","""NC(CC1CC1)C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""D79749FA021750CF"""
+"""59A08135A333BB9A_FB4B7E326A73B537_2267_UN""","""NC(CC1CC1)C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""D79749FA021750CF"""
+"""63BE4D79CF9098AC_D3A06F7A7036DE3A_2267_UN""","""NC(CC1CC1)C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""D79749FA021750CF"""
+"""EBFF59B736CB08AA_10DF999372BE0504_2267_UN""","""NC(CC1CC1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""D79749FA021750CF"""
+"""C2FC29A86A1B3E76_C5CFBB2FE3F69B57_2267_UN""","""NC(CC1CC1)C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""D79749FA021750CF"""
+"""7EEC2A213F02A1B6_6671F2226D6FFC3B_2267_UN""","""NC(CC1CC1)C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""D79749FA021750CF"""
+"""BE70AEB092104479_4D7E5F369211B618_2267_UN""","""NC(CC1CC1)C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""D79749FA021750CF"""
+"""185094C1264B4CEA_A1F32E15E2299FC5_2267_UN""","""NC(CC1CC1)C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""D79749FA021750CF"""
+"""4F19587D90BBE34C_5B4E3529DC01E3C3_2267_UN""","""NC(CC1CC1)C#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""D79749FA021750CF"""
+"""FF0779B5B17B0B2D_FD22A14CFEC42407_2267_UN""","""NC(CC1CC1)C#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""D79749FA021750CF"""
+"""0A40F2C3A7A9AB2B_774F9043F94AAF53_2267_UN""","""NC(CC1CC1)C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""D79749FA021750CF"""
+"""B2E3B7AE86ACB4DE_ABD950919C815518_2267_UN""","""NC(CC1CC1)C#CC2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""D79749FA021750CF"""
+"""C559124E3F77D2B5_1DCBC49798663AB4_2267_UN""","""NC(CC1CC1)C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""D79749FA021750CF"""
+"""F9C30172C83A91A6_18C65DECF0915D21_2267_UN""","""NC(CC1CC1)C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""D79749FA021750CF"""
+"""396DAFF41B4C7072_E10395A44249F30B_2267_UN""","""NC(CC1CC1)C#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""D79749FA021750CF"""
+"""D9152DE80AE9765F_C5D9917E14E7F883_2267_UN""","""NC(CC1CC1)C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""D79749FA021750CF"""
+"""6950FA18C22B185F_B2B12C6CD33292F4_2267_UN""","""NC(CC1CC1)C#CC2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""D79749FA021750CF"""
+"""E3E89EDBFF0D013D_64FAC84E1BED4BC5_2267_UN""","""NC(CC1CC1)C#CC2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""D79749FA021750CF"""
+"""450E123E826B04F4_406537A62313917E_2267_UN""","""NC(CC1CC1)C#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""D79749FA021750CF"""
+"""0203BBEBDC2DE11F_CF75C03AE29FF0F7_2267_UN""","""NC(CC1CC1)C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""D79749FA021750CF"""
+"""B7632062A2436ADF_8660ED8B6D37EFE4_2267_UN""","""NC(CC1CC1)C#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""D79749FA021750CF"""
+"""8CD990B93E3E270A_5A44D7E952B0D16E_2267_UN""","""NC(CC1CC1)C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""D79749FA021750CF"""
+"""8E2877D6B9142F0D_95F6C31F45283CDF_2267_UN""","""NC(CC1CC1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""D79749FA021750CF"""
+"""2DEFAECBC0B54989_D1DC34BAD206E809_2267_UN""","""NC(CC1CC1)C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""D79749FA021750CF"""
+"""015253483556A0D9_AA7ABAE73A76CD59_2267_UN""","""NC(CC1CC1)C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""D79749FA021750CF"""
+"""DD65D8A1E864C127_98DC027F4199E503_2267_UN""","""NC(CC1CC1)C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""D79749FA021750CF"""
+"""F3E7D82DDB2B00D7_ADFF0AB877EC9E0C_2267_UN""","""NC(CC1CC1)C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""D79749FA021750CF"""
+"""EBAF1DE9B7E27649_F54DC0E2B7B06B19_2267_UN""","""NC(CC1CC1)C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""D79749FA021750CF"""
+"""2D5E3EAF23BFFD10_AD2BB78CA9E29280_2267_UN""","""NC(CC1CC1)C#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""D79749FA021750CF"""
+"""13E7ABD929E85176_6B74ABCA59469008_6031_DP""","""C[N]1C=NC=C1[C@@H]2CNC[C@H]2C(=O)OCC(C(OC)=O)N""",21,"""D93CE3DDBB764201"""
+"""85E70854CA4339CC_156CA43D6F63B212_6031_DP""","""C[N]1C=NC=C1[C@@H]2CNC[C@H]2C(=O)OCC3CCNCC3""",21,"""D93CE3DDBB764201"""
+"""0B951A9D32400412_F9FFDE156E28C81C_6031_DP""","""C[N]1C=NC=C1[C@@H]2CNC[C@H]2C(=O)OCC3CCCNC3""",21,"""D93CE3DDBB764201"""
+"""522E3F990A67C72B_6425219A0123CD0B_6031_DP""","""C[N]1C=NC=C1[C@@H]2CNC[C@H]2C(=O)OCC3NCCNC3""",21,"""D93CE3DDBB764201"""
+"""CA9C23EAFE300358_80799327B977B415_6031_DP""","""C[N]1C=NC=C1[C@@H]2CNC[C@H]2C(=O)OCC(CC=CC)N""",21,"""D93CE3DDBB764201"""
+"""61F7D361678CFE31_C213B1E40127EB8F_6031_DP""","""C[N]1C=NC=C1[C@@H]2CNC[C@H]2C(=O)OCC(CC(C)C)N""",21,"""D93CE3DDBB764201"""
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+"""B36EEC7FD5A35F9A_CCC7823EA7D85ED2_2267_UN""","""CCSCCCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""DA56FC03202A4C05"""
+"""F02843D448BE0120_C3EAD2EB8972DD3E_2267_UN""","""CCSCCCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""DA56FC03202A4C05"""
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+"""9749FAF0F34A51CA_EF460F6AEE46F229_2267_UN""","""CCSCCCC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""DA56FC03202A4C05"""
+"""709F5C01C23B07F2_8A6DC09C05D57420_2267_UN""","""CCSCCCC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""DA56FC03202A4C05"""
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+"""BC38ADD5F25F8866_DE61DA83520BC2F0_2267_UN""","""CCSCCCC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""DA56FC03202A4C05"""
+"""6CAD13672D28AA82_1D1E2C6A508319CE_2267_UN""","""CCSCCCC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""DA56FC03202A4C05"""
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+"""51CCB24C865DD122_6BB047DB4F52E0F1_2267_UN""","""CCSCCCC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""DA56FC03202A4C05"""
+"""C3D203D99E19A488_40BFEACFB02CAAD2_2267_UN""","""CCSCCCC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""DA56FC03202A4C05"""
+"""CD534E4C554A2BBB_AC329BECC014830F_2267_UN""","""CCSCCCC#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""DA56FC03202A4C05"""
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+"""790B391547D1D5C3_7A8E25BADB77B399_2267_UN""","""CCSCCCC#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""DA56FC03202A4C05"""
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+"""F76828E12A4C0AD9_100A716EBA5B267E_2267_UN""","""CCSCCCC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""DA56FC03202A4C05"""
+"""3669CF926811B10D_1507E815D2AC41EB_2267_UN""","""CCSCCCC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""DA56FC03202A4C05"""
+"""90C9C254F723F8B0_ECC2205D6074EFC1_2267_UN""","""CCSCCCC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""DA56FC03202A4C05"""
+"""7E154FF29F32AF2B_C818248736DAE449_2267_UN""","""CCSCCCC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""DA56FC03202A4C05"""
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+"""3FC7300CFC30FE9D_693B7DB739D0570F_2267_UN""","""CCSCCCC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""DA56FC03202A4C05"""
+"""20D06AD8A9397A27_4DA4825F012E8DB4_2267_UN""","""CCSCCCC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""DA56FC03202A4C05"""
+"""2FDAA6A18F1E21A8_C2B475C3C0A2EC3D_2267_UN""","""CCSCCCC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""DA56FC03202A4C05"""
+"""9E57B0F736750328_8BA158724F0AF32E_2267_UN""","""CCSCCCC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""DA56FC03202A4C05"""
+"""30162DC5838F8A07_57856210708DCDA4_2267_UN""","""CCSCCCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""DA56FC03202A4C05"""
+"""98E3D54FE33CAAA5_983776E667152015_2267_UN""","""CCSCCCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""DA56FC03202A4C05"""
+"""82AB21789CDC8E6C_DC1D8143F03BF4C3_2267_UN""","""CCSCCCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""DA56FC03202A4C05"""
+"""9752E7A560BE5536_A7BB0F1E184BD193_2267_UN""","""CCSCCCC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""DA56FC03202A4C05"""
+"""99EA2610DC15EBFD_951DB78663A4F9C9_2267_UN""","""CCSCCCC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""DA56FC03202A4C05"""
+"""1D94A53154E09E47_A03EBF4155D182C6_2267_UN""","""CCSCCCC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""DA56FC03202A4C05"""
+"""FC1FE90F6B1213FE_F88C751B958D77D3_2267_UN""","""CCSCCCC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""DA56FC03202A4C05"""
+"""3A97C8230314679A_A0EA02758BDF8E4A_2267_UN""","""CCSCCCC#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""DA56FC03202A4C05"""
+"""E6BEF130D5979409_2C618DF59395C21D_2267_UN""","""FC(F)C1(CC1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""DB8B5DE36A2A4304"""
+"""B07D7EA16B20687A_B2B204A37C62954E_2267_UN""","""FC(F)C1(CC1)C#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""DB8B5DE36A2A4304"""
+"""23717ED131AA1E37_564CF7E09E5288EB_2267_UN""","""FC(F)C1(CC1)C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""DB8B5DE36A2A4304"""
+"""299A9926B6E4E84B_317A010E2DCC0B60_2267_UN""","""FC(F)C1(CC1)C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""DB8B5DE36A2A4304"""
+"""61D95C8F4B2AB33A_BAFBAAFCABDEC271_2267_UN""","""FC(F)C1(CC1)C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""DB8B5DE36A2A4304"""
+"""036AEB1C7F45DD64_4A70B87B1D9A2A24_2267_UN""","""FC(F)C1(CC1)C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""DB8B5DE36A2A4304"""
+"""8A6CBEAD4EEA19BF_8A7FB9A6974876BF_2267_UN""","""FC(F)C1(CC1)C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""DB8B5DE36A2A4304"""
+"""F24E4EF41226B98A_CD1A23DEEDD851D3_2267_UN""","""FC(F)C1(CC1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""DB8B5DE36A2A4304"""
+"""7B21251E4F89D770_C237730BC372D23F_2267_UN""","""FC(F)C1(CC1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""DB8B5DE36A2A4304"""
+"""8DC46ACEDFA15E32_A4CB4DC06267BF59_2267_UN""","""FC(F)C1(CC1)C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""DB8B5DE36A2A4304"""
+"""0E430E1C6576AC16_0E1FFD87ECA4A5F6_2267_UN""","""FC(F)C1(CC1)C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""DB8B5DE36A2A4304"""
+"""1C0699C006728511_EE9BAE8AA446FD28_2267_UN""","""FC(F)C1(CC1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""DB8B5DE36A2A4304"""
+"""1193B43BE3F444B7_8BB0617C4FD57B21_2267_UN""","""FC(F)C1(CC1)C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""DB8B5DE36A2A4304"""
+"""2798A039F9912BAD_499A55C2A445B173_2267_UN""","""FC(F)C1(CC1)C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""DB8B5DE36A2A4304"""
+"""F6C525FCE68DB7B4_F7576A2B024EA6FC_2267_UN""","""FC(F)C1(CC1)C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""DB8B5DE36A2A4304"""
+"""410898CFE587BA36_DFBC7B63180BCDF1_2267_UN""","""FC(F)C1(CC1)C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""DB8B5DE36A2A4304"""
+"""C0B7C55F0F9D8A06_1CC38D8A1A8316CF_2267_UN""","""FC(F)C1(CC1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""DB8B5DE36A2A4304"""
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+"""A4B49F9098A3233F_E849A2C354784B4E_6036_UN""","""CC1=C(C=CC=C1)C(CN)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""DDC3B37956222D1E"""
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+"""96535041DE3B029F_755B4B18EA7E686B_6036_UN""","""CC1=C(C=CC=C1)C(CN)N2CCCC(CC=C)[S]2(=O)=O""",21,"""DDC3B37956222D1E"""
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+"""CB6044871D017A38_168DC7D08DE77723_6036_UN""","""CC(N)CC(C1=CC=CS1)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""DE043ABC4B360131"""
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+"""3876579614E8BAA5_1DD95374BA358044_6036_UN""","""CC(N)CC(C1=CC=CS1)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""DE043ABC4B360131"""
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+"""107018357B4B00AA_BFFC555C9E3E89D5_6036_UN""","""CC(N)CC(C1=CC=CS1)N(CC)[S](=O)(=O)C2CCNC2""",21,"""DE043ABC4B360131"""
+"""70AE4CF82BF029ED_7A5FDB6622FEA62C_6036_UN""","""CC(N)CC(C1=CC=CS1)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""DE043ABC4B360131"""
+"""A4AAE3B338408DDC_DF044E02601BA1DB_6036_UN""","""CC(N)CC(C1=CC=CS1)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""DE043ABC4B360131"""
+"""F26A93FF10562338_D1953948597DD254_6036_UN""","""CC(N)CC(C1=CC=CS1)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""DE043ABC4B360131"""
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+"""2E873DCC6C737B99_809011062756F7FC_6036_UN""","""CC(N)CC(C1=CC=CS1)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""DE043ABC4B360131"""
+"""DFB0F533B5E250BA_371EE175652A11F5_6036_UN""","""CC(N)CC(C1=CC=CS1)N(C)[S](=O)(=O)C2CCNCC2""",21,"""DE043ABC4B360131"""
+"""4BA4036898B02795_998C8235BF3D1E5A_6036_UN""","""CC(N)CC(C1=CC=CS1)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""DE043ABC4B360131"""
+"""B31E442F17BF9EB8_81A853D98DF8D2ED_6036_UN""","""CC(N)CC(C1=CC=CS1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""DE043ABC4B360131"""
+"""F87F462444BF684F_61E41A8FD05A5181_6036_UN""","""CC(N)CC(C1=CC=CS1)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""DE043ABC4B360131"""
+"""1B76FD1E3430E9FD_2D8AA78CEC5C0DA5_6036_UN""","""CC(N)CC(C1=CC=CS1)N([S](C)(=O)=O)C2CCNCC2""",21,"""DE043ABC4B360131"""
+"""F2ED0FF234A79DFE_529172CD7378C0CB_6036_UN""","""CC(N)CC(C1=CC=CS1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""DE043ABC4B360131"""
+"""D15A8478E92A4379_82EE21CF2957E82D_6036_UN""","""CC(N)CC(C1=CC=CS1)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""DE043ABC4B360131"""
+"""68A35E8C396356CE_50DFF29D41FB4825_6036_UN""","""CC(N)CC(C1=CC=CS1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""DE043ABC4B360131"""
+"""09A91B0FE89986CE_EB8E2B06496C6761_6036_UN""","""CC(N)CC(C1=CC=CS1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""DE043ABC4B360131"""
+"""FDD6E6B824BB86B8_192F70150177B95B_6036_UN""","""CC(N)CC(C1=CC=CS1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""DE043ABC4B360131"""
+"""EF12919EA0CF9900_393B649C01B7F967_6036_UN""","""CC(N)CC(C1=CC=CS1)N([S](C)(=O)=O)CC2CNCC2""",21,"""DE043ABC4B360131"""
+"""E3E5A8B1E217482E_0547DF8A564256D1_6036_UN""","""CC(N)CC(C1=CC=CS1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""DE043ABC4B360131"""
+"""02448FF2CEBDB5F8_0C0FC2132B4427AE_6036_UN""","""CC(N)CC(C1=CC=CS1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""DE043ABC4B360131"""
+"""B4A284B0FE7BB37E_AE3A1BCB56938F25_6036_UN""","""CC(N)CC(C1=CC=CS1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""DE043ABC4B360131"""
+"""AD7FD00CA33587C0_BF2EC8E845E6BC11_6036_UN""","""CC(N)CC(C1=CC=CS1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""DE043ABC4B360131"""
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+"""F503B3229300E38E_6F422F88CCAC6866_6036_UN""","""CC(N)CC(C1=CC=CS1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""DE043ABC4B360131"""
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+"""2A39A6884BD03FEA_29164E6096200B9D_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""DEFC9E766F9F8A84"""
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+"""7E55F5AA40D8F933_533B34759BE7416B_2267_UN""","""C[C@@]1(NCCC1)C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""DEFC9E766F9F8A84"""
+"""48499EA50AA8A913_340DC29B2879C2E0_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""DEFC9E766F9F8A84"""
+"""C25A16ABE590EF59_BF8C6969AE6B0BF1_2267_UN""","""C[C@@]1(NCCC1)C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""DEFC9E766F9F8A84"""
+"""EBE602690F4841BA_4F077BEE182FE3A4_2267_UN""","""C[C@@]1(NCCC1)C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""DEFC9E766F9F8A84"""
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+"""3C5A3B0D09B724F3_C86DE04BE86D9853_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""DEFC9E766F9F8A84"""
+"""7C3907E19D52E12E_C740B09EC6C71BBF_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""DEFC9E766F9F8A84"""
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+"""6311C7C60A483664_0B683E12E9116C76_2267_UN""","""C[C@@]1(NCCC1)C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""DEFC9E766F9F8A84"""
+"""2CD550F7258AA327_EBEC6D1FA1F334A8_2267_UN""","""C[C@@]1(NCCC1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""DEFC9E766F9F8A84"""
+"""EEB09B5A6A7367B8_8EC7A2E94A60B2A1_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""DEFC9E766F9F8A84"""
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+"""713D1E49AB402E8C_F220A9BE07FB6F7C_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""DEFC9E766F9F8A84"""
+"""E867A1D7C737AA92_DACBB8F61DBE0471_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""DEFC9E766F9F8A84"""
+"""CC0D085DCB9B5BEA_19B44E1F1F36DF4F_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""DEFC9E766F9F8A84"""
+"""E2956F402A5131DB_CCA46CA38E7E411C_2267_UN""","""C[C@@]1(NCCC1)C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""DEFC9E766F9F8A84"""
+"""16341A3E9355460A_6F1A25AE00E72670_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""DEFC9E766F9F8A84"""
+"""0EBEC1909A359334_441588BAFF996C53_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""DEFC9E766F9F8A84"""
+"""A5F45805D68544EE_A898F9998FA1458E_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""DEFC9E766F9F8A84"""
+"""A9BE9BC7094E59EE_5225E2A5B1893988_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""DEFC9E766F9F8A84"""
+"""1CB4DA7FCDC0BCF0_F44976C0934CFE4C_2267_UN""","""C[C@@]1(NCCC1)C#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""DEFC9E766F9F8A84"""
+"""446F9A8FA97F83AF_7E2447CF94C27518_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""DEFC9E766F9F8A84"""
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+"""D3D1AD945F226C09_E86842282FC12940_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""DEFC9E766F9F8A84"""
+"""34ED5AA1599E9FB3_CCB246F2796F22C8_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""DEFC9E766F9F8A84"""
+"""B7B3863D7E64C81B_BBDAFBE0BEBA48BF_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""DEFC9E766F9F8A84"""
+"""9CCE2821FA274D56_6D911FC27665918E_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""DEFC9E766F9F8A84"""
+"""73F8B5460D9F1ADA_490EE02A4E9B4B35_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""DEFC9E766F9F8A84"""
+"""E0D3E53A40C5A26E_C61E17B68F172ABC_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""DEFC9E766F9F8A84"""
+"""1BB286DABD417D43_8F0B3A0700BF35AF_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""DEFC9E766F9F8A84"""
+"""A64B9821A0B7F104_532F00653F380B25_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""DEFC9E766F9F8A84"""
+"""20A6DFEE1DC447B6_9C9D149328A0E694_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""DEFC9E766F9F8A84"""
+"""20EAD67F665009B3_D8B7E336BF8E3242_2267_UN""","""C[C@@]1(NCCC1)C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""DEFC9E766F9F8A84"""
+"""4918FFBFB30984B0_A3116D6B57FE1712_2267_UN""","""C[C@@]1(NCCC1)C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""DEFC9E766F9F8A84"""
+"""9059F73B4D0832F7_91B7D5F32C113F48_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""DEFC9E766F9F8A84"""
+"""A664382DF696411C_A494DD341A644447_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""DEFC9E766F9F8A84"""
+"""F3E8A26EB0BD6BBD_FC26176EDA38B152_2267_UN""","""C[C@@]1(NCCC1)C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""DEFC9E766F9F8A84"""
+"""C0165346734FB8A1_A4406000C46A48CB_2267_UN""","""C[C@@]1(NCCC1)C#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""DEFC9E766F9F8A84"""
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+"""FA848C521F5044E4_FFA7FEF5E63D17CE_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2CCCNC2)N""",21,"""DF64C33D33639DD3"""
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+"""BB8D90F430EDA494_C44B91048932345D_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC(CC(C)C)N)N""",21,"""DF64C33D33639DD3"""
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+"""E402DEC9459FB00C_8724B64D0F04759D_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OC[C@@H]2CCCNC2)N""",21,"""DF64C33D33639DD3"""
+"""07EA2475CB865BF0_EDA38D981E0D0523_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OC[C@@H]2CCCCN2)N""",21,"""DF64C33D33639DD3"""
+"""9814382083A47E3C_AE42C09835619FC0_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2OCCNC2)N""",21,"""DF64C33D33639DD3"""
+"""56488A1A55FC6A8E_6F27BFD7AC822715_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCCC2(CNC2)N)N""",21,"""DF64C33D33639DD3"""
+"""6F2955616DEE6096_2D217CE51D4315EC_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC(N)CC(F)F)N""",21,"""DF64C33D33639DD3"""
+"""0451CE6E59FF9635_4F6A1F549D0EEE85_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OC[C@@H](C(OC)=O)N)N""",21,"""DF64C33D33639DD3"""
+"""184605DD7826ED64_A905F405AF450656_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2COCCN2)N""",21,"""DF64C33D33639DD3"""
+"""8326D843768BE22E_139BEC50EC89ACBA_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC(CCN)(C)C)N""",21,"""DF64C33D33639DD3"""
+"""D5270FB453CD99DA_98985BFC88985F38_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2(CCNC2)C)N""",21,"""DF64C33D33639DD3"""
+"""3060E275CC8739D4_2861B14E4917D594_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC23CC(N)(C2)C3)N""",21,"""DF64C33D33639DD3"""
+"""B7BE7F2D598492B7_653F79AA3909A7EB_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCCCNC2CC2)N""",21,"""DF64C33D33639DD3"""
+"""500D6E1930FC81CC_47898DE267F21B76_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC(=C2CNC2)F)N""",21,"""DF64C33D33639DD3"""
+"""C26EBE3E916FA3CC_14596D3EB816BFF9_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC[C@H]2CCCN2)N""",21,"""DF64C33D33639DD3"""
+"""D2D76FA998501C2E_17040BFF8B5FB6D3_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OC[C@H]2CC[C@@H](N)C2)N""",21,"""DF64C33D33639DD3"""
+"""68AF8A919BE1B045_4AF289C0A585054F_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OC[C@H]2COC[C@H]2N)N""",21,"""DF64C33D33639DD3"""
+"""837C16BE54037340_09D56D72925652FC_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OC[C@H]2CCC[C@H]2N)N""",21,"""DF64C33D33639DD3"""
+"""35571C09320DB383_2DFF1E5E9F41FDA4_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2C(CN2)(C)C)N""",21,"""DF64C33D33639DD3"""
+"""B2AD80302DE2AB4D_51B2B222CB4ED011_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCCCNC(C)C)N""",21,"""DF64C33D33639DD3"""
+"""CCBD4D917AC299BB_F969ACCED3AF87F1_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCCC2(CN)CC2)N""",21,"""DF64C33D33639DD3"""
+"""6900DAB922353C7C_EADD897D7DBCD99B_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC(C(C)C)ON)N""",21,"""DF64C33D33639DD3"""
+"""D8FB7E30B405BC17_C241737D15A694DD_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC(C(C)C)CN)N""",21,"""DF64C33D33639DD3"""
+"""45E99888E6CCDCB6_F27362C4E6CB42F0_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2=CNCCO2)N""",21,"""DF64C33D33639DD3"""
+"""9042278C47B692F2_CA2C8D5F3E16C648_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2=CNCCC2)N""",21,"""DF64C33D33639DD3"""
+"""2A01781A5CC54AA9_A7115024E46D4549_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCCC2CC(N)C2)N""",21,"""DF64C33D33639DD3"""
+"""44CF2519EAAA68DB_C1C4931229B6540A_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OC[C@@H]2COCCN2)N""",21,"""DF64C33D33639DD3"""
+"""C6D4272058F8AE9E_3EC017D1A89FF112_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCCCC(CC)N)N""",21,"""DF64C33D33639DD3"""
+"""AE7A7F40D21BA34F_28353CBE1C7F2507_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2(CN)COC2)N""",21,"""DF64C33D33639DD3"""
+"""65379E891B05A704_032BB02352A591C7_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCCCCCCN)N""",21,"""DF64C33D33639DD3"""
+"""F681E990B16EB9E2_08BEED8EE8928711_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2[C@@H]3CNC[C@H]23)N""",21,"""DF64C33D33639DD3"""
+"""6F1D22DD52723D90_D06A7395B79AB833_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2(CNC2)C#N)N""",21,"""DF64C33D33639DD3"""
+"""5320D65925628191_C502F20DBFF13C25_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OC[C@@H]2C[C@H](N)C=C2)N""",21,"""DF64C33D33639DD3"""
+"""DD29FCA0B59033D8_8C0852E7632D1241_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OC[C@H]2CCCNC2)N""",21,"""DF64C33D33639DD3"""
+"""798777FB54664140_2574D69DA1D4BDFB_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCC2CC(NC)C2)N""",21,"""DF64C33D33639DD3"""
+"""114F0CC774402725_75CB26270DBBE636_6031_DP""","""COC1=CC(=CC=C1)C(CC(=O)OCCC2CCNC2)N""",21,"""DF64C33D33639DD3"""
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+"""27A6D16A7A0A9628_BA3AFD8B245B9E4E_6031_DP""","""O(C(=O)C1(CC1)C2=C(C=C(C=C2)N)F)C[C@H]3CCCNC3""",21,"""E9566C51741511DC"""
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+"""8C6F89D447353E67_A8A2C4D3BEA0D26B_6031_DP""","""O(C(=O)C1(CC1)C2=C(C=C(C=C2)N)F)C[C@@H]3OCCNC3""",21,"""E9566C51741511DC"""
+"""5A449A8DAFB6B423_596AC24319D1A326_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC(C(OC)=O)N""",21,"""EB228A54FBE1712F"""
+"""99450B3D17315BC2_2772CDB42FF4813C_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2CCNCC2""",21,"""EB228A54FBE1712F"""
+"""CDC57B771CF24356_CBE1B79C2EBFFB32_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2CCCNC2""",21,"""EB228A54FBE1712F"""
+"""39A0EF4484BF2A3F_563B481341B4FE25_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2NCCNC2""",21,"""EB228A54FBE1712F"""
+"""4D0EA84660C23C33_B267FAAEF9E0873B_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC(CC=CC)N""",21,"""EB228A54FBE1712F"""
+"""2A0FC9AFCDB25F82_F00DD86D41B0D8A1_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC(CC(C)C)N""",21,"""EB228A54FBE1712F"""
+"""D2FC18F9B7DFB464_30DB7139A5F56DD0_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2(N)CCCC2""",21,"""EB228A54FBE1712F"""
+"""7A775DAD70FBA1C4_B362FF24C7869961_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OC[C@@H]2CCCNC2""",21,"""EB228A54FBE1712F"""
+"""F308ACDA54D2A0EB_D9E5C4F1D68FE9DF_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OC[C@@H]2CCCCN2""",21,"""EB228A54FBE1712F"""
+"""6E04F7F871A581A7_9A0489F1FDE3733C_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2OCCNC2""",21,"""EB228A54FBE1712F"""
+"""AAB292BD3D2C7B88_5B61F6BE6400CBE9_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCCC2(CNC2)N""",21,"""EB228A54FBE1712F"""
+"""052F91159BB10DF7_1967358CD5C1F910_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC(N)CC(F)F""",21,"""EB228A54FBE1712F"""
+"""A6DC8FBF4BF83893_7B2C563D558C0279_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OC[C@@H](C(OC)=O)N""",21,"""EB228A54FBE1712F"""
+"""FDDDCC2560DF2D69_9D43BD6C67C7EAAA_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2COCCN2""",21,"""EB228A54FBE1712F"""
+"""90A6BA5509054CAB_27DDA539240B4046_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC(CCN)(C)C""",21,"""EB228A54FBE1712F"""
+"""16730728A5740DC2_ACDE1295401AB3C4_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2(CCNC2)C""",21,"""EB228A54FBE1712F"""
+"""09A3AB6A9E1CD052_1C27F82781953968_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC23CC(N)(C2)C3""",21,"""EB228A54FBE1712F"""
+"""117F40E64DB564EA_517930C3F18B4B17_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCCCNC2CC2""",21,"""EB228A54FBE1712F"""
+"""A540C7FEBC256598_73CFC48BAF70F78A_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC(=C2CNC2)F""",21,"""EB228A54FBE1712F"""
+"""86DB825C5DBEB3D9_201F245770945305_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC[C@H]2CCCN2""",21,"""EB228A54FBE1712F"""
+"""FF710129A6FAFB4B_2342429643DD5A2F_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OC[C@H]2CC[C@@H](N)C2""",21,"""EB228A54FBE1712F"""
+"""0BB3C963FC0A48B8_7EB4C0A96D07E9B3_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OC[C@H]2COC[C@H]2N""",21,"""EB228A54FBE1712F"""
+"""A24C2FD95EDF2E19_3D93241B5AD4BE00_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OC[C@H]2CCC[C@H]2N""",21,"""EB228A54FBE1712F"""
+"""4EA8D1E645AABD6E_19B9573757C31158_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2C(CN2)(C)C""",21,"""EB228A54FBE1712F"""
+"""ECD21DC1A9BA0A8B_65F4FB4B03CC3CED_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCCCNC(C)C""",21,"""EB228A54FBE1712F"""
+"""E60F028891A44E85_CD2FE5A71B2D6B0D_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCCC2(CN)CC2""",21,"""EB228A54FBE1712F"""
+"""CC504C3BA1F05B27_DE9BC014B53E3567_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC(C(C)C)ON""",21,"""EB228A54FBE1712F"""
+"""063D0AB348FF0CFE_F6073A14DD247821_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC(C(C)C)CN""",21,"""EB228A54FBE1712F"""
+"""AF51638F8AFB9396_C6352BAD2E49AE0C_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2=CNCCO2""",21,"""EB228A54FBE1712F"""
+"""24D25F38156C20A9_FE6AC436F6942AB4_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2=CNCCC2""",21,"""EB228A54FBE1712F"""
+"""FD53D60A8AB619F1_9357194D2CEFA9B5_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCCC2CC(N)C2""",21,"""EB228A54FBE1712F"""
+"""65ADB5D6AF841E9B_F582DA7BE134B8F6_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OC[C@@H]2COCCN2""",21,"""EB228A54FBE1712F"""
+"""4684A1A78A4089A6_0A865EB8601D1DEE_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCCCC(CC)N""",21,"""EB228A54FBE1712F"""
+"""B5DE06262A956581_1C7375D7D4FDC9FB_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2(CN)COC2""",21,"""EB228A54FBE1712F"""
+"""EA5A47041B706B99_376DF94A9A277D3B_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCCCCCCN""",21,"""EB228A54FBE1712F"""
+"""F8262A0F3AA47A64_3CF8A4E720106BED_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2[C@@H]3CNC[C@H]23""",21,"""EB228A54FBE1712F"""
+"""1636F20D0D311832_E42C3AFC7F1854CF_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OCC2(CNC2)C#N""",21,"""EB228A54FBE1712F"""
+"""E25D76888F6D41B7_F144BB647773D0D9_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OC[C@@H]2C[C@H](N)C=C2""",21,"""EB228A54FBE1712F"""
+"""89CFF586D6C13135_B84E1B8EABAFFEBD_6031_DP""","""CC1=C(C(=CC=C1)C)C[C@H](N)C(=O)OC[C@H]2CCCNC2""",21,"""EB228A54FBE1712F"""
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+"""380921B63D38FC6A_AE3E4E43C1494C4B_2267_UN""","""CN(CC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2)C(=O)C""",21,"""EC5FC4A68676205B"""
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+"""E730989870E0A552_963787E4F38DEE98_2267_UN""","""CN(CC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3)C(=O)C""",21,"""EC5FC4A68676205B"""
+"""D82A200D6CD9B5B4_CE854DBE33D11B8D_2267_UN""","""CN(CC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O)C(=O)C""",21,"""EC5FC4A68676205B"""
+"""1B4F6488B699EA5A_96E33AD02D83E214_2267_UN""","""CN(CC#CC2=NC1=C(OC)C=CC(=C1S2)OC)C(=O)C""",21,"""EC5FC4A68676205B"""
+"""95FA8E64034C6316_1E03AC6F05CA3211_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC=C(NC(CCC)=O)C=C3""",21,"""ECF9D1C2244DE30A"""
+"""1534CE5CC7FA6615_336C585CB819841F_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=C([N](CCCOC)C(=C3)C)C""",21,"""ECF9D1C2244DE30A"""
+"""8CB662545B4AFA3B_C6D4E6D589707D97_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=C([NH]C(=C3C(OCC)=O)C)C""",21,"""ECF9D1C2244DE30A"""
+"""7309A6A38C489669_C120CD1341DA3771_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC=C(CCCCCC)C=C3""",21,"""ECF9D1C2244DE30A"""
+"""DA0DBE312BC4A9DE_A90810D62DC81706_1171_DP""","""N1CC(C1)C2=NC(=C(C)S2)C3=C(C(=C(C)[NH]3)C(OC)=O)C""",21,"""ECF9D1C2244DE30A"""
+"""A837356EBDB510A9_94F6145CBFE31CCC_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=C(C)[N](C(=C3)C)C4=NC=N[NH]4""",21,"""ECF9D1C2244DE30A"""
+"""DB9014CDD046D72F_5A8E69E6223E5C8E_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=C(C)[N](C(=C3)C)C4=NOC=C4""",21,"""ECF9D1C2244DE30A"""
+"""BE00FB44934502E0_669433656BABE4CC_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC(=C(C=C3)OC(F)F)OC""",21,"""ECF9D1C2244DE30A"""
+"""FDB1E669D67A87CE_8B01383B829A348F_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC=C(CCN[S](C)(=O)=O)S3""",21,"""ECF9D1C2244DE30A"""
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+"""5ECF80AF358803E2_7333DCE40D88D636_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC=C(C(C)NC(=O)C)C=C3""",21,"""ECF9D1C2244DE30A"""
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+"""8FFCAEB07ABAB95C_ECD7355AC49C39A0_1171_DP""","""N1CC(C1)C2=NC(=CS2)C4=C[N](C3=CC=CC(=C3)C)N=N4""",21,"""ECF9D1C2244DE30A"""
+"""7B964007C1D6D2F6_DCFEA86D64954C74_1171_DP""","""N1CC(C1)C2=NC(=CS2)C4=CC3=C(CCN(C(C)=O)C3)S4""",21,"""ECF9D1C2244DE30A"""
+"""92B7D778C7C7B90E_3C95AFE34843CAA7_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC4=C(C=C3)NC(N(C)C4)=O""",21,"""ECF9D1C2244DE30A"""
+"""F9A8481255A74894_938EADAE650AC3E8_1171_DP""","""N1CC(C1)C2=NC(=CS2)C4=CC3=C(C=C(OC)C=C3)C=C4""",21,"""ECF9D1C2244DE30A"""
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+"""24F5F0C236BA21FB_A94302DEF05DB323_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC=C([S](N(C)C)(=O)=O)C=C3""",21,"""ECF9D1C2244DE30A"""
+"""EA88849F99AFC88F_B7092762B7F15B38_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3(NC(C(F)(F)F)=O)CCCC3""",21,"""ECF9D1C2244DE30A"""
+"""8BEADF03C4FD435F_A08A9C819CA86F21_1171_DP""","""N1CC(C1)C2=NC(=CS2)C4=C[N](C3=CC=C(F)C=C3)N=N4""",21,"""ECF9D1C2244DE30A"""
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+"""1F726593C01FA317_245549ABA3885339_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC(=C(C(=C3)OC)OC)OC""",21,"""ECF9D1C2244DE30A"""
+"""71369392DCA35A1E_9069AA666560F125_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC(=C(C=C3)NC(=O)C)SC""",21,"""ECF9D1C2244DE30A"""
+"""71A0770FE9773D81_BC2FC2F71C940F9A_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=C(C)[N](C(=C3)C)C4=NC=CS4""",21,"""ECF9D1C2244DE30A"""
+"""0552DE047C863054_C4C272C8FEB8A519_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=C([NH]C(=C3C)C(OCC)=O)C""",21,"""ECF9D1C2244DE30A"""
+"""5909B46BE7CFA41A_B62ACDE5BBA019D2_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC=C(CCNC(C)=O)C=C3""",21,"""ECF9D1C2244DE30A"""
+"""0DF45920D51E6D26_1A6A259E6563D53F_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC=C(CN(C)C(=O)C)C=C3""",21,"""ECF9D1C2244DE30A"""
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+"""83EA16B4E2601DDE_E0F3A13CF964B693_1171_DP""","""N1CC(C1)C3=NC(=C(CC2=CC=CC=C2)S3)C(OCC)=O""",21,"""ECF9D1C2244DE30A"""
+"""9CC91A2E851A880E_14D476B59C19B66D_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=C([N](CC(OC)=O)C(=C3)C)C""",21,"""ECF9D1C2244DE30A"""
+"""E199EC18C91FC4FA_109E554F4C3C0E5F_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=CC=CC(=C3)[S](N(C)C)(=O)=O""",21,"""ECF9D1C2244DE30A"""
+"""C46CA417A199C91C_7D2777DE4079C896_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=C([N](C(COC)C)C(=C3)C)C""",21,"""ECF9D1C2244DE30A"""
+"""97DA600A211DCF50_1F355ABED960991E_1171_DP""","""N1CC(C1)C2=NC(=CS2)C3=C(C)[N](N=C3)C4=CC=CC=C4""",21,"""ECF9D1C2244DE30A"""
+"""3024603335618172_065C88E48DCCC2F0_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](CC)(=O)=O)CC(=O)OC""",21,"""ED88C02CF4DE5C7F"""
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+"""EA0F319B0B8DB8DE_0F761239E08437CB_6036_UN""","""NC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""ED88C02CF4DE5C7F"""
+"""94B4E56FA8B9C423_5DC305D02C1C8254_6036_UN""","""NC1=CC=C(C=C1)OCCN2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""ED88C02CF4DE5C7F"""
+"""8C163C7A856A20F0_3C88D6739C07E1AE_6036_UN""","""NC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2CCCNC2""",21,"""ED88C02CF4DE5C7F"""
+"""B56060E0A339870E_0A8AEA59AE66AD1C_6036_UN""","""NC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)CC2CCCN2""",21,"""ED88C02CF4DE5C7F"""
+"""666948D676B46CB7_2E55A9E405DDDD0A_6036_UN""","""NC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""ED88C02CF4DE5C7F"""
+"""7200FF06446D9ED8_E1719CF0448014AA_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](C)(=O)=O)C2CCCNC2""",21,"""ED88C02CF4DE5C7F"""
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+"""96FD2FBC479D91EE_8C70AFCC21D6D49B_6036_UN""","""NC1=CC=C(C=C1)OCCN(CC)[S](=O)(=O)C2CCNC2""",21,"""ED88C02CF4DE5C7F"""
+"""14A18E2B9F13CD63_49D321F69D16FB62_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](C(C)(C)C)(=O)=O)CC=C""",21,"""ED88C02CF4DE5C7F"""
+"""EFEAB0175F2A6843_EC88B492DFF3FC95_6036_UN""","""NC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""ED88C02CF4DE5C7F"""
+"""219C20618B3958B3_E219C3D8E6958F1A_6036_UN""","""NC1=CC=C(C=C1)OCCN(C(C)(C)C)[S](=O)(=O)CCN""",21,"""ED88C02CF4DE5C7F"""
+"""3D6F9F519E16EEAC_0C80AEE951AA291A_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](C)(=O)=O)CCNC2CC2""",21,"""ED88C02CF4DE5C7F"""
+"""8631F551D7FBE8B7_B31CEB9698BEAAB2_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""ED88C02CF4DE5C7F"""
+"""5D0933119122F217_04921BE5DAC24CBB_6036_UN""","""NC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2CCNCC2""",21,"""ED88C02CF4DE5C7F"""
+"""3373567B54D2270F_AA0078A500D54314_6036_UN""","""NC1=CC=C(C=C1)OCCN2[S](CCC2C(OC)=O)(=O)=O""",21,"""ED88C02CF4DE5C7F"""
+"""6473A36FF5314C6A_B224A94932108FA3_6036_UN""","""NC1=CC=C(C=C1)OCCN2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""ED88C02CF4DE5C7F"""
+"""DACC096DBEF5CBCF_5268E01F6FB20CCF_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](C)(=O)=O)CC2=CC=NO2""",21,"""ED88C02CF4DE5C7F"""
+"""8E41BF7198C930F8_1E065D1C53B450EB_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](C)(=O)=O)C2CCNCC2""",21,"""ED88C02CF4DE5C7F"""
+"""721CF949ACA0DFEA_611D885DCC909D85_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](C)(=O)=O)C2=NC=CC=C2""",21,"""ED88C02CF4DE5C7F"""
+"""D8B3D58D030DA5B3_B162DB5F96BFB563_6036_UN""","""NC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""ED88C02CF4DE5C7F"""
+"""4E8071AC80CD4278_6353080DFE13156B_6036_UN""","""NC1=CC=C(C=C1)OCCN(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""ED88C02CF4DE5C7F"""
+"""E5152871901BEFB5_D802D196F6843A2F_6036_UN""","""NC1=CC=C(C=C1)OCCN(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""ED88C02CF4DE5C7F"""
+"""D6C451773EFFD7BB_2AA38A85BE9FE415_6036_UN""","""NC1=CC=C(C=C1)OCCN2CCCC(C(C)C)[S]2(=O)=O""",21,"""ED88C02CF4DE5C7F"""
+"""4668F5D3261849F0_0AB79E0CBE5FA429_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](C)(=O)=O)CC2CNCC2""",21,"""ED88C02CF4DE5C7F"""
+"""9B1586C8D08D11E6_36CB251AE9AA0B9F_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""ED88C02CF4DE5C7F"""
+"""D08DBFA03D55B0FF_3F83388394AC7AE0_6036_UN""","""NC1=CC=C(C=C1)OCCN(CCCCl)[S](=O)(=O)C2CC2""",21,"""ED88C02CF4DE5C7F"""
+"""C9DEDCFFC97B5AF2_9DB6E15BE97BD26B_6036_UN""","""NC1=CC=C(C=C1)OCCN2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""ED88C02CF4DE5C7F"""
+"""E9A5C0030FC7AA63_8CA23278FA0EE15F_6036_UN""","""NC1=CC=C(C=C1)OCCN(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""ED88C02CF4DE5C7F"""
+"""4623AB4F51342FAC_79140C5400950F64_6036_UN""","""NC1=CC=C(C=C1)OCCN(CCCN)[S](=O)(=O)C2CC2""",21,"""ED88C02CF4DE5C7F"""
+"""76054C6C6CEA6D05_4510384D4882190A_6036_UN""","""NC1=CC=C(C=C1)OCCN2CCCC(CC=C)[S]2(=O)=O""",21,"""ED88C02CF4DE5C7F"""
+"""DADE4F20A684BEDE_AC66026A59ACD355_6036_UN""","""NC1=CC=C(C=C1)OCCN(CCCN)[S](=O)(=O)C(F)F""",21,"""ED88C02CF4DE5C7F"""
+"""00AE3971406F7F2A_5F66A887C3B33C81_6036_UN""","""NC1=CC=C(C=C1)OCCN2[S](C3(CC2CI)CC3)(=O)=O""",21,"""ED88C02CF4DE5C7F"""
+"""7662A0A83CA274CC_5608B8643AA6A33E_6036_UN""","""NC1=CC=C(C=C1)OCCN2CCCCNCC[S]2(=O)=O""",21,"""ED88C02CF4DE5C7F"""
+"""36DC4EB316A66E57_22507FC7398F7F96_6036_UN""","""NC1=CC=C(C=C1)OCCN2[S](=O)(=O)C3(C2)CCOCC3""",21,"""ED88C02CF4DE5C7F"""
+"""CF8F40EBBE150A4A_CD8B8FD3EFE3B0E0_6036_UN""","""NC1=CC=C(C=C1)OCCN2C(CN)CC3([S]2(=O)=O)CC3""",21,"""ED88C02CF4DE5C7F"""
+"""0E9641A405146BBC_6A75A09B2C44A3FA_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](=O)(=O)C2CC2)C3CNC3""",21,"""ED88C02CF4DE5C7F"""
+"""2C5BC940794CB746_523251CAF4F5B1F5_6036_UN""","""NC1=CC=C(C=C1)OCCN2CC3(C[S]2(=O)=O)CCCC3""",21,"""ED88C02CF4DE5C7F"""
+"""96B093519611031F_F86C53C02D28DC53_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](=O)(=O)C2CNC2)C3CC3""",21,"""ED88C02CF4DE5C7F"""
+"""8F004F0E2F71C18A_5CCED51873443528_6036_UN""","""NC1=CC=C(C=C1)OCCN([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""ED88C02CF4DE5C7F"""
+"""D46473771F5FF116_4C820B642A43FECD_6036_UN""","""NC1=CC=C(C=C1)OCCN(CCC)[S](=O)(=O)C(F)(F)F""",21,"""ED88C02CF4DE5C7F"""
+"""7F211DE916A7C45F_0619DE54BFF15EAA_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](CC)(=O)=O)CC(=O)OC""",21,"""EDCD969CC6E3C025"""
+"""0D049251DD906431_25446BF00032B637_6036_UN""","""NCCC(C1=CC=CC=C1)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""EDCD969CC6E3C025"""
+"""1214C7431F6C095C_0F334489D2B9AB91_6036_UN""","""NCCC(C1=CC=CC=C1)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""EDCD969CC6E3C025"""
+"""D5E5EAFD57005A8C_5D8653601E211E0E_6036_UN""","""NCCC(C1=CC=CC=C1)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""EDCD969CC6E3C025"""
+"""F1C88D01E0A8E46E_3CCD80C3AE3A7DF4_6036_UN""","""NCCC(C1=CC=CC=C1)N(C)[S](=O)(=O)C2CCCNC2""",21,"""EDCD969CC6E3C025"""
+"""7AC6427E3B3123F0_0ACFBCE99C5B3146_6036_UN""","""NCCC(C1=CC=CC=C1)N(C)[S](=O)(=O)CC2CCCN2""",21,"""EDCD969CC6E3C025"""
+"""8EF4ABA583541CDB_2E10FF5437E04150_6036_UN""","""NCCC(C1=CC=CC=C1)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""EDCD969CC6E3C025"""
+"""7A537ADCDED521F9_E134CA4076BD88F0_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C)(=O)=O)C2CCCNC2""",21,"""EDCD969CC6E3C025"""
+"""37C2FD53A16B8366_3473CDD9853B35BA_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""EDCD969CC6E3C025"""
+"""347EEF708C61E4CE_8C35F97C13EB48C1_6036_UN""","""NCCC(C1=CC=CC=C1)N(CC)[S](=O)(=O)C2CCNC2""",21,"""EDCD969CC6E3C025"""
+"""C6CF33F3B732D708_49967746AF2B6738_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""EDCD969CC6E3C025"""
+"""C76D5ACEFF5BAC04_ECCDE222EDCE60CF_6036_UN""","""NCCC(C1=CC=CC=C1)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""EDCD969CC6E3C025"""
+"""9B4DFB221C2A95B3_E25C9568D4A81340_6036_UN""","""NCCC(C1=CC=CC=C1)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""EDCD969CC6E3C025"""
+"""8BD36AB98F803AA6_0CC5F8596397B540_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C)(=O)=O)CCNC2CC2""",21,"""EDCD969CC6E3C025"""
+"""9407DB82D7C27AA9_B359BD26AA8336E8_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""EDCD969CC6E3C025"""
+"""135BBC96B971B58E_04D74D55E8FFD0E1_6036_UN""","""NCCC(C1=CC=CC=C1)N(C)[S](=O)(=O)C2CCNCC2""",21,"""EDCD969CC6E3C025"""
+"""26E7A9F2BA7BBFB8_AA452E1532E8DF4E_6036_UN""","""NCCC(C1=CC=CC=C1)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""EDCD969CC6E3C025"""
+"""65FBBD178C5D1575_B261FFF9002D13F9_6036_UN""","""NCCC(C1=CC=CC=C1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""EDCD969CC6E3C025"""
+"""2E6CC65FB33C2830_522DB6AF5D8F9095_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""EDCD969CC6E3C025"""
+"""4FFCDC21B4C62F9F_1E430BAC6189CCB1_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C)(=O)=O)C2CCNCC2""",21,"""EDCD969CC6E3C025"""
+"""5F07C577278707BD_6158DEEDFEAD01DF_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""EDCD969CC6E3C025"""
+"""388F30A22FA7527A_B1278DEFA4822939_6036_UN""","""NCCC(C1=CC=CC=C1)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""EDCD969CC6E3C025"""
+"""2512CA8D301C5545_63165EBDCC2E8931_6036_UN""","""NCCC(C1=CC=CC=C1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""EDCD969CC6E3C025"""
+"""2FD2139C8A5AC389_D8478726C4B9A675_6036_UN""","""NCCC(C1=CC=CC=C1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""EDCD969CC6E3C025"""
+"""8A634DA3D1FAF659_2AE6DC358CA2784F_6036_UN""","""NCCC(C1=CC=CC=C1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""EDCD969CC6E3C025"""
+"""819734534AC8E746_0AF2C8BC8C623873_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C)(=O)=O)CC2CNCC2""",21,"""EDCD969CC6E3C025"""
+"""011E310CAF664CBE_368E73AADB9797C5_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""EDCD969CC6E3C025"""
+"""C4C1499033DA7034_3FC66E33A691E6BA_6036_UN""","""NCCC(C1=CC=CC=C1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""EDCD969CC6E3C025"""
+"""2B14DD55B3EB2BD8_9DF3B7EBDB464E31_6036_UN""","""NCCC(C1=CC=CC=C1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""EDCD969CC6E3C025"""
+"""A82D380837D6F268_8CE764C8C8337D05_6036_UN""","""NCCC(C1=CC=CC=C1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""EDCD969CC6E3C025"""
+"""438744D3796A3C04_79515AE432A8933E_6036_UN""","""NCCC(C1=CC=CC=C1)N(CCCN)[S](=O)(=O)C2CC2""",21,"""EDCD969CC6E3C025"""
+"""FCFBEF867BF71186_45556EFD7ABF8550_6036_UN""","""NCCC(C1=CC=CC=C1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""EDCD969CC6E3C025"""
+"""1C07509D9C0117EA_AC2354DA6B914F0F_6036_UN""","""NCCC(C1=CC=CC=C1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""EDCD969CC6E3C025"""
+"""BA1F741F2DBC589A_5F23FE37F18EA0DB_6036_UN""","""NCCC(C1=CC=CC=C1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""EDCD969CC6E3C025"""
+"""14BC2968FE0E8C71_564DEED4089B3F64_6036_UN""","""NCCC(C1=CC=CC=C1)N2CCCCNCC[S]2(=O)=O""",21,"""EDCD969CC6E3C025"""
+"""E3FBFD5D7C129B9A_221529770BB2E3CC_6036_UN""","""NCCC(C1=CC=CC=C1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""EDCD969CC6E3C025"""
+"""10F1028002AE4DFD_CDCED963DDDE2CBA_6036_UN""","""NCCC(C1=CC=CC=C1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""EDCD969CC6E3C025"""
+"""CC5284372614FD02_6A30F62B1E793FA0_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""EDCD969CC6E3C025"""
+"""007299588B95959F_5277077AC6C82DAF_6036_UN""","""NCCC(C1=CC=CC=C1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""EDCD969CC6E3C025"""
+"""3C1E6BA54E73B57F_F82905701F154009_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""EDCD969CC6E3C025"""
+"""20CB4CB47DD81D51_5C8B83A84179A972_6036_UN""","""NCCC(C1=CC=CC=C1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""EDCD969CC6E3C025"""
+"""10DA2566A361E328_4CC75DD4187E6297_6036_UN""","""NCCC(C1=CC=CC=C1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""EDCD969CC6E3C025"""
+"""97AB20916F619D9F_19D778904562651E_2267_UN""","""C[N]1C=NC=C1C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""EE3DA886BCDDE407"""
+"""CE145FBF9781A1A0_8704F1C6AA95324D_2267_UN""","""C[N]1C=NC=C1C#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""EE3DA886BCDDE407"""
+"""3B74CB31AD10405D_63FA028548A52FE8_2267_UN""","""C[N]1C=NC=C1C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""EE3DA886BCDDE407"""
+"""0F01162769AB41E3_04CCF46BFB3BAC63_2267_UN""","""C[N]1C=NC=C1C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""EE3DA886BCDDE407"""
+"""E3EAC456B26190F7_8F4D5F997D296572_2267_UN""","""C[N]1C=NC=C1C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""EE3DA886BCDDE407"""
+"""09446DA6A5701617_7FC64D1ECB6D8D27_2267_UN""","""C[N]1C=NC=C1C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""EE3DA886BCDDE407"""
+"""83525D990B3E7733_BFC94CC341BFD1BC_2267_UN""","""C[N]1C=NC=C1C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""EE3DA886BCDDE407"""
+"""E7BA94E668CA42FD_F8ACD6BB3B2FF6D0_2267_UN""","""C[N]1C=NC=C1C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""EE3DA886BCDDE407"""
+"""E85E2571B161C7B6_F781866E1585753C_2267_UN""","""C[N]1C=NC=C1C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""EE3DA886BCDDE407"""
+"""430DF4A9D55DB616_917DB8A5B490185A_2267_UN""","""C[N]1C=NC=C1C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""EE3DA886BCDDE407"""
+"""6D3D6D0B327AA153_3BA908E23A5302F5_2267_UN""","""C[N]1C=NC=C1C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""EE3DA886BCDDE407"""
+"""CD4531C832A67C28_DB2D5BEF72B15A2B_2267_UN""","""C[N]1C=NC=C1C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""EE3DA886BCDDE407"""
+"""F801F86F4BEE7F45_BE0694199922DC22_2267_UN""","""C[N]1C=NC=C1C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""EE3DA886BCDDE407"""
+"""CC5912E6D51CCCAC_7C2CA0A772B21670_2267_UN""","""C[N]1C=NC=C1C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""EE3DA886BCDDE407"""
+"""A70C0B3BD9741998_C2E19F4ED4B901FF_2267_UN""","""C[N]1C=NC=C1C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""EE3DA886BCDDE407"""
+"""382242D2F4FCF3BC_EA0A8E06CEFC6AF2_2267_UN""","""C[N]1C=NC=C1C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""EE3DA886BCDDE407"""
+"""3DD656FBDA01ACC2_297578EFCC74B1CC_2267_UN""","""C[N]1C=NC=C1C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""EE3DA886BCDDE407"""
+"""7C8FDBF0DB5879A6_FC655A535D3C2F9F_2267_UN""","""C[N]1C=NC=C1C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""EE3DA886BCDDE407"""
+"""5DB27D32A8CAD99B_5FDB135ED3A548F3_2267_UN""","""C[N]1C=NC=C1C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""EE3DA886BCDDE407"""
+"""504E5FA63FD24D11_74D4BE4A2CDB02D0_2267_UN""","""C[N]1C=NC=C1C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""EE3DA886BCDDE407"""
+"""82361351F4C98C64_9859CF695CE32B0D_2267_UN""","""C[N]1C=NC=C1C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""EE3DA886BCDDE407"""
+"""FF5941835727B611_62E4D45562CB570B_2267_UN""","""C[N]1C=NC=C1C#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""EE3DA886BCDDE407"""
+"""52753947DA205C0F_C4884030400E90CF_2267_UN""","""C[N]1C=NC=C1C#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""EE3DA886BCDDE407"""
+"""1596B7F469466B0F_4EE5713F47801B9B_2267_UN""","""C[N]1C=NC=C1C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""EE3DA886BCDDE407"""
+"""8682FD27BEC676B4_9273B1ED224BE1D0_2267_UN""","""C[N]1C=NC=C1C#CC2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""EE3DA886BCDDE407"""
+"""F40F8C78D9933D72_246125EB26AC8E7C_2267_UN""","""C[N]1C=NC=C1C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""EE3DA886BCDDE407"""
+"""AD467C9E446E3BDC_216CBC904E5BE9E9_2267_UN""","""C[N]1C=NC=C1C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""EE3DA886BCDDE407"""
+"""B67555A5D89B8EF2_D8A974D8FC8347C3_2267_UN""","""C[N]1C=NC=C1C#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""EE3DA886BCDDE407"""
+"""E325C248347E3CA7_FC737002AA2D4C4B_2267_UN""","""C[N]1C=NC=C1C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""EE3DA886BCDDE407"""
+"""10D4B9D991B9A910_8B1BCD106DF8263C_2267_UN""","""C[N]1C=NC=C1C#CC2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""EE3DA886BCDDE407"""
+"""9DCD4459235595CE_5D502932A527FF0D_2267_UN""","""C[N]1C=NC=C1C#CC2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""EE3DA886BCDDE407"""
+"""1B95F27FB0A6249F_79CFD6DA9DD925B6_2267_UN""","""C[N]1C=NC=C1C#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""EE3DA886BCDDE407"""
+"""F8D98F119AD7DF12_F6DF21465C55443F_2267_UN""","""C[N]1C=NC=C1C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""EE3DA886BCDDE407"""
+"""03FF622A8FA18C76_BFCA0CF7D3FD5B2C_2267_UN""","""C[N]1C=NC=C1C#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""EE3DA886BCDDE407"""
+"""388E67E0AA622479_63EE3695EC7A65A6_2267_UN""","""C[N]1C=NC=C1C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""EE3DA886BCDDE407"""
+"""DBF7379BD278378F_AC5C2263FBE28817_2267_UN""","""C[N]1C=NC=C1C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""EE3DA886BCDDE407"""
+"""1CEBF38201618289_E876D5C66CCC5CC1_2267_UN""","""C[N]1C=NC=C1C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""EE3DA886BCDDE407"""
+"""943DC4D4FB352C90_93D05B9B84BC7991_2267_UN""","""C[N]1C=NC=C1C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""EE3DA886BCDDE407"""
+"""FFC8812A08D0731F_A176E303FF5351CB_2267_UN""","""C[N]1C=NC=C1C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""EE3DA886BCDDE407"""
+"""F9B3650853F6D4D9_9455EBC4C9262AC4_2267_UN""","""C[N]1C=NC=C1C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""EE3DA886BCDDE407"""
+"""C19B8D468C9A82B4_CCE7219E097ADFD1_2267_UN""","""C[N]1C=NC=C1C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""EE3DA886BCDDE407"""
+"""B1DC62A2BDE7E130_948156F017282648_2267_UN""","""C[N]1C=NC=C1C#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""EE3DA886BCDDE407"""
+"""398BAC90F59CA7D8_18EE0B8CA14B0F80_2267_UN""","""C(#CCNC1CCC1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""EF04DB9A58F48E99"""
+"""1FEB3CE49D28755D_863D82DA4EBC58D3_2267_UN""","""C(#CCNC1CCC1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""EF04DB9A58F48E99"""
+"""EA2C9A37F27D69C4_62C37199AC8C4576_2267_UN""","""C(#CCNC1CCC1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""EF04DB9A58F48E99"""
+"""6CE6D5075C4ED92E_05F587771F12C6FD_2267_UN""","""C(#CCNC1CCC1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""EF04DB9A58F48E99"""
+"""E3498C1E6AF0CFBA_8E742C8599000FEC_2267_UN""","""C(#CCNC1CCC1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""EF04DB9A58F48E99"""
+"""B32E2506845B724D_7EFF3E022F44E7B9_2267_UN""","""C(#CCNC1CCC1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""EF04DB9A58F48E99"""
+"""B71003ECD096CC12_BEF03FDFA596BB22_2267_UN""","""C(#CCNC1CCC1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""EF04DB9A58F48E99"""
+"""1DF6C1CFB29BF8EA_F995A5A7DF069C4E_2267_UN""","""C(#CCNC1CCC1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""EF04DB9A58F48E99"""
+"""D3C76A87B6C207D1_F6B8F572F1AC1FA2_2267_UN""","""C(#CCNC1CCC1)C2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""EF04DB9A58F48E99"""
+"""E49165B2538B15C8_9044CBB950B972C4_2267_UN""","""C(#CCNC1CCC1)C2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""EF04DB9A58F48E99"""
+"""096DDFDD87149BB4_3A907BFEDE7A686B_2267_UN""","""C(#CCNC1CCC1)C2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""EF04DB9A58F48E99"""
+"""4BB0A9294221F66D_DA1428F3969830B5_2267_UN""","""C(#CCNC1CCC1)C2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""EF04DB9A58F48E99"""
+"""28E6F12BAA8D9B00_BF3FE7057D0BB6BC_2267_UN""","""C(#CCNC1CCC1)C2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""EF04DB9A58F48E99"""
+"""70BF1AD315417EBF_7D15D3BB969B7CEE_2267_UN""","""C(#CCNC1CCC1)C3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""EF04DB9A58F48E99"""
+"""FDB617BE7CD21178_C3D8EC5230906B61_2267_UN""","""C(#CCNC1CCC1)C2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""EF04DB9A58F48E99"""
+"""27C6789D1FC9E8B3_EB33FD1A2AD5006C_2267_UN""","""C(#CCNC1CCC1)C2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""EF04DB9A58F48E99"""
+"""ADC6E452FFCE7525_284C0BF3285DDB52_2267_UN""","""C(#CCNC1CCC1)C2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""EF04DB9A58F48E99"""
+"""F862FC24DF1AB96F_FD5C294FB9154501_2267_UN""","""C(#CCNC1CCC1)C3=CC=C(CC2(C)NCCC2)C=C3""",21,"""EF04DB9A58F48E99"""
+"""B059C22051162523_5EE26042378C226D_2267_UN""","""C(#CCNC1CCC1)C2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""EF04DB9A58F48E99"""
+"""A5B8EAD64B8B9735_75EDCD56C8F2684E_2267_UN""","""C(#CCNC1CCC1)C2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""EF04DB9A58F48E99"""
+"""7778662B56C65842_9960BC75B8CA4193_2267_UN""","""C(#CCNC1CCC1)C2=CC=C(C=C2)C3NCCNC3=O""",21,"""EF04DB9A58F48E99"""
+"""A6125BCC6322FF27_63DDA74986E23D95_2267_UN""","""C(#CCNC1CCC1)C2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""EF04DB9A58F48E99"""
+"""FAADCBAFDCAFBAF0_C5B1332CA427FA51_2267_UN""","""C(#CCNC1CCC1)C(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""EF04DB9A58F48E99"""
+"""5D9C09F87AC6DC18_4FDC0223A3A97105_2267_UN""","""C(#CCNC1CCC1)C2=C[N](CC(OCC)OCC)N=C2""",21,"""EF04DB9A58F48E99"""
+"""BBFA4463373AF7EE_934AC2F1C6628B4E_2267_UN""","""C(#CCNC1CCC1)C2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""EF04DB9A58F48E99"""
+"""C111FFFB355DA3D3_255856F7C285E4E2_2267_UN""","""C(#CCNC1CCC1)C2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""EF04DB9A58F48E99"""
+"""C9ECA80A8206E16A_2055CF8CAA728377_2267_UN""","""C(#CCNC1CCC1)C3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""EF04DB9A58F48E99"""
+"""0D5A220B716874E6_D99007C418AA2D5D_2267_UN""","""C(#CCNC1CCC1)C2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""EF04DB9A58F48E99"""
+"""25452B92B64158C9_FD4A031E4E0426D5_2267_UN""","""C(#CCNC1CCC1)C2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""EF04DB9A58F48E99"""
+"""6C79F14F59E28BF2_8A22BE0C89D14CA2_2267_UN""","""C(#CCNC1CCC1)C2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""EF04DB9A58F48E99"""
+"""FA95E8E0B252C5F3_5C695A2E410E9593_2267_UN""","""C(#CCNC1CCC1)C2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""EF04DB9A58F48E99"""
+"""8AC31D53892027F5_78F6A5C679F04F28_2267_UN""","""C(#CCNC1CCC1)C2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""EF04DB9A58F48E99"""
+"""93F39AE62FA28DE0_F7E6525AB87C2EA1_2267_UN""","""C(#CCNC1CCC1)C2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""EF04DB9A58F48E99"""
+"""26DD6722A1142AE6_BEF37FEB37D431B2_2267_UN""","""C(#CCNC1CCC1)C2=CC=C(C=C2)CN3CCCCC3""",21,"""EF04DB9A58F48E99"""
+"""C26A667EB64B202E_62D7458908530F38_2267_UN""","""C(#CCNC1CCC1)C2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""EF04DB9A58F48E99"""
+"""74D1426DC9739AF8_AD65517F1FCBE289_2267_UN""","""C(#CCNC1CCC1)C2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""EF04DB9A58F48E99"""
+"""2BA2C53FE112F9D1_E94FA6DA88E5365F_2267_UN""","""C(#CCNC1CCC1)C2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""EF04DB9A58F48E99"""
+"""830776C2DA263E90_92E928876095130F_2267_UN""","""C(#CCNC1CCC1)C3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""EF04DB9A58F48E99"""
+"""5F41985246AAE671_A04F901F1B7A3B55_2267_UN""","""C(#CCNC1CCC1)C2=CC=C(CCCCC(O)=O)C=C2""",21,"""EF04DB9A58F48E99"""
+"""DC904422ED572757_956C98D82D0F405A_2267_UN""","""C(#CCNC1CCC1)C2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""EF04DB9A58F48E99"""
+"""BDD3E40EB85D01A5_CDDE5282ED53B54F_2267_UN""","""C(#CCNC1CCC1)C2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""EF04DB9A58F48E99"""
+"""48762AFA9D121636_95B825ECF3014CD6_2267_UN""","""C(#CCNC1CCC1)C3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""EF04DB9A58F48E99"""
+"""2DD2789867DD3C32_18F9FA565EEC821A_2267_UN""","""C(#CC1NCCCC1)C2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""EF132A40A7530303"""
+"""7892473C8255A2AF_862A7300B11BD549_2267_UN""","""C(#CC1NCCCC1)C2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""EF132A40A7530303"""
+"""56CDC1F09AF53A71_62D48043532BC8EC_2267_UN""","""C(#CC1NCCCC1)C3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""EF132A40A7530303"""
+"""057D5B386A0E7421_05E276ADE0B54B67_2267_UN""","""C(#CC1NCCCC1)C2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""EF132A40A7530303"""
+"""F072BBC0784F0AF0_8E63DD5F66A78276_2267_UN""","""C(#CC1NCCCC1)C3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""EF132A40A7530303"""
+"""A5453709A6448998_7EE8CFD8D0E36A23_2267_UN""","""C(#CC1NCCCC1)C3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""EF132A40A7530303"""
+"""A924D0EE0F6455E8_BEE7CE055A3136B8_2267_UN""","""C(#CC1NCCCC1)C2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""EF132A40A7530303"""
+"""71B4A7E3E90AE9BF_F982547D20A111D4_2267_UN""","""C(#CC1NCCCC1)C2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""EF132A40A7530303"""
+"""5F5A964DEB5D02C7_F6AF04A80E0B9238_2267_UN""","""C(#CC1NCCCC1)C2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""EF132A40A7530303"""
+"""08A0A10C69CD4976_90533A63AF1EFF5E_2267_UN""","""C(#CC1NCCCC1)C2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""EF132A40A7530303"""
+"""5F8F105F223ED108_3A878A2421DDE5F1_2267_UN""","""C(#CC1NCCCC1)C2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""EF132A40A7530303"""
+"""88E7F8F493D7F7A7_DA03D929693FBD2F_2267_UN""","""C(#CC1NCCCC1)C2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""EF132A40A7530303"""
+"""380E7F73A52BDFDB_BF2816DF82AC3B26_2267_UN""","""C(#CC1NCCCC1)C2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""EF132A40A7530303"""
+"""51EF621B78C73C30_7D022261693CF174_2267_UN""","""C(#CC1NCCCC1)C3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""EF132A40A7530303"""
+"""0E739B1338676BFF_C3CF1D88CF37E6FB_2267_UN""","""C(#CC1NCCCC1)C2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""EF132A40A7530303"""
+"""243CC1CF8C77B6FC_EB240CC0D5728DF6_2267_UN""","""C(#CC1NCCCC1)C2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""EF132A40A7530303"""
+"""90A6DA1339171921_285BFA29D7FA56C8_2267_UN""","""C(#CC1NCCCC1)C2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""EF132A40A7530303"""
+"""9AA844B2DEF0D4C1_FD4BD89546B2C89B_2267_UN""","""C(#CC1NCCCC1)C3=CC=C(CC2(C)NCCC2)C=C3""",21,"""EF132A40A7530303"""
+"""E9F2AABBAA3EDF32_5EF59198C82BAFF7_2267_UN""","""C(#CC1NCCCC1)C2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""EF132A40A7530303"""
+"""868A042A64071299_75FA3C8C3755E5D4_2267_UN""","""C(#CC1NCCCC1)C2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""EF132A40A7530303"""
+"""A06E98889264852C_99774DAF476DCC09_2267_UN""","""C(#CC1NCCCC1)C2=CC=C(C=C2)C3NCCNC3=O""",21,"""EF132A40A7530303"""
+"""E00BB735DD3E09A9_63CA56937945B00F_2267_UN""","""C(#CC1NCCCC1)C2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""EF132A40A7530303"""
+"""6BDF06EDBA318008_C5A6C2F65B8077CB_2267_UN""","""C(#CC1NCCCC1)C(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""EF132A40A7530303"""
+"""27F47C457E59CD82_4FCBF3F95C0EFC9F_2267_UN""","""C(#CC1NCCCC1)C2=C[N](CC(OCC)OCC)N=C2""",21,"""EF132A40A7530303"""
+"""8E05874366CD1BA9_935D332B39C506D4_2267_UN""","""C(#CC1NCCCC1)C2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""EF132A40A7530303"""
+"""AEC14956E037BF93_254FA72D3D226978_2267_UN""","""C(#CC1NCCCC1)C2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""EF132A40A7530303"""
+"""FAF73AAE325FB91B_20423E5655D50EED_2267_UN""","""C(#CC1NCCCC1)C3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""EF132A40A7530303"""
+"""8FB2A9A22920AF57_D987F61EE70DA0C7_2267_UN""","""C(#CC1NCCCC1)C2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""EF132A40A7530303"""
+"""E9D91867877A199A_FD5DF2C4B1A3AB4F_2267_UN""","""C(#CC1NCCCC1)C2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""EF132A40A7530303"""
+"""37ADA32EE034EAA0_8A354FD67676C138_2267_UN""","""C(#CC1NCCCC1)C2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""EF132A40A7530303"""
+"""98A1765581C651F9_5C7EABF4BEA91809_2267_UN""","""C(#CC1NCCCC1)C2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""EF132A40A7530303"""
+"""0652C522EB5DC9D6_78E1541C8657C2B2_2267_UN""","""C(#CC1NCCCC1)C2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""EF132A40A7530303"""
+"""9C619C1A566F1C4A_F7F1A38047DBA33B_2267_UN""","""C(#CC1NCCCC1)C2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""EF132A40A7530303"""
+"""586796224D3AF9D7_BEE48E31C873BC28_2267_UN""","""C(#CC1NCCCC1)C2=CC=C(C=C2)CN3CCCCC3""",21,"""EF132A40A7530303"""
+"""522E088B6D04C098_62C0B453F7F482A2_2267_UN""","""C(#CC1NCCCC1)C2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""EF132A40A7530303"""
+"""4CC69085C336461C_AD72A0A5E06C6F13_2267_UN""","""C(#CC1NCCCC1)C2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""EF132A40A7530303"""
+"""EEE9A24263DB4BAC_E95857007742BBC5_2267_UN""","""C(#CC1NCCCC1)C2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""EF132A40A7530303"""
+"""74BEF88F20D8F051_92FED95D9F329E95_2267_UN""","""C(#CC1NCCCC1)C3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""EF132A40A7530303"""
+"""22F8D427C24BA80B_A05861C5E4DDB6CF_2267_UN""","""C(#CC1NCCCC1)C2=CC=C(CCCCC(O)=O)C=C2""",21,"""EF132A40A7530303"""
+"""E32DDD00C241857C_957B6902D2A8CDC0_2267_UN""","""C(#CC1NCCCC1)C2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""EF132A40A7530303"""
+"""AEEDA77A0A6EAE27_CDC9A35812F438D5_2267_UN""","""C(#CC1NCCCC1)C2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""EF132A40A7530303"""
+"""A9B0E3B017E715E7_95AFD4360CA6C14C_2267_UN""","""C(#CC1NCCCC1)C3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""EF132A40A7530303"""
+"""A7079D99F3F56B09_1BF5669C829D31E0_7019_UN""","""COC(=O)C(C)(C)C=CC1=CSC(=N1)C2=CC=C(Cl)C=C2""",21,"""F2E8BFF5E8398299"""
+"""9DA3C3C22D5B32C0_2300DCEDC7C9A9D0_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC1=CC=CC(=C1N=C2Cl)C""",21,"""F2E8BFF5E8398299"""
+"""F592ABB3538EC3A4_441829F1795FD333_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC1=C(C=C(C)C=C1)N=C2Cl""",21,"""F2E8BFF5E8398299"""
+"""DACAC2345B1CC2EC_27B72598D2E3FFA7_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC=C(C1=CC=C(Cl)C=C1)O2""",21,"""F2E8BFF5E8398299"""
+"""8513CB8233A95EA5_3FBFE95C66B2162B_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC(=C1OCCCOC1=C2)Cl""",21,"""F2E8BFF5E8398299"""
+"""3329D1AAA8F13108_E8330190D576AD4E_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(Cl)N=C(S1)N2CCCCC2""",21,"""F2E8BFF5E8398299"""
+"""63CFE293ADD08F52_8E7EAB10FC2A77FE_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC1=C(C=CC(=C1)C)N=C2Cl""",21,"""F2E8BFF5E8398299"""
+"""EF570844EDAE6EA9_FB39A80798D8D46A_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC=C(C1=CC=C(Cl)C=C1)S2""",21,"""F2E8BFF5E8398299"""
+"""47D6EB4E93D0DB2E_25A9B4AD9F51ECA6_7019_UN""","""COC(=O)C(C)(C)C=CC2=C[N](C1=CC=C(Cl)C=C1)N=C2""",21,"""F2E8BFF5E8398299"""
+"""BDB140AD909BD37B_3C8438D680145758_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC1=C(C(=CC(=C1)Cl)Cl)OC2""",21,"""F2E8BFF5E8398299"""
+"""28222E9F8C880478_CC90FA8EA23F49EE_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC=C(C1=CC=CC(=C1)Cl)S2""",21,"""F2E8BFF5E8398299"""
+"""4C6C0BE902661D8A_C6F60C01928C7229_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(OC(F)F)C(=CC(=C1)Cl)Cl""",21,"""F2E8BFF5E8398299"""
+"""7B4B0D56C8B5FD40_D86F2C64F761E9FF_7019_UN""","""COC(=O)C(C)(C)C=CC1=CC(=C(OCC)C(=C1)Cl)OC""",21,"""F2E8BFF5E8398299"""
+"""6B0725BAE8B45663_4B4C3D883533524C_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC1=C([N](N=C1C)C)N=C2Cl""",21,"""F2E8BFF5E8398299"""
+"""432D7F4CF29B8DD3_ADFF44F8C705F622_7019_UN""","""COC(=O)C(C)(C)C=CC1=C[NH]N=C1C2=CC=CC(=C2)Cl""",21,"""F2E8BFF5E8398299"""
+"""E4BD0ECF360BA2CD_62C1656341501824_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(Cl)C=CC=C1N2CCCC2""",21,"""F2E8BFF5E8398299"""
+"""A3DA4EF42EAD683B_70E3E89966842CD5_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC(=C1C=CC=CC1=C2O)Cl""",21,"""F2E8BFF5E8398299"""
+"""D3AFCA16310CBE68_75A383486A98079B_7019_UN""","""COC(=O)C(C)(C)C=CC1=C([S](CC)(=O)=O)C(=CC=C1)Cl""",21,"""F2E8BFF5E8398299"""
+"""71DAD5562954755E_E2AD589D355854B3_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(C=CC(=C1)Cl)OCC2CC2""",21,"""F2E8BFF5E8398299"""
+"""8D55E6A0C2048B66_769501FE3CEE9E86_7019_UN""","""COC(=O)C(C)(C)C=CC1=C[NH]N=C1C2=CC=C(Cl)C=C2""",21,"""F2E8BFF5E8398299"""
+"""12CC43469307A6B2_94CDFB6151D8B68F_7019_UN""","""COC(=O)C(C)(C)C=CC1=CC(=C(C(=C1)Cl)OC)OCC""",21,"""F2E8BFF5E8398299"""
+"""27FC68C18D0BD4F7_3C820160F41D3D90_7019_UN""","""COC(=O)C(C)(C)C=CC2=N[N](C1=CC=C(Cl)C=C1)N=C2""",21,"""F2E8BFF5E8398299"""
+"""4F15C224E297E97F_0530CA1AB4DA8AD3_7019_UN""","""COC(=O)C(C)(C)C=CC2=CN=C(C1=CC=CC(=C1)Cl)S2""",21,"""F2E8BFF5E8398299"""
+"""2AF8CC780A8FA268_ED7B28E28303F371_7019_UN""","""COC(=O)C(C)(C)C=CC1=CC(=C(OC(C)C)C=C1Cl)Cl""",21,"""F2E8BFF5E8398299"""
+"""90A7B0487CB3201C_05CA595DBFDC52A7_7019_DP""","""COC(=O)C(C)(C)C=CC2=C(N=C(N1CCNCC1)S2)Cl""",21,"""F2E8BFF5E8398299"""
+"""D3CE47C40A368D2E_28DB302E6BF5D5E4_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC1=C(C=CC(=C1)F)N=C2Cl""",21,"""F2E8BFF5E8398299"""
+"""BBC3BF8FF277DDD7_EF9FEBD7DDEEF4CD_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC1=C(C=C(F)C=C1)N=C2Cl""",21,"""F2E8BFF5E8398299"""
+"""8B3C07BD08EDD66E_FD09538C6438D758_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC=C(C1=C(Cl)C=CC=C1)S2""",21,"""F2E8BFF5E8398299"""
+"""48B06A4C7EC51452_8680CFE106769931_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(Cl)N=C(S1)N2CCOCC2""",21,"""F2E8BFF5E8398299"""
+"""3DB6BBC5EAD7D813_FE6096D78805AD98_7019_UN""","""COC(=O)C(C)(C)C=CC1=C[NH]C2=CC(=C(OC)C=C12)Cl""",21,"""F2E8BFF5E8398299"""
+"""CB53D1974B2CA0A0_8E33C11610EA1873_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(Cl)[N](N=C1)C2=CC=CC=C2""",21,"""F2E8BFF5E8398299"""
+"""2D3AFA1BC7FB92D2_483CCFFEF268F2A2_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(Cl)[NH]C2=C1C=C(C(=C2)Cl)Cl""",21,"""F2E8BFF5E8398299"""
+"""9C7462171C527763_1596A2AF813392B0_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(C=C(Cl)C=C1)[N]2C=NC=N2""",21,"""F2E8BFF5E8398299"""
+"""C35B6612880B8667_A1C0DC321D4FDA08_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC=C(C1=C(Cl)C=CC=C1)O2""",21,"""F2E8BFF5E8398299"""
+"""34F62AF6A808204F_9DEAC245209C85B1_7019_UN""","""COC(=O)C(C)(C)C=CC2=CN=C(C1=CC=C(Cl)C=C1)S2""",21,"""F2E8BFF5E8398299"""
+"""AD547E5B1CD94717_01C4FFBF8FC7553C_7019_UN""","""COC(=O)C(C)(C)C=CC2=C[N](C1=CC=CC(=C1)Cl)N=C2""",21,"""F2E8BFF5E8398299"""
+"""4A31343AD63D1EEB_F9871C2BE7EE3082_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(C(=C(F)C=C1)C(F)(F)F)Cl""",21,"""F2E8BFF5E8398299"""
+"""ED7460E4AC2E5105_1F051CDA0FBFCE39_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(C=C(OC)C=C1CCl)OC""",21,"""F2E8BFF5E8398299"""
+"""4F315ECEEF7098DB_9DC3B0BDD91EA276_7019_UN""","""COC(=O)C(C)(C)C=CC1=CC(=C(OC(F)(F)F)C=C1)Cl""",21,"""F2E8BFF5E8398299"""
+"""65AA72913AB12FB3_CAE294C6E168D168_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(Cl)C=CC=C1[N]2C=CN=C2""",21,"""F2E8BFF5E8398299"""
+"""CADBCA4B410A36DB_E29A12BC097CE0B7_7019_UN""","""COC(=O)C(C)(C)C=CC2=CC(=C1OCOCC1=C2)CCl""",21,"""F2E8BFF5E8398299"""
+"""278136E647ABA498_2AA2918EBB607DB9_7019_UN""","""COC(=O)C(C)(C)C=CC1=C(Cl)C=CC=C1[N]2C=CC=N2""",21,"""F2E8BFF5E8398299"""
+"""005883BA0BE2180A_4176D84D8D15D903_6031_DP""","""O(C(=O)C1CNCC2=C1C=CC(=C2)Cl)CC(C(OC)=O)N""",21,"""F33E905A6F250B0A"""
+"""0EF3CF04E26A3806_3F6ED7BABB30FB19_6031_DP""","""O(C(=O)C1CNCC2=C1C=CC(=C2)Cl)CC3CCNCC3""",21,"""F33E905A6F250B0A"""
+"""7BCD14A1E3C6D331_D3FDAD92BA7B8117_6031_DP""","""O(C(=O)C1CNCC2=C1C=CC(=C2)Cl)CC3CCCNC3""",21,"""F33E905A6F250B0A"""
+"""1D4DEAD7422F99A6_4E27521DD5708400_6031_DP""","""O(C(=O)C1CNCC2=C1C=CC(=C2)Cl)CC3NCCNC3""",21,"""F33E905A6F250B0A"""
+"""345D5E869F41F353_AA7BE0A06D24FD1E_6031_DP""","""O(C(=O)C1CNCC2=C1C=CC(=C2)Cl)CC(CC=CC)N""",21,"""F33E905A6F250B0A"""
+"""F256BAC48F987F49_E811C263D574A284_6031_DP""","""O(C(=O)C1CNCC2=C1C=CC(=C2)Cl)CC(CC(C)C)N""",21,"""F33E905A6F250B0A"""
+"""9D45FC10B751C7ED_28C76B37313117F5_6031_DP""","""O(C(=O)C1CNCC2=C1C=CC(=C2)Cl)CC3(N)CCCC3""",21,"""F33E905A6F250B0A"""
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+"""7F2B1BF2D8BFC994_EF84448EEB70237D_6031_DP""","""O(C(=O)C1=N[N](C=C1)C2CCCNC2)CC(CC(C)C)N""",21,"""F4AB16B751218AF3"""
+"""AA3664937A3211D8_2F52EDDA0F35960C_6031_DP""","""O(C(=O)C1=N[N](C=C1)C2CCCNC2)CC3(N)CCCC3""",21,"""F4AB16B751218AF3"""
+"""D6835FE27B2ACA1F_ACEB63C76D4662BD_6031_DP""","""O(C(=O)C1=N[N](C=C1)C2CCCNC2)C[C@@H]3CCCNC3""",21,"""F4AB16B751218AF3"""
+"""D3FBC7E6BB5FF172_C66C58127C4F1203_6031_DP""","""O(C(=O)C1=N[N](C=C1)C2CCCNC2)C[C@@H]3CCCCN3""",21,"""F4AB16B751218AF3"""
+"""F1121F40A328B2FF_858D1512572388E0_6031_DP""","""O(C(=O)C1=N[N](C=C1)C2CCCNC2)CC3OCCNC3""",21,"""F4AB16B751218AF3"""
+"""2E4962E0B1F9B54B_44E86A5DCEC03035_6031_DP""","""O(C(=O)C1=N[N](C=C1)C2CCCNC2)CCC3(CNC3)N""",21,"""F4AB16B751218AF3"""
+"""1F61646D61F48744_06EEA96F7F0102CC_6031_DP""","""O(C(=O)C1=N[N](C=C1)C2CCCNC2)CC(N)CC(F)F""",21,"""F4AB16B751218AF3"""
+"""844D65D3D34DBFD8_64A5CADEFF4CF9A5_6031_DP""","""O(C(=O)C1=N[N](C=C1)C2CCCNC2)C[C@@H](C(OC)=O)N""",21,"""F4AB16B751218AF3"""
+"""89FC8A1DF4E16A92_82CA218FCD071176_6031_DP""","""O(C(=O)C1=N[N](C=C1)C2CCCNC2)CC3COCCN3""",21,"""F4AB16B751218AF3"""
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+"""101875529174AD16_3DB3CFDD41617913_2267_UN""","""C[N]1N=CC=C1C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""F7EF42B0DB101368"""
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+"""19011043312458C3_FD69457083D90764_2267_UN""","""C(#CC12CC(C1)CN2)C3=C(C(OCC)=O)C=N[N]3C(C)C""",21,"""F95E63F0F1F88991"""
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+"""BF0E55E190574E11_EB06912510194209_2267_UN""","""C(#CC12CC(C1)CN2)C4=CC=C(CC3(C)NCCC3)C=C4""",21,"""F95E63F0F1F88991"""
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+"""1CCC1A3BF695541C_63B7753C61FE6F46_2267_UN""","""C(#CC12CC(C1)CN2)C3=C(C)C=C(C(=C3)C)C4OCCO4""",21,"""F95E63F0F1F88991"""
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+"""2EC4B1789074B617_9C78066620DD4BAA_2267_UN""","""C(#CC12CC(C1)CN2)C3=CC(=CC(=C3)C(F)(F)F)C(O)=O""",21,"""F95E63F0F1F88991"""
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+"""F7F456FDE3BF401E_6EAC1DACD0FC4820_2267_UN""","""C(#CC12CC(C1)CN2)C3=CC(=C(C(OC)=O)C=C3)[N](=O)=O""",21,"""F95E63F0F1F88991"""
+"""5D26953869FA1139_E1BCEA30117029A9_2267_UN""","""C(#CC12CC(C1)CN2)C3=CC(=CC=C3)CC4=CC=CC=C4""",21,"""F95E63F0F1F88991"""
+"""F21F76B2CD42EF00_A8A9C7819ED836BA_2267_UN""","""C(#CC12CC(C1)CN2)C3=CC=C(C=C3)CN4CCCCC4""",21,"""F95E63F0F1F88991"""
+"""8197B803A93001C1_748DFDE3A15F0830_2267_UN""","""C(#CC12CC(C1)CN2)C3=CC(=C(C=C3)F)C[C@H](N)C(=O)O""",21,"""F95E63F0F1F88991"""
+"""ACE023D97939F32F_BB3FE915B6C7E581_2267_UN""","""C(#CC12CC(C1)CN2)C3=C(C(OC)=O)[NH]C4=C3C=CC=C4""",21,"""F95E63F0F1F88991"""
+"""10AAB6F7A3276DA5_FF151EB021E93157_2267_UN""","""C(#CC12CC(C1)CN2)C3=C[NH]C4=C3C=NC(=N4)C(OC)=O""",21,"""F95E63F0F1F88991"""
+"""E901995E05C4308D_84B390EDC9991407_2267_UN""","""C(#CC12CC(C1)CN2)C4=CC3=C(N=C(C(O)=O)C=C3)C=C4""",21,"""F95E63F0F1F88991"""
+"""88E2503F923C3187_B6152875B2763C5D_2267_UN""","""C(#CC12CC(C1)CN2)C3=CC=C(CCCCC(O)=O)C=C3""",21,"""F95E63F0F1F88991"""
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+"""1BB4CDCECA0AD415_9CCFE206693B08C3_2267_UN""","""C[S](=O)(=O)CCC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""FDBF1519A8CF89B6"""
+"""88DA9D3FCFC514EA_6C44F081DF7FE096_2267_UN""","""C[S](=O)(=O)CCC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""FDBF1519A8CF89B6"""
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+"""A378B507855FC749_9D71310DC1984C58_6036_UN""","""NC(CN(C(C)(C)C(=N)N)[S](=O)(=O)C)C1=CC=C(C=C1)Br""",21,"""13AAF92CCB55054C"""
+"""0BC794BBA9C69C63_2620E896C90F631C_6036_UN""","""NC(CN(C)[S](=O)(=O)C1=C[N](C)C=N1)C2=CC=C(C=C2)Br""",21,"""13AAF92CCB55054C"""
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+"""939B67CE9B082660_C8E91C1AD62152AC_6036_UN""","""NC(CN([S](C)(=O)=O)[C@@H]1CNCCC1)C2=CC=C(C=C2)Br""",21,"""13AAF92CCB55054C"""
+"""C1B5107C7D3E6CEC_C1A10183AB2723D3_6036_UN""","""NC(CN(CCCCl)[S](=O)(=O)C1CC1)C2=CC=C(C=C2)Br""",21,"""13AAF92CCB55054C"""
+"""9C4A27B0F2CE104D_6394D85BD6F08B58_6036_UN""","""NC(CN1C(=O)C2=C([S]1(=O)=O)C=CS2)C3=CC=C(C=C3)Br""",21,"""13AAF92CCB55054C"""
+"""E86B3D56CECED1B8_72800B78C585B86C_6036_UN""","""NC(CN(C(C(C)(C)N)=O)[S](=O)(=O)C)C1=CC=C(C=C1)Br""",21,"""13AAF92CCB55054C"""
+"""80F377DB2FA4ABC9_873635543F1E5657_6036_UN""","""NC(CN(CCCN)[S](=O)(=O)C1CC1)C2=CC=C(C=C2)Br""",21,"""13AAF92CCB55054C"""
+"""713A873F194BFCB6_BB32014D77094039_6036_UN""","""NC(CN1CCCC(CC=C)[S]1(=O)=O)C2=CC=C(C=C2)Br""",21,"""13AAF92CCB55054C"""
+"""F56D8935D1B70641_52443B6A66278A66_6036_UN""","""NC(CN(CCCN)[S](=O)(=O)C(F)F)C1=CC=C(C=C1)Br""",21,"""13AAF92CCB55054C"""
+"""D6EBE6AC25CEA382_A1449187FC3865B2_6036_UN""","""NC(CN1[S](C2(CC1CI)CC2)(=O)=O)C3=CC=C(C=C3)Br""",21,"""13AAF92CCB55054C"""
+"""CBA6D1093AE64738_A82A8164052DFA0D_6036_UN""","""NC(CN1CCCCNCC[S]1(=O)=O)C2=CC=C(C=C2)Br""",21,"""13AAF92CCB55054C"""
+"""4252FE0E8D6D2E42_DC7246C7060426A5_6036_UN""","""NC(CN1[S](=O)(=O)C2(C1)CCOCC2)C3=CC=C(C=C3)Br""",21,"""13AAF92CCB55054C"""
+"""C6D7DEE92A7E2422_33A9B6D3D068E9D3_6036_UN""","""NC(CN1C(CN)CC2([S]1(=O)=O)CC2)C3=CC=C(C=C3)Br""",21,"""13AAF92CCB55054C"""
+"""A5B5044F9DC7308F_9457999B13CFFAC9_6036_UN""","""NC(CN([S](=O)(=O)C1CC1)C2CNC2)C3=CC=C(C=C3)Br""",21,"""13AAF92CCB55054C"""
+"""EAE546EC171C9A1B_AC1068CACB7EE8C6_6036_UN""","""NC(CN1CC2(C[S]1(=O)=O)CCCC2)C3=CC=C(C=C3)Br""",21,"""13AAF92CCB55054C"""
+"""52A1D3151DF45655_064E6AC012A38560_6036_UN""","""NC(CN([S](=O)(=O)C1CNC1)C2CC2)C3=CC=C(C=C3)Br""",21,"""13AAF92CCB55054C"""
+"""406A4E63302AC565_A2ECEC184CCF6C1B_6036_UN""","""NC(CN([S](C)(=O)=O)CC[S](=O)(=O)Cl)C1=CC=C(C=C1)Br""",21,"""13AAF92CCB55054C"""
+"""5410907D1785D18E_B2A0326415C8A7FE_6036_UN""","""NC(CN(CCC)[S](=O)(=O)C(F)(F)F)C1=CC=C(C=C1)Br""",21,"""13AAF92CCB55054C"""
+"""9627C095845F5981_CFAEF6A987A1CDC3_6016_UN""","""NC(CO)C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)OCO3""",21,"""13AAF92CCB55054C"""
+"""23CE1F6D949C5E81_F254783395EA8F04_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](CC)(=O)=O)CC(=O)OC""",21,"""198030FBECF8118B"""
+"""876B68F6F887EAC9_D109CD972A296799_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""198030FBECF8118B"""
+"""CFF0FC73A91C9F14_FB7EE2EEF8A27A3F_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""198030FBECF8118B"""
+"""3B09B237AA2C55A3_A9CBF507343ACFA0_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""198030FBECF8118B"""
+"""A456737DDA183DF4_C88026A48421AC5A_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C)[S](=O)(=O)C2CCCNC2""",21,"""198030FBECF8118B"""
+"""737A3216699AEEAC_FE821A8EB640E0E8_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C)[S](=O)(=O)CC2CCCN2""",21,"""198030FBECF8118B"""
+"""42DE06D2F6C9D7CE_DA5D59331DFB90FE_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""198030FBECF8118B"""
+"""FFE545463F072FDF_15796C275CA6595E_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C)(=O)=O)C2CCCNC2""",21,"""198030FBECF8118B"""
+"""93D98C6924ADB31D_C03E6BBEAF20E414_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""198030FBECF8118B"""
+"""949FC6B046954DCF_78785F1B39F0996F_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(CC)[S](=O)(=O)C2CCNC2""",21,"""198030FBECF8118B"""
+"""DA020EDA47D1E6ED_BDDBD1218530B696_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C(C)(C)C)(=O)=O)CC=C""",21,"""198030FBECF8118B"""
+"""B3EAF679A981E0E9_18804445C7D5B161_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""198030FBECF8118B"""
+"""FE822656532271FE_1611330FFEB3C2EE_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C(C)(C)C)[S](=O)(=O)CCN""",21,"""198030FBECF8118B"""
+"""78107BA3CBC9784E_F8885E3E498C64EE_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C)(=O)=O)CCNC2CC2""",21,"""198030FBECF8118B"""
+"""717C67B12864F842_47141B418098E746_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""198030FBECF8118B"""
+"""873BEE5E0D377D1F_F09AEB32C2E4014F_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C)[S](=O)(=O)C2CCNCC2""",21,"""198030FBECF8118B"""
+"""6F8CAD2CA3AC05DA_5E08887218F30EE0_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2[S](CCC2C(OC)=O)(=O)=O""",21,"""198030FBECF8118B"""
+"""434DFFB93A97965D_462C599E2A36C257_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""198030FBECF8118B"""
+"""7D0757C41DE30CD2_A66010C87794413B_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C)(=O)=O)CC2=CC=NO2""",21,"""198030FBECF8118B"""
+"""6B94052A788EAC78_EA0EADCB4B921D1F_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C)(=O)=O)C2CCNCC2""",21,"""198030FBECF8118B"""
+"""227A9115C35A3E57_9515788AD4B6D071_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C)(=O)=O)C2=NC=CC=C2""",21,"""198030FBECF8118B"""
+"""3C10D14DD89C87E2_456A2B888E99F897_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""198030FBECF8118B"""
+"""870554C7BAF73187_975BF8DAE635589F_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""198030FBECF8118B"""
+"""5BFEB14DEA31CC03_2C0A2141EEA277DB_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""198030FBECF8118B"""
+"""27D0538E91F90E9B_DEAB7A52A6B9A9E1_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2CCCC(C(C)C)[S]2(=O)=O""",21,"""198030FBECF8118B"""
+"""AA2E37AE9AEE6CA1_FEBF6EDBA679E9DD_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C)(=O)=O)CC2CNCC2""",21,"""198030FBECF8118B"""
+"""9E006C8083DD5015_C2C3D5CDF18C466B_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""198030FBECF8118B"""
+"""0742AFCF6654A20C_CB8BC8548C8A3714_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(CCCCl)[S](=O)(=O)C2CC2""",21,"""198030FBECF8118B"""
+"""9060244EFD2D6C0E_69BE118CF15D9F9F_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""198030FBECF8118B"""
+"""D8A96A29E26A828C_78AAC2AFE228ACAB_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""198030FBECF8118B"""
+"""D6D7C0127FCB877B_8D1CFC8318B34290_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(CCCN)[S](=O)(=O)C2CC2""",21,"""198030FBECF8118B"""
+"""E71798392D910A21_B118C89A50A454FE_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2CCCC(CC=C)[S]2(=O)=O""",21,"""198030FBECF8118B"""
+"""757E805CDCB84FE9_586EF2BD418A9EA1_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(CCCN)[S](=O)(=O)C(F)F""",21,"""198030FBECF8118B"""
+"""FC92D3EFADCD50F4_AB6E5850DB957175_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2[S](C3(CC2CI)CC3)(=O)=O""",21,"""198030FBECF8118B"""
+"""F830E468F17D56FF_A20048B32280EECA_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2CCCCNCC[S]2(=O)=O""",21,"""198030FBECF8118B"""
+"""0DC181170CFC7B1D_D6588F1021A93262_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2[S](=O)(=O)C3(C2)CCOCC3""",21,"""198030FBECF8118B"""
+"""1159B8F9D62E3967_39837F04F7C5FD14_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2C(CN)CC3([S]2(=O)=O)CC3""",21,"""198030FBECF8118B"""
+"""A448D04BD45DC030_9E7D504C3462EE0E_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](=O)(=O)C2CC2)C3CNC3""",21,"""198030FBECF8118B"""
+"""4A2EEE9D53829138_A63AA11DECD3FC01_6036_UN""","""COC1=C(C=C(C=N1)Br)CN2CC3(C[S]2(=O)=O)CCCC3""",21,"""198030FBECF8118B"""
+"""C5721963C9C2996D_0C64A317350E91A7_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](=O)(=O)C2CNC2)C3CC3""",21,"""198030FBECF8118B"""
+"""E815767DF2DCE1A4_A8C625CF6B6278DC_6036_UN""","""COC1=C(C=C(C=N1)Br)CN([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""198030FBECF8118B"""
+"""8A387EC360E0D938_B88AFBB33265B339_6036_UN""","""COC1=C(C=C(C=N1)Br)CN(CCC)[S](=O)(=O)C(F)(F)F""",21,"""198030FBECF8118B"""
+"""0DC86EBEC8DCF718_C5843F7EA00CD904_6016_UN""","""COC1=C(C=C(C=N1)C(=O)C2=CC3=C(C=C2)OCO3)CO""",21,"""198030FBECF8118B"""
+"""AA2FA004415453BD_C3B185EA71B09E6A_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](CC)(=O)=O)CC(=O)OC""",21,"""2865CD2208A200E5"""
+"""7C5B71E6A67D4A71_E0EC304ECE7376F7_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""2865CD2208A200E5"""
+"""8CAA69F152BD9BB7_CA9B1F371CF86B51_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""2865CD2208A200E5"""
+"""6744DA45F24980D7_982E08DED060DECE_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""2865CD2208A200E5"""
+"""F0EA0654A98C2B14_F965DB7D607BBD34_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C)[S](=O)(=O)C2CCCNC2""",21,"""2865CD2208A200E5"""
+"""F582B5307FB974D2_CF67E757521AF186_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C)[S](=O)(=O)CC2CCCN2""",21,"""2865CD2208A200E5"""
+"""4CC51871A28C2C7E_EBB8A4EAF9A18190_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""2865CD2208A200E5"""
+"""868AF43122F75530_249C91FEB8FC4830_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C)(=O)=O)C2CCCNC2""",21,"""2865CD2208A200E5"""
+"""95A20BB226A79011_F1DB96674B7AF57A_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""2865CD2208A200E5"""
+"""2E71A8868478223B_499DA2C2DDAA8801_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(CC)[S](=O)(=O)C2CCNC2""",21,"""2865CD2208A200E5"""
+"""9165F6E68DE29F91_8C3E2CF8616AA7F8_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""2865CD2208A200E5"""
+"""6AF169E125C540A1_2965B99C238FA00F_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""2865CD2208A200E5"""
+"""37E62C51B3925A0A_27F4CED61AE9D380_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""2865CD2208A200E5"""
+"""28AF924DE23964ED_C96DA3E7ADD67580_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C)(=O)=O)CCNC2CC2""",21,"""2865CD2208A200E5"""
+"""7DFDAB6E0171DD2A_76F1E69864C2F628_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""2865CD2208A200E5"""
+"""66DE34C7C40F803F_C17F16EB26BE1021_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C)[S](=O)(=O)C2CCNCC2""",21,"""2865CD2208A200E5"""
+"""32CD68DBD3E39906_6FED75ABFCA91F8E_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""2865CD2208A200E5"""
+"""50E6E36387CD3854_77C9A447CE6CD339_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""2865CD2208A200E5"""
+"""55E962D57D513EB8_9785ED1193CE5055_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""2865CD2208A200E5"""
+"""116600FA203AFA3C_DBEB5012AFC80C71_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C)(=O)=O)C2CCNCC2""",21,"""2865CD2208A200E5"""
+"""69EB939F6BFB329A_A4F0855330ECC11F_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""2865CD2208A200E5"""
+"""371B01917B0662AC_748FD6516AC3E9F9_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""2865CD2208A200E5"""
+"""D56444D3E36618D4_A6BE0503026F49F1_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""2865CD2208A200E5"""
+"""0356E4D1DA3A5EB3_1DEFDC980AF866B5_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""2865CD2208A200E5"""
+"""B6427E5342C40676_EF4E878B42E3B88F_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""2865CD2208A200E5"""
+"""1E12362AD47775AA_CF5A93024223F8B3_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C)(=O)=O)CC2CNCC2""",21,"""2865CD2208A200E5"""
+"""C58456D30AA7FF94_F326281415D65705_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""2865CD2208A200E5"""
+"""3A786E6A7D2F9977_FA6E358D68D0267A_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""2865CD2208A200E5"""
+"""B2FE4BD8B7FB2F21_585BEC5515078EF1_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""2865CD2208A200E5"""
+"""BC89A334BAA93B11_494F3F760672BDC5_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""2865CD2208A200E5"""
+"""06263F920C7F889F_BCF9015AFCE953FE_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(CCCN)[S](=O)(=O)C2CC2""",21,"""2865CD2208A200E5"""
+"""85E806E0AE300C93_80FD3543B4FE4590_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2CCCC(CC=C)[S]2(=O)=O""",21,"""2865CD2208A200E5"""
+"""4C7A792012AAB7F7_698B0F64A5D08FCF_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(CCCN)[S](=O)(=O)C(F)F""",21,"""2865CD2208A200E5"""
+"""6D9DC02D9B7B5ADC_9A8BA5893FCF601B_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""2865CD2208A200E5"""
+"""D5DA887DD05ADF26_93E5B56AC6DAFFA4_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2CCCCNCC[S]2(=O)=O""",21,"""2865CD2208A200E5"""
+"""143D159F50991EDC_E7BD72C9C5F3230C_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""2865CD2208A200E5"""
+"""67383FB73768424B_086682DD139FEC7A_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""2865CD2208A200E5"""
+"""30162ACA7A1502F7_AF98AD95D038FF60_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""2865CD2208A200E5"""
+"""10902CD8C1D37A57_97DF5CC40889ED6F_6036_UN""","""C(CNCC1=CC=C(Br)S1)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""2865CD2208A200E5"""
+"""054544F26F7B1EC7_3D815ECED15480C9_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""2865CD2208A200E5"""
+"""0C798749260F830B_9923D8168F3869B2_6036_UN""","""C(CNCC1=CC=C(Br)S1)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""2865CD2208A200E5"""
+"""5B85912EA6A999A2_896F066AD63FA257_6036_UN""","""C(CNCC1=CC=C(Br)S1)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""2865CD2208A200E5"""
+"""A3B2CC20BAD624B2_F461C2A74456C86A_6016_UN""","""OCCNCC1=CC=C(S1)C(=O)C2=CC3=C(C=C2)OCO3""",21,"""2865CD2208A200E5"""
+"""2CEC73F11EE29C31_C188DC8A4B4E7AAA_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](CC)(=O)=O)CC(=O)OC""",21,"""2A5C9442325CE425"""
+"""22B623B644EB4E16_E2D5692EF48D9237_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""2A5C9442325CE425"""
+"""A5EDD4AA78449739_C8A2465726068F91_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""2A5C9442325CE425"""
+"""110BEA1CB272AE00_9A1751BEEA9E3A0E_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""2A5C9442325CE425"""
+"""BDFF4BAC5DC3EE3B_FB5C821D5A8559F4_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2CCCNC2""",21,"""2A5C9442325CE425"""
+"""A1CA1CF0E01D90C1_CD5EBE3768E41546_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)CC2CCCN2""",21,"""2A5C9442325CE425"""
+"""7080E9F7FF8E7B92_E981FD8AC35F6550_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""2A5C9442325CE425"""
+"""6D53380830C9D6BF_26A5C89E8202ACF0_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)C2CCCNC2""",21,"""2A5C9442325CE425"""
+"""C2C2E0F906602892_F3E2CF07718411BA_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""2A5C9442325CE425"""
+"""888B532CCA61D226_4BA4FBA2E7546CC1_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(CC)[S](=O)(=O)C2CCNC2""",21,"""2A5C9442325CE425"""
+"""BC21C88A4E8AA197_8E0775985B944338_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""2A5C9442325CE425"""
+"""C31F5DAF259C1036_2B5CE0FC197144CF_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""2A5C9442325CE425"""
+"""2384A5667524E70D_25CD97B620173740_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""2A5C9442325CE425"""
+"""CF15B0897A219403_CB54FA8797289140_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)CCNC2CC2""",21,"""2A5C9442325CE425"""
+"""61D00660BC4DC92C_74C8BFF85E3C12E8_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""2A5C9442325CE425"""
+"""60462C563C23BC81_C3464F8B1C40F4E1_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2CCNCC2""",21,"""2A5C9442325CE425"""
+"""E8FB3147B233C1D3_6DD42CCBC657FB4E_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""2A5C9442325CE425"""
+"""CEB7A65D12929219_75F0FD27F49237F9_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""2A5C9442325CE425"""
+"""4F0226D8CB02C849_95BCB471A930B495_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""2A5C9442325CE425"""
+"""ECB6ED7B23F8EAC2_D9D209729536E8B1_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)C2CCNCC2""",21,"""2A5C9442325CE425"""
+"""F9FFD5AEF5D65681_A6C9DC330A1225DF_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""2A5C9442325CE425"""
+"""95914A256E8E5A1B_76B68F31503D0D39_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""2A5C9442325CE425"""
+"""21E820375CCE8521_A4875C633891AD31_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""2A5C9442325CE425"""
+"""95E9C71E55F2840C_1FD685F830068275_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""2A5C9442325CE425"""
+"""7049E292CF7CCA92_ED77DEEB781D5C4F_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""2A5C9442325CE425"""
+"""17A3AA2856EE3A91_CD63CA6278DD1C73_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)CC2CNCC2""",21,"""2A5C9442325CE425"""
+"""02185A92BD31A91F_F11F71742F28B3C5_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""2A5C9442325CE425"""
+"""16FA8470A33CBE76_F8576CED522EC2BA_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""2A5C9442325CE425"""
+"""F1A307642CFE8CCC_5A62B5352FF96A31_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""2A5C9442325CE425"""
+"""F04A5CAB7793496D_4B7666163C8C5905_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""2A5C9442325CE425"""
+"""A696D29962E0A777_BEC0583AC617B73E_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(CCCN)[S](=O)(=O)C2CC2""",21,"""2A5C9442325CE425"""
+"""B957CEEDD24C5E9E_82C46C238E00A150_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2CCCC(CC=C)[S]2(=O)=O""",21,"""2A5C9442325CE425"""
+"""09AB3748B5A61EC6_6BB256049F2E6B0F_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(CCCN)[S](=O)(=O)C(F)F""",21,"""2A5C9442325CE425"""
+"""B147B42EAB1AB79F_98B2FCE9053184DB_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""2A5C9442325CE425"""
+"""3B254E289576F62C_91DCEC0AFC241B64_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2CCCCNCC[S]2(=O)=O""",21,"""2A5C9442325CE425"""
+"""355DABABA70B68C4_E5842BA9FF0DC7CC_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""2A5C9442325CE425"""
+"""C2FE0743553F09E1_0A5FDBBD296108BA_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""2A5C9442325CE425"""
+"""1E0893C6FFA4B063_ADA1F4F5EAC61BA0_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""2A5C9442325CE425"""
+"""05FA73E3B16DD207_95E605A4327709AF_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""2A5C9442325CE425"""
+"""D5BAB08CCD64DF7A_3FB807AEEBAA6409_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""2A5C9442325CE425"""
+"""541E668BBAD3F4E4_9B1A8176B5C68D72_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""2A5C9442325CE425"""
+"""E326169964492044_8B565F0AECC14697_6036_UN""","""CC(C1=CC(=C(C=C1)Br)F)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""2A5C9442325CE425"""
+"""CF2E3E95FFD84687_F6589BC77EA82CAA_6016_UN""","""CC(O)C1=CC(=C(C=C1)C(=O)C2=CC3=C(C=C2)OCO3)F""",21,"""2A5C9442325CE425"""
+"""E026279C5FB10C14_AF8514AEA29EB4BA_1031_UN""","""[N]1(CCCCCC#C)C2=C(C(=C1C)C(OCC)=O)CCC2""",21,"""301EA12181A76801"""
+"""E32634E385CD045B_C7F471377818E918_2267_UN""","""NCCCCCC#CC1=CC=C(C(CCC(O)=O)=O)C=C1""",21,"""301EA12181A76801"""
+"""7E919AC38BFA7621_5927F86197EFBE4B_2267_UN""","""NCCCCCC#CC1=C(C(O)=O)C=C(C(=C1)F)[N](=O)=O""",21,"""301EA12181A76801"""
+"""2E9FD57822CBABB6_BDD90B2275DFA3EE_2267_UN""","""NCCCCCC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""301EA12181A76801"""
+"""8111D64A72AD9845_DAEFFDCCC6412065_2267_UN""","""NCCCCCC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""301EA12181A76801"""
+"""A58BE5C758022428_516E563E4053E974_2267_UN""","""NCCCCCC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""301EA12181A76801"""
+"""3B24436849BE451D_A1E544B9F6170121_2267_UN""","""NCCCCCC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""301EA12181A76801"""
+"""227BC723DEDDC8CE_61EA45647CC55DBA_2267_UN""","""NCCCCCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""301EA12181A76801"""
+"""3D06321A84876BF5_268FDF1C06557AD6_2267_UN""","""NCCCCCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""301EA12181A76801"""
+"""52A5EE80753A7F96_29A28FC928FFF93A_2267_UN""","""NCCCCCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""301EA12181A76801"""
+"""B2A84AEE92C07FD1_4F5EB10289EA945C_2267_UN""","""NCCCCCC#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""301EA12181A76801"""
+"""A2F5BBC4B63C7ED3_E58A014507298EF3_2267_UN""","""NCCCCCC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""301EA12181A76801"""
+"""FBD7B4BDEA3A2888_050E52484FCBD62D_2267_UN""","""NCCCCCC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""301EA12181A76801"""
+"""A2F81253FE9B5925_60259DBEA4585024_2267_UN""","""NCCCCCC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""301EA12181A76801"""
+"""311E7AF206CFCF39_A20FA9004FC89A76_2267_UN""","""NCCCCCC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2""",21,"""301EA12181A76801"""
+"""C75B558AD328F274_1CC296E9E9C38DF9_2267_UN""","""NCCCCCC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""301EA12181A76801"""
+"""1C3DD658300D8C33_342987A1F386E6F4_2267_UN""","""NCCCCCC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""301EA12181A76801"""
+"""8796792AC3A341CA_F7567148F10E3DCA_2267_UN""","""NCCCCCC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""301EA12181A76801"""
+"""E1AF30CFB26E8ABC_224653F46046A399_2267_UN""","""NCCCCCC#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""301EA12181A76801"""
+"""0CC99AE84B74E3B7_81F81AF9EEDFC4F5_2267_UN""","""NCCCCCC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""301EA12181A76801"""
+"""73D964E78AF1C958_AAF7B7ED11A18ED6_2267_UN""","""NCCCCCC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""301EA12181A76801"""
+"""9597A138150F92A2_467AC6CE6199A70B_2267_UN""","""NCCCCCC#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""301EA12181A76801"""
+"""0F74D185542C845A_BCC7DDF25FB1DB0D_2267_UN""","""NCCCCCC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""301EA12181A76801"""
+"""0A30DC97FC5B3C39_1AAB49977D741CC9_2267_UN""","""NCCCCCC#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""301EA12181A76801"""
+"""8EADB2DEC205A449_90C678987AFA979D_2267_UN""","""NCCCCCC#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""301EA12181A76801"""
+"""F871DCDF4B0DC9BA_4C50B84A1F316DD6_2267_UN""","""NCCCCCC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""301EA12181A76801"""
+"""6BEEFF597C758C22_FA422C4C1BD6027A_2267_UN""","""NCCCCCC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""301EA12181A76801"""
+"""47A97E1DA63BA1E3_FF4FB537732165EF_2267_UN""","""NCCCCCC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""301EA12181A76801"""
+"""192FE0292663E9B3_068A7D7FC1F9CBC5_2267_UN""","""NCCCCCC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""301EA12181A76801"""
+"""CB055225FEDE7ADC_225079A59757C04D_2267_UN""","""NCCCCCC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""301EA12181A76801"""
+"""83236E049B334C61_5538C4B75082AA3A_2267_UN""","""NCCCCCC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""301EA12181A76801"""
+"""36835E7741B247A8_83732095985D730B_2267_UN""","""NCCCCCC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""301EA12181A76801"""
+"""171281273F5496DB_A7ECDF7DA0A3A9B0_2267_UN""","""NCCCCCC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""301EA12181A76801"""
+"""7C2D5521F475AA54_28FC28E1612FC839_2267_UN""","""NCCCCCC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""301EA12181A76801"""
+"""14488179DA66B177_61E90550EE87D72A_2267_UN""","""NCCCCCC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""301EA12181A76801"""
+"""BA578D1CB09DC950_BDCD3F32D100E9A0_2267_UN""","""NCCCCCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""301EA12181A76801"""
+"""378AF6C96CE372DD_727F2BC4C6980411_2267_UN""","""NCCCCCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""301EA12181A76801"""
+"""D58F3DAC2F793539_3655DC6151B6D0C7_2267_UN""","""NCCCCCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""301EA12181A76801"""
+"""5F13B9AC09BDABFC_4DF3523CB9C6F597_2267_UN""","""NCCCCCC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""301EA12181A76801"""
+"""BEF70A35F3324BF3_7F55EAA4C229DDCD_2267_UN""","""NCCCCCC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""301EA12181A76801"""
+"""FD6848FE18A0A931_4A76E263F45CA6C2_2267_UN""","""NCCCCCC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""301EA12181A76801"""
+"""C94DE70762711F6C_12C42839340053D7_2267_UN""","""NCCCCCC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""301EA12181A76801"""
+"""FF101FA93B3AB0F9_4AA25F572A52AA4E_2267_UN""","""NCCCCCC#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""301EA12181A76801"""
+"""BF8E670598A440EF_D2AF576DDA82D5C1_6036_UN""","""C(C1=C(C(=CC=C1F)Br)F)N([S](CC)(=O)=O)CC(=O)OC""",21,"""397B1FA5A3904B4E"""
+"""7A8FD98E53D742A0_F1F2E2C965413D5C_6036_UN""","""C(C1=C(C(=CC=C1F)Br)F)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""397B1FA5A3904B4E"""
+"""652AE499FC494FD0_DB85CDB0B7CA20FA_6036_UN""","""C(C1=C(C(=CC=C1F)Br)F)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""397B1FA5A3904B4E"""
+"""A8D08685C9946F36_8930DA597B529565_6036_UN""","""C(C1=C(C(=CC=C1F)Br)F)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""397B1FA5A3904B4E"""
+"""9BFC160580BB19CF_E87B09FACB49F69F_6036_UN""","""C(C1=C(C(=CC=C1F)Br)F)N(C)[S](=O)(=O)C2CCCNC2""",21,"""397B1FA5A3904B4E"""
+"""1C3A7B12F06F27E4_DE7935D0F928BA2D_6036_UN""","""C(C1=C(C(=CC=C1F)Br)F)N(C)[S](=O)(=O)CC2CCCN2""",21,"""397B1FA5A3904B4E"""
+"""854F77F8467BC0F0_FAA6766D5293CA3B_6036_UN""","""C(C1=C(C(=CC=C1F)Br)F)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""397B1FA5A3904B4E"""
+"""E1E8194A59E89D9B_3582437913CE039B_6036_UN""","""C(C1=C(C(=CC=C1F)Br)F)N([S](C)(=O)=O)C2CCCNC2""",21,"""397B1FA5A3904B4E"""
+"""EA3D65E414DDF171_E0C544E0E048BED1_6036_UN""","""C(C1=C(C(=CC=C1F)Br)F)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""397B1FA5A3904B4E"""
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+"""8A2A47E9EBDBC174_E57F1020EF6483C1_6016_UN""","""OCC1=C(C(=CC=C1F)C(=O)C2=CC3=C(C=C2)OCO3)F""",21,"""397B1FA5A3904B4E"""
+"""56CF4107F575049F_A5E25C2AFA1327FB_1031_UN""","""[N]1(CC(=O)OCC#C)C2=C(C(=C1C)C(OCC)=O)CCC2""",21,"""3A79E9A5D92AFB40"""
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+"""F65B51AC7F744CAB_B7BE43A62D5230AF_2267_UN""","""NCC(=O)OCC#CC2=CC1=CC=CC(=C1N=C2)[N](=O)=O""",21,"""3A79E9A5D92AFB40"""
+"""98BEEE85BA57E102_D088B5489ECCB324_2267_UN""","""NCC(=O)OCC#CC1=C[NH]C2=C1C=C(C(OC)=O)C=C2""",21,"""3A79E9A5D92AFB40"""
+"""38837B73589C9D01_5B091EBA18DE7A35_2267_UN""","""NCC(=O)OCC#CC2=CC(=C1C=CC=CC1=C2)C(O)=O""",21,"""3A79E9A5D92AFB40"""
+"""75A72462F5B735D2_AB820C3DAE9A9260_2267_UN""","""NCC(=O)OCC#CC2=C(C(O)=O)C=C1C=CC=CC1=C2""",21,"""3A79E9A5D92AFB40"""
+"""34585813605A018C_6B8D0DE02448CEFB_2267_UN""","""NCC(=O)OCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""3A79E9A5D92AFB40"""
+"""9BE023CB49FCFD4E_2CE897985ED8E997_2267_UN""","""NCC(=O)OCC#CC1=C(C=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""3A79E9A5D92AFB40"""
+"""9A8921CF680F63C1_23C5C74D70726A7B_2267_UN""","""NCC(=O)OCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""3A79E9A5D92AFB40"""
+"""A8E223B54BD6DA5F_4539F986D167071D_2267_UN""","""NCC(=O)OCC#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""3A79E9A5D92AFB40"""
+"""45A07C7D5A165ED8_EFED49C15FA41DB2_2267_UN""","""NCC(=O)OCC#CC1=N[N](CC[S](CC)(=O)=O)C=C1C""",21,"""3A79E9A5D92AFB40"""
+"""3BCA52B6BC140A97_0F691ACC1746456C_2267_UN""","""NCC(=O)OCC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""3A79E9A5D92AFB40"""
+"""4C050B036EF2C922_6A42D53AFCD5C365_2267_UN""","""NCC(=O)OCC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""3A79E9A5D92AFB40"""
+"""E9ADFEE79CB33DCB_A868E18417450937_2267_UN""","""NCC(=O)OCC#CC2=C1CCC(C(OC)=O)CC1=N[NH]2""",21,"""3A79E9A5D92AFB40"""
+"""BA14D2335EB7C452_16A5DE6DB14E1EB8_2267_UN""","""NCC(=O)OCC#CC1=CC(=CC(=C1C)C(=O)O)[N](=O)=O""",21,"""3A79E9A5D92AFB40"""
+"""B33945D52FCC37A5_3E4ECF25AB0B75B5_2267_UN""","""NCC(=O)OCC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""3A79E9A5D92AFB40"""
+"""1E976030B38E0A17_FD3139CCA983AE8B_2267_UN""","""NCC(=O)OCC#CC1=CC=CC(=C1)[C@@H](CC(OC)=O)N""",21,"""3A79E9A5D92AFB40"""
+"""67AE3F46E2676C51_28211B7038CB30D8_2267_UN""","""NCC(=O)OCC#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""3A79E9A5D92AFB40"""
+"""5B5F62E86591BA75_8B9F527DB65257B4_2267_UN""","""NCC(=O)OCC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""3A79E9A5D92AFB40"""
+"""3CE243EA7FEBF07D_A090FF69492C1D97_2267_UN""","""NCC(=O)OCC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""3A79E9A5D92AFB40"""
+"""12CAA444BB4286F4_4C1D8E4A3914344A_2267_UN""","""NCC(=O)OCC#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""3A79E9A5D92AFB40"""
+"""21933192709020FF_B6A09576073C484C_2267_UN""","""NCC(=O)OCC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""3A79E9A5D92AFB40"""
+"""3F106AB6B340CC10_10CC011325F98F88_2267_UN""","""NCC(=O)OCC#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""3A79E9A5D92AFB40"""
+"""3F91D931E7BB81B1_9AA1301C227704DC_2267_UN""","""NCC(=O)OCC#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""3A79E9A5D92AFB40"""
+"""3787C45116FC259A_4637F0CE47BCFE97_2267_UN""","""NCC(=O)OCC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""3A79E9A5D92AFB40"""
+"""AB55B22B2939DEEF_F02564C8435B913B_2267_UN""","""NCC(=O)OCC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""3A79E9A5D92AFB40"""
+"""3B6618B2C568CE71_F528FDB32BACF6AE_2267_UN""","""NCC(=O)OCC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""3A79E9A5D92AFB40"""
+"""8D0B575E52F7C41E_0CED35FB99745884_2267_UN""","""NCC(=O)OCC#CC1=CC2=C(C=C1)C3=C(O2)C=CC=C3""",21,"""3A79E9A5D92AFB40"""
+"""FC4553C8D9850A4C_28373121CFDA530C_2267_UN""","""NCC(=O)OCC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""3A79E9A5D92AFB40"""
+"""C90DEDDDD058F796_5F5F8C33080F397B_2267_UN""","""NCC(=O)OCC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""3A79E9A5D92AFB40"""
+"""F62C3B34A1D35EC1_89146811C0D0E04A_2267_UN""","""NCC(=O)OCC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""3A79E9A5D92AFB40"""
+"""8ED54E400DE5929D_AD8B97F9F82E3AF1_2267_UN""","""NCC(=O)OCC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""3A79E9A5D92AFB40"""
+"""D708EB1BE3FD66A4_229B606539A25B78_2267_UN""","""NCC(=O)OCC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""3A79E9A5D92AFB40"""
+"""242988863149FDFA_6B8E4DD4B60A446B_2267_UN""","""NCC(=O)OCC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""3A79E9A5D92AFB40"""
+"""DA1839E79D4CCB54_B7AA77B6898D7AE1_2267_UN""","""NCC(=O)OCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""3A79E9A5D92AFB40"""
+"""69F7A083FE9587B9_781863409E159750_2267_UN""","""NCC(=O)OCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""3A79E9A5D92AFB40"""
+"""6927687AD4C1899D_3C3294E5093B4386_2267_UN""","""NCC(=O)OCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""3A79E9A5D92AFB40"""
+"""93FA188EAFBADCB9_47941AB8E14B66D6_2267_UN""","""NCC(=O)OCC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""3A79E9A5D92AFB40"""
+"""11AA1AE59511E655_7532A2209AA44E8C_2267_UN""","""NCC(=O)OCC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""3A79E9A5D92AFB40"""
+"""EBE92B5D9A68742A_4011AAE7ACD13583_2267_UN""","""NCC(=O)OCC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""3A79E9A5D92AFB40"""
+"""D884F2F1CA692064_18A360BD6C8DC096_2267_UN""","""NCC(=O)OCC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""3A79E9A5D92AFB40"""
+"""7ED06837CBA7DBFA_40C517D372DF390F_2267_UN""","""NCC(=O)OCC#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""3A79E9A5D92AFB40"""
+"""4947A14D1CC17578_D6E5648A9F086E75_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N([S](CC)(=O)=O)CC(=O)OC""",21,"""3D312C42E61AF0FA"""
+"""0E5C11CF003A010C_F5B8D12E20CB86E8_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""3D312C42E61AF0FA"""
+"""13397F1CC1B63C26_DFCFFE57F2409B4E_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""3D312C42E61AF0FA"""
+"""9CD16E20202E04D7_8D7AE9BE3ED82ED1_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""3D312C42E61AF0FA"""
+"""F2F709512C594409_EC313A1D8EC34D2B_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N(C)[S](=O)(=O)C2CCCNC2""",21,"""3D312C42E61AF0FA"""
+"""16817FAF8E092A67_DA330637BCA20199_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N(C)[S](=O)(=O)CC2CCCN2""",21,"""3D312C42E61AF0FA"""
+"""531FCF4704F075BA_FEEC458A1719718F_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""3D312C42E61AF0FA"""
+"""A032C09629CA8A94_31C8709E5644B82F_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N([S](C)(=O)=O)C2CCCNC2""",21,"""3D312C42E61AF0FA"""
+"""A4D8FBA05F736529_E48F7707A5C20565_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""3D312C42E61AF0FA"""
+"""9574E784A0745C3B_5CC943A23312781E_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N(CC)[S](=O)(=O)C2CCNC2""",21,"""3D312C42E61AF0FA"""
+"""51CDEEF6A040EE9D_996ACD988FD257E7_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""3D312C42E61AF0FA"""
+"""48E2FB98D97C3E35_3C3158FCCD375010_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""3D312C42E61AF0FA"""
+"""51D7C3527BBC2D1D_32A02FB6F451239F_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""3D312C42E61AF0FA"""
+"""0C14C06B1332F5B6_DC394287436E859F_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N([S](C)(=O)=O)CCNC2CC2""",21,"""3D312C42E61AF0FA"""
+"""36CFDBAA08B4DB11_63A507F88A7A0637_6036_UN""","""C(C1=CC(=C(C(=C1)F)Br)F)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""3D312C42E61AF0FA"""
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+"""8BF0F44C9D66694D_11B6D2DF97DD5460_2267_UN""","""NCC(=O)NCC#CC1=CC=C(C=C1)C(=O)C2CCCO2""",21,"""4042369A6ABF61DB"""
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+"""463BB1B7F39979FE_59FE1872C3E7F0E0_2267_UN""","""NCC(=O)NCC#CC1=C([N](=O)=O)C=C(C=C1)C(F)(F)F""",21,"""4042369A6ABF61DB"""
+"""8A28972BC6E84713_3F0226B962F29D86_2267_UN""","""NCC(=O)NCC#CC1=C(C(NCC(O)=O)=O)C=CC=C1""",21,"""4042369A6ABF61DB"""
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+"""C406C03333F87252_7552C5F3A4D3DFF7_2267_UN""","""NCC(=O)NCC#CC1=N[N](C=C1C)C2CC[S](=O)(=O)C2""",21,"""4042369A6ABF61DB"""
+"""B0A77EA9DA370E0D_10790A054F4059FE_2267_UN""","""NCC(=O)NCC#CC1=C(C(N)=O)C=C(C=C1)C(F)(F)F""",21,"""4042369A6ABF61DB"""
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+"""9F2EEB576F254349_4475101A189EEF2E_2267_UN""","""NCC(=O)NCC#CC1=C(C(OCC)=O)C=N[N]1C(C)C""",21,"""4042369A6ABF61DB"""
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+"""6878BE7C63F9B3B9_521AC44F8B5EAA43_2267_UN""","""NCC(=O)NCC#CC2=CC=C(CC1(C)NCCC1)C=C2""",21,"""4042369A6ABF61DB"""
+"""84FC8CAFD1DF074C_F1A48D4205C7CD2F_2267_UN""","""NCC(=O)NCC#CC1=C[NH]C2=CN=C(C(F)(F)F)C=C12""",21,"""4042369A6ABF61DB"""
+"""8D2A24F6EC439435_DAAB2056FAB9870C_2267_UN""","""NCC(=O)NCC#CC1=C(C)C=C(C(=C1)C)C2OCCO2""",21,"""4042369A6ABF61DB"""
+"""5ABEC6822BCA4F1B_362651758A81AED1_2267_UN""","""NCC(=O)NCC#CC1=CC=C(C=C1)C2NCCNC2=O""",21,"""4042369A6ABF61DB"""
+"""81D1BC8D64C343A9_CC9B4A49B4A9D2D7_2267_UN""","""NCC(=O)NCC#CC1=C(C(C)=O)C=CC2=C1C=CC=C2""",21,"""4042369A6ABF61DB"""
+"""7C30A301437FB9D0_6AF7DE2C966C1513_2267_UN""","""NCC(=O)NCC#CC(B1OC(CN(C)CC(O1)=O)=O)=C""",21,"""4042369A6ABF61DB"""
+"""A21A13794BECC8E2_E09AEF2391E29E47_2267_UN""","""NCC(=O)NCC#CC1=C[N](CC(OCC)OCC)N=C1""",21,"""4042369A6ABF61DB"""
+"""1EB984F0990474A4_3C0C2FF1F429640C_2267_UN""","""NCC(=O)NCC#CC1=CN=C2C=C(C(OC)=O)C=C[N]12""",21,"""4042369A6ABF61DB"""
+"""EF3457271EB47045_8A1EBBF7F0CE0BA0_2267_UN""","""NCC(=O)NCC#CC1=CC=CC(=C1)[C@H](CC(OC)=O)N""",21,"""4042369A6ABF61DB"""
+"""35A9B3DF14C2E2FE_8F13228C98396C35_2267_UN""","""NCC(=O)NCC#CC2=CC=C(C1=NN=C(C)N=N1)C=C2""",21,"""4042369A6ABF61DB"""
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+"""EDDF02D1EA694425_520CEE1E7C4FC997_2267_UN""","""NCC(=O)NCC#CC1=C(C(OC)=O)[NH]N=C1C2CNC2""",21,"""4042369A6ABF61DB"""
+"""2E2FE04A1A5CA7F8_2564530CBB9AA3E0_2267_UN""","""NCC(=O)NCC#CC1=CC(=CC(=C1)C(F)(F)F)C(O)=O""",21,"""4042369A6ABF61DB"""
+"""AC0C776F95213F5E_F32FB72E73457AD1_2267_UN""","""NCC(=O)NCC#CC1=C(C=CC(=C1)C(OC)=O)C(C)C""",21,"""4042369A6ABF61DB"""
+"""79E96A72563B58FF_D7B048C64BBBA06A_2267_UN""","""NCC(=O)NCC#CC1=CC(=C(C(OC)=O)C=C1)[N](=O)=O""",21,"""4042369A6ABF61DB"""
+"""B9951891EF734573_58A0BF5A8A37C1E3_2267_UN""","""NCC(=O)NCC#CC1=CC(=CC=C1)CC2=CC=CC=C2""",21,"""4042369A6ABF61DB"""
+"""CE9730AAE275B90F_11B592EB059FDEF0_2267_UN""","""NCC(=O)NCC#CC1=CC=C(C=C1)CN2CCCCC2""",21,"""4042369A6ABF61DB"""
+"""AB3E6AB95613A38E_CD91A8893A18E07A_2267_UN""","""NCC(=O)NCC#CC1=CC(=C(C=C1)F)C[C@H](N)C(=O)O""",21,"""4042369A6ABF61DB"""
+"""B1B8A338A0732C7A_0223BC7F2D800DCB_2267_UN""","""NCC(=O)NCC#CC1=C(C(OC)=O)[NH]C2=C1C=CC=C2""",21,"""4042369A6ABF61DB"""
+"""7FC67432CFF7C9D6_46094BDABAAED91D_2267_UN""","""NCC(=O)NCC#CC1=C[NH]C2=C1C=NC(=N2)C(OC)=O""",21,"""4042369A6ABF61DB"""
+"""F826E0D6EB535056_3DAFC58752DEFC4D_2267_UN""","""NCC(=O)NCC#CC2=CC1=C(N=C(C(O)=O)C=C1)C=C2""",21,"""4042369A6ABF61DB"""
+"""55D31DC390BF8E0A_0F097D1F2931D417_2267_UN""","""NCC(=O)NCC#CC1=CC=C(CCCCC(O)=O)C=C1""",21,"""4042369A6ABF61DB"""
+"""D3A472AE0D5ADE80_3A2A75D81F44AF18_2267_UN""","""NCC(=O)NCC#CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3""",21,"""4042369A6ABF61DB"""
+"""97C11602DF0FA526_6298BF82DF185A0D_2267_UN""","""NCC(=O)NCC#CC1=CC(=C(C=C1)F)CC(N)C(=O)O""",21,"""4042369A6ABF61DB"""
+"""A68D78C2143F9A59_3AFEC8ECC14AA394_2267_UN""","""NCC(=O)NCC#CC2=NC1=C(OC)C=CC(=C1S2)OC""",21,"""4042369A6ABF61DB"""
+"""4F3002D8740B034A_A9CEDFD7981CBA8E_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N([S](CC)(=O)=O)CC(=O)OC""",21,"""421A971FE10E2401"""
+"""D316002D3BD426A8_8A936A7327DF5213_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""421A971FE10E2401"""
+"""A62EABB4332A5E77_A0E4450AF5544FB5_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""421A971FE10E2401"""
+"""7B7BD308BA153D26_F25152E339CCFA2A_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""421A971FE10E2401"""
+"""E8AA88470EDBCC4C_931A814089D799D0_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N(C)[S](=O)(=O)C2CCCNC2""",21,"""421A971FE10E2401"""
+"""6187F87F1716DB55_A518BD6ABBB6D562_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N(C)[S](=O)(=O)CC2CCCN2""",21,"""421A971FE10E2401"""
+"""4EDBC11250E024BF_81C7FED7100DA574_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""421A971FE10E2401"""
+"""F82539FA8DF7C3BA_4EE3CBC351506CD4_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N([S](C)(=O)=O)C2CCCNC2""",21,"""421A971FE10E2401"""
+"""F33D9FCD7E93CC22_9BA4CC5AA2D6D19E_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""421A971FE10E2401"""
+"""1A3190F53EFBB5C3_23E2F8FF3406ACE5_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N(CC)[S](=O)(=O)C2CCNC2""",21,"""421A971FE10E2401"""
+"""7376A0814F9C48FF_E64176C588C6831C_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""421A971FE10E2401"""
+"""4DA37DE1476D2415_431AE3A1CA2384EB_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""421A971FE10E2401"""
+"""6DD7A94B4A0B92C4_4D8B94EBF345F764_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""421A971FE10E2401"""
+"""00B194C7B3131B51_A312F9DA447A5164_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N([S](C)(=O)=O)CCNC2CC2""",21,"""421A971FE10E2401"""
+"""6667E2BAACDF2B71_1C8EBCA58D6ED2CC_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""421A971FE10E2401"""
+"""29ECBB16F9EE1E77_AB004CD6CF1234C5_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N(C)[S](=O)(=O)C2CCNCC2""",21,"""421A971FE10E2401"""
+"""F4D934FFC0837F95_05922F9615053B6A_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""421A971FE10E2401"""
+"""0A657FD9C4C4C102_1DB6FE7A27C0F7DD_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""421A971FE10E2401"""
+"""092C8A35C1C3DC9D_FDFAB72C7A6274B1_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""421A971FE10E2401"""
+"""665B19D67B02769C_B1940A2F46642895_6036_UN""","""C(C1=CC(=CC(=C1)Br)C#N)N([S](C)(=O)=O)C2CCNCC2""",21,"""421A971FE10E2401"""
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+"""026ECA8CC6A0A2C9_2DDA6F47F147926C_6036_UN""","""CC(CN(C(C(C)(C)N)=O)[S](=O)(=O)C)C1=CC=C(C=C1)Br""",21,"""4CF09D13FF972F4C"""
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+"""04E69E3B4A8F6851_E468657243CB6A39_6036_UN""","""CC(CN1CCCC(CC=C)[S]1(=O)=O)C2=CC=C(C=C2)Br""",21,"""4CF09D13FF972F4C"""
+"""D1F1C838149C8B93_0D1E5F5552E5A066_6036_UN""","""CC(CN(CCCN)[S](=O)(=O)C(F)F)C1=CC=C(C=C1)Br""",21,"""4CF09D13FF972F4C"""
+"""151188C55A93AE4D_FE1EF5B8C8FA4FB2_6036_UN""","""CC(CN1[S](C2(CC1CI)CC2)(=O)=O)C3=CC=C(C=C3)Br""",21,"""4CF09D13FF972F4C"""
+"""7F4F2BD7F2A4F63D_F770E55B31EFD00D_6036_UN""","""CC(CN1CCCCNCC[S]1(=O)=O)C2=CC=C(C=C2)Br""",21,"""4CF09D13FF972F4C"""
+"""679221B7C9CE8D42_832822F832C60CA5_6036_UN""","""CC(CN1[S](=O)(=O)C2(C1)CCOCC2)C3=CC=C(C=C3)Br""",21,"""4CF09D13FF972F4C"""
+"""828C74EE55E8579E_6CF3D2ECE4AAC3D3_6036_UN""","""CC(CN1C(CN)CC2([S]1(=O)=O)CC2)C3=CC=C(C=C3)Br""",21,"""4CF09D13FF972F4C"""
+"""982B947E16561F9A_CB0DFDA4270DD0C9_6036_UN""","""CC(CN([S](=O)(=O)C1CC1)C2CNC2)C3=CC=C(C=C3)Br""",21,"""4CF09D13FF972F4C"""
+"""1454D96F88A3C420_F34A0CF5FFBCC2C6_6036_UN""","""CC(CN1CC2(C[S]1(=O)=O)CCCC2)C3=CC=C(C=C3)Br""",21,"""4CF09D13FF972F4C"""
+"""BD733A666BE7CF9D_59140EFF2661AF60_6036_UN""","""CC(CN([S](=O)(=O)C1CNC1)C2CC2)C3=CC=C(C=C3)Br""",21,"""4CF09D13FF972F4C"""
+"""44F8C281A5B150D6_FDB68827780D461B_6036_UN""","""CC(CN([S](C)(=O)=O)CC[S](=O)(=O)Cl)C1=CC=C(C=C1)Br""",21,"""4CF09D13FF972F4C"""
+"""51A73E7D9B0A522F_EDFA565B210A8DFE_6036_UN""","""CC(CN(CCC)[S](=O)(=O)C(F)(F)F)C1=CC=C(C=C1)Br""",21,"""4CF09D13FF972F4C"""
+"""516C32E20CE0B2C3_90F49296B363E7C3_6016_UN""","""CC(CO)C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)OCO3""",21,"""4CF09D13FF972F4C"""
+"""E9F807E98E12BAF5_37EBBE01E743F872_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N(C)[S](=O)(=O)CC(=O)O""",21,"""59E73C327D7B153A"""
+"""BF42682F64F07E7A_B32B3B57EFD5A3BF_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N([S](C)(=O)=O)CC(=O)O""",21,"""59E73C327D7B153A"""
+"""5B2E04FFF6AC51DA_B84509E270B9AAEC_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)C3=C[NH]N=C3""",21,"""59E73C327D7B153A"""
+"""F53A3224AD8F9151_68D6F2551F9A4C55_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)CC(F)(F)F""",21,"""59E73C327D7B153A"""
+"""D451710672F00F75_BAF09A62BE09AFBE_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](CCOCC)(=O)=O""",21,"""59E73C327D7B153A"""
+"""E7047D77B0683CB8_FD8688E3946DCB4E_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](CC(OC)=O)(=O)=O""",21,"""59E73C327D7B153A"""
+"""81A503555474ACF8_8FC5133D9E8F8DA8_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](CCC(C)C)(=O)=O""",21,"""59E73C327D7B153A"""
+"""EE036C22B5E5DDBF_FB325269A7D0B790_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](CCCOC)(=O)=O""",21,"""59E73C327D7B153A"""
+"""10574917B6813A28_6BF7F27376B7CE52_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](CC(C)(C)C)(=O)=O""",21,"""59E73C327D7B153A"""
+"""FF7402B3D1149CBA_1419CD07FBD1F1B9_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](C(CC)CC)(=O)=O""",21,"""59E73C327D7B153A"""
+"""4EBFED8D342B47C0_FE324723283B8DD2_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](CC(CC)C)(=O)=O""",21,"""59E73C327D7B153A"""
+"""AC85D3745249A036_C8CA7717040B73E5_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](C(COC)C)(=O)=O""",21,"""59E73C327D7B153A"""
+"""7C87CE6448AAEC01_0F8CAEB5E4BED54F_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)C3CCOC3""",21,"""59E73C327D7B153A"""
+"""89FA7350431FD42E_3769C62AF8C5716A_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](CCCCC)(=O)=O""",21,"""59E73C327D7B153A"""
+"""C94E85777FAFEE03_278E5081774E53C2_6043_DP""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](C3CCNC3)(=O)=O""",21,"""59E73C327D7B153A"""
+"""EA574907CCD5B86A_A3B8CD6D309FFC5F_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)C3CCCC3""",21,"""59E73C327D7B153A"""
+"""3A339DE992BF77F7_D974391659BF59BA_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)CCC(=O)O""",21,"""59E73C327D7B153A"""
+"""6F70CA19074F479C_172B762D5B2C17AA_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)CCCC#N""",21,"""59E73C327D7B153A"""
+"""3B86F6A698E47028_3620944EAE6CCE7F_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)CC3CCC3""",21,"""59E73C327D7B153A"""
+"""B8E2B05B3419F7C4_3ECD64E8BA2A9DDB_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](C(C)C(=O)O)(=O)=O""",21,"""59E73C327D7B153A"""
+"""BD1C7C7FD869B731_0C6E7800CD3390D4_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](CC(OC)C)(=O)=O""",21,"""59E73C327D7B153A"""
+"""F242F9604D0C21C5_4549FF41D4B273FF_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](CCN(C)C)(=O)=O""",21,"""59E73C327D7B153A"""
+"""793EF7E9D85075DA_324B90DA62E12492_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](C3(CC)CC3)(=O)=O""",21,"""59E73C327D7B153A"""
+"""9D4D327A1DF934BA_1B0FD285D0E830FE_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)C3=CSC=C3""",21,"""59E73C327D7B153A"""
+"""960ACF5C58F46346_2FF66A9B9B99F6FB_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N(CC(C)O)[S](=O)(=O)C""",21,"""59E73C327D7B153A"""
+"""943AA1282DCDC1B2_AEE748AEA12F06C9_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)CC=C(Cl)Cl""",21,"""59E73C327D7B153A"""
+"""9418B82B8E4B60D4_B392045EFDF502B0_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N(C[C@@H](C)O)[S](=O)(=O)C""",21,"""59E73C327D7B153A"""
+"""A0DF032D7F38A3C4_5727552786A124F6_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)C3(CO)CC3""",21,"""59E73C327D7B153A"""
+"""CC9FCA7F1283C4C1_331C23F84AF79ADF_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)C3(CC3)C=C""",21,"""59E73C327D7B153A"""
+"""729E9C7E8842F7E2_AC665E1FE715072D_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)C3(CCl)CC3""",21,"""59E73C327D7B153A"""
+"""26A24DF6ECDEE9FD_8D96F029FBA38086_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)CCCC#C""",21,"""59E73C327D7B153A"""
+"""6EF9F307CC6111FF_3198C44150539E83_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)C3(CC3)C#C""",21,"""59E73C327D7B153A"""
+"""1F7A18C3CBE4C9C9_12A804E55A0B5579_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](C3(C)CCC3)(=O)=O""",21,"""59E73C327D7B153A"""
+"""FCF767E44F17F864_69F5CA93DF49318E_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N(C)[S](=O)(=O)CCCO""",21,"""59E73C327D7B153A"""
+"""A9B07A0A7389A3E5_1E17821F9CA2A5C2_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)CCCCF""",21,"""59E73C327D7B153A"""
+"""745807DE9E270AB2_E697D730FCE90726_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)CCCC=C""",21,"""59E73C327D7B153A"""
+"""7C667D2A6B7F8713_8EE413D42B9EA791_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](C(CCC)C)(=O)=O""",21,"""59E73C327D7B153A"""
+"""5C06BFE1201ABD99_88FBD196EEA24C44_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)C3=COC=C3""",21,"""59E73C327D7B153A"""
+"""FB09B1453F469159_DBF28F6CCA8A75A3_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](CCCSC)(=O)=O""",21,"""59E73C327D7B153A"""
+"""4ECA9CCD8D1499F3_A025D528305C3379_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)CCCCCl""",21,"""59E73C327D7B153A"""
+"""4EEC2E40DF4499B6_9520053DECAB130A_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N[S](=O)(=O)CCC3CO3""",21,"""59E73C327D7B153A"""
+"""51B92C702FDE4256_6DCE1E44FFF4A720_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N3[S](CCC3CO)(=O)=O""",21,"""59E73C327D7B153A"""
+"""814A83BBA5D9BE71_B04841D343E5EB0A_6043_UN""","""C1(=CC(=CC=C1)C2=CC=CC=C2)N([S](C)(=O)=O)CCCO""",21,"""59E73C327D7B153A"""
+"""690DAF4311C5358B_8BE3F34260CEF9B1_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](CC)(=O)=O)CC(=O)OC""",21,"""6037BB8A19DC673E"""
+"""79450208E396D270_A8BE46E6DF0D112C_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""6037BB8A19DC673E"""
+"""A1765F95A11EA5CD_82C9699F0D860C8A_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""6037BB8A19DC673E"""
+"""DD4ABBF4C3B9691B_D07C7E76C11EB915_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""6037BB8A19DC673E"""
+"""F4B15B7836B8C583_B137ADD57105DAEF_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C)[S](=O)(=O)C2CCCNC2""",21,"""6037BB8A19DC673E"""
+"""469F01190F0BB425_873591FF4364965D_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C)[S](=O)(=O)CC2CCCN2""",21,"""6037BB8A19DC673E"""
+"""397CC94890237058_A3EAD242E8DFE64B_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""6037BB8A19DC673E"""
+"""F16AD0D58EB4F04A_6CCEE756A9822FEB_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C)(=O)=O)C2CCCNC2""",21,"""6037BB8A19DC673E"""
+"""C75F3DF4240911F7_B989E0CF5A0492A1_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""6037BB8A19DC673E"""
+"""A1AEFC51CC93C725_01CFD46ACCD4EFDA_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(CC)[S](=O)(=O)C2CCNC2""",21,"""6037BB8A19DC673E"""
+"""4B70DD3AB34F05AC_C46C5A507014C023_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""6037BB8A19DC673E"""
+"""16CBAFC1B66A46F7_6137CF3432F1C7D4_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""6037BB8A19DC673E"""
+"""0EFE58D4251EBA93_6FA6B87E0B97B45B_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""6037BB8A19DC673E"""
+"""CC2621C440B97471_813FD54FBCA8125B_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C)(=O)=O)CCNC2CC2""",21,"""6037BB8A19DC673E"""
+"""2D03D95B40B388C3_3EA3903075BC91F3_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""6037BB8A19DC673E"""
+"""1F83F502832EBE6E_892D604337C077FA_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C)[S](=O)(=O)C2CCNCC2""",21,"""6037BB8A19DC673E"""
+"""82704FDF4B3129BB_27BF0303EDD77855_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""6037BB8A19DC673E"""
+"""9A132F1813D77BE9_3F9BD2EFDF12B4E2_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""6037BB8A19DC673E"""
+"""E674EAB5B5135BEF_DFD79BB982B0378E_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""6037BB8A19DC673E"""
+"""0D1BDFF423D164FE_93B926BABEB66BAA_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C)(=O)=O)C2CCNCC2""",21,"""6037BB8A19DC673E"""
+"""34CEF0FAF9BC0CB6_ECA2F3FB2192A6C4_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""6037BB8A19DC673E"""
+"""689D4D8987AE2F5A_3CDDA0F97BBD8E22_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""6037BB8A19DC673E"""
+"""A687ABEC94B161C2_EEEC73AB13112E2A_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""6037BB8A19DC673E"""
+"""B95E1210CA66468E_55BDAA301B86016E_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""6037BB8A19DC673E"""
+"""131AE632C336DF6E_A71CF123539DDF54_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""6037BB8A19DC673E"""
+"""AAFBE37DD9E3793D_8708E5AA535D9F68_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C)(=O)=O)CC2CNCC2""",21,"""6037BB8A19DC673E"""
+"""A3612D5A8C44D2D0_BB745EBC04A830DE_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""6037BB8A19DC673E"""
+"""8A9055E464980491_B23C432579AE41A1_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""6037BB8A19DC673E"""
+"""E8BAF936C8B84616_10099AFD0479E92A_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""6037BB8A19DC673E"""
+"""56AE557C7E122268_011D49DE170CDA1E_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""6037BB8A19DC673E"""
+"""1389504B413998BB_F4AB77F2ED973425_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(CCCN)[S](=O)(=O)C2CC2""",21,"""6037BB8A19DC673E"""
+"""60E7107606CECA30_C8AF43EBA580224B_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2CCCC(CC=C)[S]2(=O)=O""",21,"""6037BB8A19DC673E"""
+"""24D9C6E138A3049F_21D979CCB4AEE814_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(CCCN)[S](=O)(=O)C(F)F""",21,"""6037BB8A19DC673E"""
+"""F3364BBC02E6E5A7_D2D9D3212EB107C0_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""6037BB8A19DC673E"""
+"""1CEC44EBDC93F631_DBB7C3C2D7A4987F_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2CCCCNCC[S]2(=O)=O""",21,"""6037BB8A19DC673E"""
+"""52541C61B769A028_AFEF0461D48D44D7_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""6037BB8A19DC673E"""
+"""2F81301D748166A0_4034F47502E18BA1_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""6037BB8A19DC673E"""
+"""5B9D26ACB8241A92_E7CADB3DC14698BB_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""6037BB8A19DC673E"""
+"""AFF7CB710F3C8661_DF8D2A6C19F78AB4_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""6037BB8A19DC673E"""
+"""BD8FABA8FC01F088_75D32866C02AE712_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""6037BB8A19DC673E"""
+"""589E65B803921260_D171AEBE9E460E69_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""6037BB8A19DC673E"""
+"""3BE37E1E6FF73636_C13D70C2C741C58C_6036_UN""","""C(C1=CC(=C(C(=C1)Cl)Br)Cl)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""6037BB8A19DC673E"""
+"""762157865C02A518_BC33B40F5528AFB1_6016_UN""","""OCC1=CC(=C(C(=C1)Cl)C(=O)C2=CC3=C(C=C2)OCO3)Cl""",21,"""6037BB8A19DC673E"""
+"""2A5F916011EBC0D2_85E57C5E53BF63DA_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](CC)(=O)=O)CC(=O)OC""",21,"""6E3134962AADFD55"""
+"""9369D55F494366B1_A6B8C9FAEC7C8B47_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""6E3134962AADFD55"""
+"""3C0947305AAABEC6_8CCFE6833EF796E1_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C)[S](=O)(=O)C3=CC=C(Br)S3""",21,"""6E3134962AADFD55"""
+"""0A944B4BACCB6D81_DE7AF16AF26F237E_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3C4=C(C[S]3(=O)=O)C=CC=C4""",21,"""6E3134962AADFD55"""
+"""E3E603760C7B491D_BF3122C942744084_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C)[S](=O)(=O)C3CCCNC3""",21,"""6E3134962AADFD55"""
+"""8CAEB866485D0464_89331EE370150C36_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C)[S](=O)(=O)CC3CCCN3""",21,"""6E3134962AADFD55"""
+"""5EBE5D6ECAF49D9A_ADEC5D5EDBAE7C20_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C)[S](=O)(=O)C3=CC=C(Cl)S3""",21,"""6E3134962AADFD55"""
+"""6A27080012F1CEFC_62C8684A9AF3B580_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C)(=O)=O)C3CCCNC3""",21,"""6E3134962AADFD55"""
+"""F05095ECDC0994BD_B78F6FD3697508CA_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C)(=O)=O)C3=NN=C(N)S3""",21,"""6E3134962AADFD55"""
+"""C5DF3F5397560062_0FC95B76FFA575B1_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(CC)[S](=O)(=O)C3CCNC3""",21,"""6E3134962AADFD55"""
+"""9ACA26E54A65CE1C_CA6AD54C43655A48_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""6E3134962AADFD55"""
+"""CCCC5A636DC950FE_6F31402801805DBF_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""6E3134962AADFD55"""
+"""D4A67A01B51E850E_61A0376238E62E30_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""6E3134962AADFD55"""
+"""1BE0D146E5FF17F7_8F395A538FD98830_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C)(=O)=O)CCNC3CC3""",21,"""6E3134962AADFD55"""
+"""646FA6959D6CF3B4_30A51F2C46CD0B98_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""6E3134962AADFD55"""
+"""65994D5E55DDEAB1_872BEF5F04B1ED91_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C)[S](=O)(=O)C3CCNCC3""",21,"""6E3134962AADFD55"""
+"""148A21EB90EB2536_29B98C1FDEA6E23E_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3[S](CCC3C(OC)=O)(=O)=O""",21,"""6E3134962AADFD55"""
+"""35F8B50B70C3B41A_319D5DF3EC632E89_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3[S](=O)(=O)C4=C(C3)C=CC=C4""",21,"""6E3134962AADFD55"""
+"""D69CB524F5B309E8_D1D114A5B1C1ADE5_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C)(=O)=O)CC3=CC=NO3""",21,"""6E3134962AADFD55"""
+"""99A4222AE6FC341D_9DBFA9A68DC7F1C1_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C)(=O)=O)C3CCNCC3""",21,"""6E3134962AADFD55"""
+"""D3764D5D5401559A_E2A47CE712E33CAF_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C)(=O)=O)C3=NC=CC=C3""",21,"""6E3134962AADFD55"""
+"""4BF6E8D509688DF7_32DB2FE548CC1449_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C)[S](=O)(=O)C3=CN=CC=C3""",21,"""6E3134962AADFD55"""
+"""6847A6D2A8FCBC42_E0EAFCB72060B441_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""6E3134962AADFD55"""
+"""7CEC92CE815DCE74_5BBB252C28F79B05_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C)[S](=O)(=O)C3=C[N](C)C=N3""",21,"""6E3134962AADFD55"""
+"""6984386EAE4BFEC6_A91A7E3F60EC453F_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3CCCC(C(C)C)[S]3(=O)=O""",21,"""6E3134962AADFD55"""
+"""1A61F426DF84EB6A_890E6AB6602C0503_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C)(=O)=O)CC3CNCC3""",21,"""6E3134962AADFD55"""
+"""4DD914F00A863668_B572D1A037D9AAB5_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C)(=O)=O)[C@@H]3CNCCC3""",21,"""6E3134962AADFD55"""
+"""9A3ABAA80DC280AD_BC3ACC394ADFDBCA_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(CCCCl)[S](=O)(=O)C3CC3""",21,"""6E3134962AADFD55"""
+"""14E0D8C1C12F1394_1E0F15E137087341_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3C(=O)C4=C([S]3(=O)=O)C=CS4""",21,"""6E3134962AADFD55"""
+"""996C950CA032D567_0F1BC6C2247D4075_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""6E3134962AADFD55"""
+"""0ECFFFCA0F71797D_FAADF8EEDEE6AE4E_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(CCCN)[S](=O)(=O)C3CC3""",21,"""6E3134962AADFD55"""
+"""BFB6EDE20D22297F_C6A9CCF796F1B820_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3CCCC(CC=C)[S]3(=O)=O""",21,"""6E3134962AADFD55"""
+"""C9AAE6A3C96EEBCB_2FDFF6D087DF727F_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(CCCN)[S](=O)(=O)C(F)F""",21,"""6E3134962AADFD55"""
+"""F116EFA901412090_DCDF5C3D1DC09DAB_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3[S](C4(CC3CI)CC4)(=O)=O""",21,"""6E3134962AADFD55"""
+"""2967A6DF06DFDAB7_D5B14CDEE4D50214_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3CCCCNCC[S]3(=O)=O""",21,"""6E3134962AADFD55"""
+"""8464CE002C700100_A1E98B7DE7FCDEBC_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3[S](=O)(=O)C4(C3)CCOCC4""",21,"""6E3134962AADFD55"""
+"""DBE02B72392AB711_4E327B69319011CA_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3C(CN)CC4([S]3(=O)=O)CC4""",21,"""6E3134962AADFD55"""
+"""95D27B448E25A66A_E9CC5421F23702D0_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](=O)(=O)C3CC3)C4CNC4""",21,"""6E3134962AADFD55"""
+"""DC9955757E6535AF_D18BA5702A8610DF_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N3CC4(C[S]3(=O)=O)CCCC4""",21,"""6E3134962AADFD55"""
+"""ACFCDB27B757FC39_7BD5A77AF35B7D79_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](=O)(=O)C3CNC3)C4CC4""",21,"""6E3134962AADFD55"""
+"""6342DCC5359638CE_DF7721A2AD379402_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""6E3134962AADFD55"""
+"""C9B111C8277CE4A3_CF3BFFDEF4305FE7_6036_UN""","""C(C1CC1)(C2=CC=C(Br)S2)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""6E3134962AADFD55"""
+"""F308A782EB2CCAAF_B2353B13665935DA_6016_UN""","""OC(C1CC1)C2=CC=C(S2)C(=O)C3=CC4=C(C=C3)OCO4""",21,"""6E3134962AADFD55"""
+"""8735B6E1321BB48C_710895082A008195_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](CC)(=O)=O)CC(=O)OC""",21,"""9ADCDDC053121F1A"""
+"""5933D40468FA3EEB_525520AC95C36908_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""9ADCDDC053121F1A"""
+"""5FA9BA873BD2C87F_78220FD5474874AE_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C)[S](=O)(=O)C3=CC=C(Br)S3""",21,"""9ADCDDC053121F1A"""
+"""FC648FB1D95144CB_2A97183C8BD0C131_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3C4=C(C[S]3(=O)=O)C=CC=C4""",21,"""9ADCDDC053121F1A"""
+"""C89F6387D090D427_4BDCCB9F3BCBA2CB_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C)[S](=O)(=O)C3CCCNC3""",21,"""9ADCDDC053121F1A"""
+"""5FE877C63CAD78D8_7DDEF7B509AAEE79_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C)[S](=O)(=O)CC3CCCN3""",21,"""9ADCDDC053121F1A"""
+"""D2912E774E54849E_5901B408A2119E6F_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C)[S](=O)(=O)C3=CC=C(Cl)S3""",21,"""9ADCDDC053121F1A"""
+"""4930E654B012AB04_9625811CE34C57CF_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C)(=O)=O)C3CCCNC3""",21,"""9ADCDDC053121F1A"""
+"""F89AFEF03113471C_4362868510CAEA85_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C)(=O)=O)C3=NN=C(N)S3""",21,"""9ADCDDC053121F1A"""
+"""543E34AC79801191_FB24B220861A97FE_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(CC)[S](=O)(=O)C3CCNC3""",21,"""9ADCDDC053121F1A"""
+"""44B4A6CD4AD50918_3E873C1A3ADAB807_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""9ADCDDC053121F1A"""
+"""60A30D6D52BE3FDB_9BDCA97E783FBFF0_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""9ADCDDC053121F1A"""
+"""98C43A9A2FC1A17F_954DDE344159CC7F_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""9ADCDDC053121F1A"""
+"""CEA7B3BBAF92DC38_7BD4B305F6666A7F_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C)(=O)=O)CCNC3CC3""",21,"""9ADCDDC053121F1A"""
+"""546E1BE5C1DDF809_C448F67A3F72E9D7_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""9ADCDDC053121F1A"""
+"""CA7641536BCC1FD0_73C606097D0E0FDE_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C)[S](=O)(=O)C3CCNCC3""",21,"""9ADCDDC053121F1A"""
+"""026936CE9876CDA2_DD546549A7190071_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3[S](CCC3C(OC)=O)(=O)=O""",21,"""9ADCDDC053121F1A"""
+"""B26A4BE48643BCE4_C570B4A595DCCCC6_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3[S](=O)(=O)C4=C(C3)C=CC=C4""",21,"""9ADCDDC053121F1A"""
+"""EB508B91D1C4B7B2_253CFDF3C87E4FAA_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C)(=O)=O)CC3=CC=NO3""",21,"""9ADCDDC053121F1A"""
+"""388882EF5D71CF3C_695240F0F478138E_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C)(=O)=O)C3CCNCC3""",21,"""9ADCDDC053121F1A"""
+"""1A1118B2D9BD9B3A_164995B16B5CDEE0_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C)(=O)=O)C3=NC=CC=C3""",21,"""9ADCDDC053121F1A"""
+"""ACEE26D8BD66A163_C636C6B33173F606_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C)[S](=O)(=O)C3=CN=CC=C3""",21,"""9ADCDDC053121F1A"""
+"""08DCC617712DE8A1_140715E159DF560E_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""9ADCDDC053121F1A"""
+"""3AA27AA4FCB88340_AF56CC7A5148794A_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C)[S](=O)(=O)C3=C[N](C)C=N3""",21,"""9ADCDDC053121F1A"""
+"""0862BDCC4642024C_5DF797691953A770_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3CCCC(C(C)C)[S]3(=O)=O""",21,"""9ADCDDC053121F1A"""
+"""6953328DA1F05455_7DE383E01993E74C_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C)(=O)=O)CC3CNCC3""",21,"""9ADCDDC053121F1A"""
+"""7F76A0FCC1DDAF6F_419F38F64E6648FA_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C)(=O)=O)[C@@H]3CNCCC3""",21,"""9ADCDDC053121F1A"""
+"""B7F757EF650B2B9D_48D7256F33603985_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(CCCCl)[S](=O)(=O)C3CC3""",21,"""9ADCDDC053121F1A"""
+"""17AE751C46D999AF_EAE2FCB74EB7910E_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3C(=O)C4=C([S]3(=O)=O)C=CS4""",21,"""9ADCDDC053121F1A"""
+"""95055444F0E5B137_FBF62F945DC2A23A_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""9ADCDDC053121F1A"""
+"""96E0FAD7EBB012FD_0E4011B8A7594C01_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(CCCN)[S](=O)(=O)C3CC3""",21,"""9ADCDDC053121F1A"""
+"""5BCA7213E6D6CAEE_324425A1EF4E5A6F_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3CCCC(CC=C)[S]3(=O)=O""",21,"""9ADCDDC053121F1A"""
+"""726232EFB522A490_DB321F86FE609030_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(CCCN)[S](=O)(=O)C(F)F""",21,"""9ADCDDC053121F1A"""
+"""F800DE85093C4508_2832B56B647F7FE4_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3[S](C4(CC3CI)CC4)(=O)=O""",21,"""9ADCDDC053121F1A"""
+"""04B6337A42E35D64_215CA5889D6AE05B_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3CCCCNCC[S]3(=O)=O""",21,"""9ADCDDC053121F1A"""
+"""8ADBA4E349D24896_5504622B9E433CF3_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3[S](=O)(=O)C4(C3)CCOCC4""",21,"""9ADCDDC053121F1A"""
+"""1BA9E1B2CEAC7D67_BADF923F482FF385_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3C(CN)CC4([S]3(=O)=O)CC4""",21,"""9ADCDDC053121F1A"""
+"""0D6496445B832D96_1D21BD778B88E09F_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](=O)(=O)C3CC3)C4CNC4""",21,"""9ADCDDC053121F1A"""
+"""829B6D174F30A161_25664C265339F290_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N3CC4(C[S]3(=O)=O)CCCC4""",21,"""9ADCDDC053121F1A"""
+"""E15826EBE6CA690F_8F384E2C8AE49F36_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](=O)(=O)C3CNC3)C4CC4""",21,"""9ADCDDC053121F1A"""
+"""D93887722EDAAB21_2B9AC8F4D488764D_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""9ADCDDC053121F1A"""
+"""E95867D663933B9F_3BD616888D8FBDA8_6036_UN""","""C1(CCC2=C(C=NC=C12)Br)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""9ADCDDC053121F1A"""
+"""DFC3BF02ACE3E434_46D8D2451FE6D795_6016_UN""","""OC1CCC2=C(C=NC=C12)C(=O)C3=CC4=C(C=C3)OCO4""",21,"""9ADCDDC053121F1A"""
+"""2269E076EC059CA6_7618111DEFC7CE83_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](CC)(=O)=O)CC(=O)OC""",21,"""9DCC59D596D5500C"""
+"""5DA1918C5F6B141D_5545A4B95004261E_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""9DCC59D596D5500C"""
+"""AFAC49D5AB6EDB25_7F328BC0828F3BB8_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""9DCC59D596D5500C"""
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+"""411DDE1DFCBDB34B_4CCC4F8AFE0CEDDD_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(C)[S](=O)(=O)C2CCCNC2""",21,"""9DCC59D596D5500C"""
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+"""C4036884F2040F04_5E11301D67D6D179_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""9DCC59D596D5500C"""
+"""177E9106E4EED62E_91350509268B18D9_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C)(=O)=O)C2CCCNC2""",21,"""9DCC59D596D5500C"""
+"""BD08B5DC992E5C1C_44720290D50DA593_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""9DCC59D596D5500C"""
+"""F2E4D64913486568_FC34363543DDD8E8_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(CC)[S](=O)(=O)C2CCNC2""",21,"""9DCC59D596D5500C"""
+"""F9F8B9BDB81592A0_3997B80FFF1DF711_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""9DCC59D596D5500C"""
+"""88E9B115AF1EE842_9CCC2D6BBDF8F0E6_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""9DCC59D596D5500C"""
+"""EC65E813D6F4ADEC_925D5A21849E8369_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""9DCC59D596D5500C"""
+"""C4E4C9FF88820002_7CC4371033A12569_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C)(=O)=O)CCNC2CC2""",21,"""9DCC59D596D5500C"""
+"""0D18486C2CBC21D9_C358726FFAB5A6C1_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""9DCC59D596D5500C"""
+"""A1666164B9DEDC20_74D6821CB8C940C8_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(C)[S](=O)(=O)C2CCNCC2""",21,"""9DCC59D596D5500C"""
+"""5E72716E1F3A76AC_DA44E15C62DE4F67_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""9DCC59D596D5500C"""
+"""3D493AD884E35969_C26030B0501B83D0_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""9DCC59D596D5500C"""
+"""2AFCC8E6141DF038_222C79E60DB900BC_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""9DCC59D596D5500C"""
+"""EC6B80EE224E24C6_6E42C4E531BF5C98_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C)(=O)=O)C2CCNCC2""",21,"""9DCC59D596D5500C"""
+"""708AECB5B6D36558_115911A4AE9B91F6_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""9DCC59D596D5500C"""
+"""512B8049A7B364F3_C12642A6F4B4B910_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""9DCC59D596D5500C"""
+"""D16EDC5DE17AB36F_131791F49C181918_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""9DCC59D596D5500C"""
+"""F2C2BA281718057D_A846486F948F365C_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""9DCC59D596D5500C"""
+"""E596B98681A25ACD_5AE7137CDC94E866_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""9DCC59D596D5500C"""
+"""B2E7632FC31BCDF0_7AF307F5DC54A85A_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C)(=O)=O)CC2CNCC2""",21,"""9DCC59D596D5500C"""
+"""829671E302553820_468FBCE38BA107EC_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""9DCC59D596D5500C"""
+"""16571508AE6FD804_4FC7A17AF6A77693_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""9DCC59D596D5500C"""
+"""B6F6CD2B23EBDC55_EDF278A28B70DE18_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""9DCC59D596D5500C"""
+"""75A03AEE99A7EB7F_FCE6AB819805ED2C_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""9DCC59D596D5500C"""
+"""771D0959BC7E211A_095095AD629E0317_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(CCCN)[S](=O)(=O)C2CC2""",21,"""9DCC59D596D5500C"""
+"""E141C77FA6051A7D_3554A1B42A891579_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N2CCCC(CC=C)[S]2(=O)=O""",21,"""9DCC59D596D5500C"""
+"""03506D2824048101_DC229B933BA7DF26_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(CCCN)[S](=O)(=O)C(F)F""",21,"""9DCC59D596D5500C"""
+"""8C06A6965C4D9D2B_2F22317EA1B830F2_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""9DCC59D596D5500C"""
+"""56BA2F96AD290DFB_264C219D58ADAF4D_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N2CCCCNCC[S]2(=O)=O""",21,"""9DCC59D596D5500C"""
+"""F3CE150EA1A6C842_5214E63E5B8473E5_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""9DCC59D596D5500C"""
+"""7B331715C516AEF7_BDCF162A8DE8BC93_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""9DCC59D596D5500C"""
+"""8B404CE569A93902_1A3139624E4FAF89_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""9DCC59D596D5500C"""
+"""BE68C7AEA68DA5D3_2276C83396FEBD86_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""9DCC59D596D5500C"""
+"""9FB373AF74E732F5_8828CA394F23D020_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""9DCC59D596D5500C"""
+"""A10DE4825EF05B31_2C8A4CE1114F395B_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""9DCC59D596D5500C"""
+"""227B466E00E0DE90_3CC6929D4848F2BE_6036_UN""","""CC(C1=C(C=C(C=C1)Br)F)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""9DCC59D596D5500C"""
+"""5EA18641A5EC8666_41C85650DA219883_6016_UN""","""CC(O)C1=C(C=C(C=C1)C(=O)C2=CC3=C(C=C2)OCO3)F""",21,"""9DCC59D596D5500C"""
+"""3488E9CA49AA62BB_489B26D3D091C34C_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](CC)(=O)=O)CC(=O)OC""",21,"""A34F6E1BA9835DC3"""
+"""C752514B4D73B0A3_6BC693776F522BD1_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""A34F6E1BA9835DC3"""
+"""C3136EBBC9170038_41B1BC0EBDD93677_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""A34F6E1BA9835DC3"""
+"""9CC1F4DA37FA2ACE_1304ABE7714183E8_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""A34F6E1BA9835DC3"""
+"""9D200EE81317D8DE_724F7844C15AE012_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2CCCNC2""",21,"""A34F6E1BA9835DC3"""
+"""8050BC4FBCAB2D3A_444D446EF33BACA0_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C)[S](=O)(=O)CC2CCCN2""",21,"""A34F6E1BA9835DC3"""
+"""F253689D1E73C19C_609207D35880DCB6_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""A34F6E1BA9835DC3"""
+"""358F365AA6202FFE_AFB632C719DD1516_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2CCCNC2""",21,"""A34F6E1BA9835DC3"""
+"""D00C1C9F6E1BA665_7AF1355EEA5BA85C_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""A34F6E1BA9835DC3"""
+"""07F8171CCDA1FD83_C2B701FB7C8BD527_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(CC)[S](=O)(=O)C2CCNC2""",21,"""A34F6E1BA9835DC3"""
+"""B316E187F2A7B5EB_07148FC1C04BFADE_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""A34F6E1BA9835DC3"""
+"""FBD4A25B96F979D8_A24F1AA582AEFD29_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""A34F6E1BA9835DC3"""
+"""EC3434871357219C_ACDE6DEFBBC88EA6_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""A34F6E1BA9835DC3"""
+"""6F0446F3BFB36622_424700DE0CF728A6_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C)(=O)=O)CCNC2CC2""",21,"""A34F6E1BA9835DC3"""
+"""89063C11F3E1124C_FDDB45A1C5E3AB0E_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""A34F6E1BA9835DC3"""
+"""408C5CF3B672F8F6_4A55B5D2879F4D07_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2CCNCC2""",21,"""A34F6E1BA9835DC3"""
+"""38F3C74738F69530_E4C7D6925D8842A8_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""A34F6E1BA9835DC3"""
+"""864562E28B6FFB75_FCE3077E6F4D8E1F_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""A34F6E1BA9835DC3"""
+"""B46029B0BBFF8BE2_1CAF4E2832EF0D73_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""A34F6E1BA9835DC3"""
+"""9845911D3612C396_50C1F32B0EE95157_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2CCNCC2""",21,"""A34F6E1BA9835DC3"""
+"""A596E934321C7DB7_2FDA266A91CD9C39_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""A34F6E1BA9835DC3"""
+"""3D9CE4C3A48C87C3_FFA57568CBE2B4DF_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""A34F6E1BA9835DC3"""
+"""F156EE4E60930D6F_2D94A63AA34E14D7_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""A34F6E1BA9835DC3"""
+"""71A6039A572C8492_96C57FA1ABD93B93_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""A34F6E1BA9835DC3"""
+"""DC455FE40A81B4FE_646424B2E3C2E5A9_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""A34F6E1BA9835DC3"""
+"""92199537E66FE95D_4470303BE302A595_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C)(=O)=O)CC2CNCC2""",21,"""A34F6E1BA9835DC3"""
+"""B8E9F0FBC46FCA34_780C8B2DB4F70A23_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""A34F6E1BA9835DC3"""
+"""643E1E3527A25AEA_714496B4C9F17B5C_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""A34F6E1BA9835DC3"""
+"""5D9EC727AC9A2914_D3714F6CB426D3D7_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""A34F6E1BA9835DC3"""
+"""8FE94C08245761CE_C2659C4FA753E0E3_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""A34F6E1BA9835DC3"""
+"""7EBCAC136A9BFADA_37D3A2635DC80ED8_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(CCCN)[S](=O)(=O)C2CC2""",21,"""A34F6E1BA9835DC3"""
+"""18DBE686F6AB77A2_0BD7967A15DF18B6_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2CCCC(CC=C)[S]2(=O)=O""",21,"""A34F6E1BA9835DC3"""
+"""C1058D809B64E308_E2A1AC5D04F1D2E9_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(CCCN)[S](=O)(=O)C(F)F""",21,"""A34F6E1BA9835DC3"""
+"""99240818EE964A18_11A106B09EEE3D3D_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""A34F6E1BA9835DC3"""
+"""2AC3250816295606_18CF165367FBA282_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2CCCCNCC[S]2(=O)=O""",21,"""A34F6E1BA9835DC3"""
+"""D88352B276FFC8FF_6C97D1F064D27E2A_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""A34F6E1BA9835DC3"""
+"""C01BA84E37CF2412_834C21E4B2BEB15C_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""A34F6E1BA9835DC3"""
+"""239EBFEE5202F243_24B20EAC7119A246_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""A34F6E1BA9835DC3"""
+"""DADCC78CBD6B2945_1CF5FFFDA9A8B049_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""A34F6E1BA9835DC3"""
+"""5C19702BB6B224A9_B6ABFDF77075DDEF_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""A34F6E1BA9835DC3"""
+"""0DA4F871725052DF_12097B2F2E193494_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""A34F6E1BA9835DC3"""
+"""E615F55E0A5CF888_0245A553771EFF71_6036_UN""","""CCC(C1=CC(=CC=C1)Br)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""A34F6E1BA9835DC3"""
+"""D7615B6908D58BFB_7F4B619EE577954C_6016_UN""","""CCC(O)C1=CC(=CC=C1)C(=O)C2=CC3=C(C=C2)OCO3""",21,"""A34F6E1BA9835DC3"""
+"""B5CF2044CDB130E5_4CD29AF2DEB27EE6_6036_UN""","""C(COC1=CC(=CN=C1)Br)N([S](CC)(=O)=O)CC(=O)OC""",21,"""A706D23AA7A0E069"""
+"""62F206EC0E470905_6F8F2F566171967B_6036_UN""","""C(COC1=CC(=CN=C1)Br)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""A706D23AA7A0E069"""
+"""2060B66E2F93A3C6_45F8002FB3FA8BDD_6036_UN""","""C(COC1=CC(=CN=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""A706D23AA7A0E069"""
+"""2EA0D5CD5D5C5FBC_174D17C67F623E42_6036_UN""","""C(COC1=CC(=CN=C1)Br)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""A706D23AA7A0E069"""
+"""381B2F7A9F0CC4DD_7606C465CF795DB8_6036_UN""","""C(COC1=CC(=CN=C1)Br)N(C)[S](=O)(=O)C2CCCNC2""",21,"""A706D23AA7A0E069"""
+"""77102CCB31B66538_4004F84FFD18110A_6036_UN""","""C(COC1=CC(=CN=C1)Br)N(C)[S](=O)(=O)CC2CCCN2""",21,"""A706D23AA7A0E069"""
+"""302DD34F4CB32CB7_64DBBBF256A3611C_6036_UN""","""C(COC1=CC(=CN=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""A706D23AA7A0E069"""
+"""96407295ED8B91DB_ABFF8EE617FEA8BC_6036_UN""","""C(COC1=CC(=CN=C1)Br)N([S](C)(=O)=O)C2CCCNC2""",21,"""A706D23AA7A0E069"""
+"""E02929F9A0F409E8_7EB8897FE47815F6_6036_UN""","""C(COC1=CC(=CN=C1)Br)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""A706D23AA7A0E069"""
+"""3F01D0360CE7298A_C6FEBDDA72A8688D_6036_UN""","""C(COC1=CC(=CN=C1)Br)N(CC)[S](=O)(=O)C2CCNC2""",21,"""A706D23AA7A0E069"""
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+"""1270A3B55425EB03_62C13B08E7CCFBF2_6006_UN""","""CCOC1=C(C(=CC(=C1)C#N)C2=C(OC)C=CC=C2F)O""",21,"""C759E844D912F463"""
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+"""D51D8543C2E94ABC_5A5204CA7C8C00D8_6006_UN""","""CCOC1=C(C(=CC(=C1)C#N)C3=CC2=C(C=CC=N2)S3)O""",21,"""C759E844D912F463"""
+"""D46679A8317FD652_ED27847574FF06A0_6006_UN""","""CCOC1=C(C(=CC(=C1)C#N)C2=C(C(=CC=C2O)F)F)O""",21,"""C759E844D912F463"""
+"""15595C770E8E549D_0A64BEFF25B905BA_6006_UN""","""CCOC1=C(C(=CC(=C1)C#N)C2=CSC3=C2C=CC=C3)O""",21,"""C759E844D912F463"""
+"""13B27710287A8E35_7562024AE28E772D_6006_UN""","""CCOC1=C(C(=CC(=C1)C#N)C2=CC=C[N]3N=CC=C23)O""",21,"""C759E844D912F463"""
+"""095749EC9F017C29_CCC82BCB63C89C9A_6006_UN""","""CCOC1=C(C(=CC(=C1)C#N)C2=CN=C(C=C2)C(F)F)O""",21,"""C759E844D912F463"""
+"""92247EE1F0B1FC92_A7D3F7C041AF6C16_6006_UN""","""CCOC1=C(C(=CC(=C1)C#N)C2=CC3=C(C=C2)CCO3)O""",21,"""C759E844D912F463"""
+"""161542CCE2A1AFEA_F1108D3475D53F95_6006_UN""","""CCOC1=C(C(=CC(=C1)C#N)C2=CC=C(C=C2)[N](=O)=O)O""",21,"""C759E844D912F463"""
+"""6AB6DEC51626FF3D_0ADE8991BAF68A0E_6006_UN""","""CCOC1=C(C(=CC(=C1)C#N)C2=CC3=C(C=C2)C=N[NH]3)O""",21,"""C759E844D912F463"""
+"""C9C1A79B7D5CC20A_AE6AEA11CB2FD84C_6006_UN""","""CCOC1=C(C(=CC(=C1)C#N)C2=CC=C(S2)C(F)(F)F)O""",21,"""C759E844D912F463"""
+"""4A2A99262942660F_0B8984643A43576F_6003_UN""","""CCOC1=C(C(=CC(=C1)C#N)Cl)OC2=CC=C(C=C2)C#N""",21,"""C759E844D912F463"""
+"""17D1119E1994B042_34A97E6C7BDBEA4E_6003_UN""","""CCOC1=C(C(=CC(=C1)C#N)Cl)OC2=CC=CC=C2[N+]#[C-]""",21,"""C759E844D912F463"""
+"""9F6063DB406A2961_33FE8B1E1A96D7EC_6003_UN""","""CCOC1=C(C(=CC(=C1)C#N)Cl)OC2=CC=CC=C2C#N""",21,"""C759E844D912F463"""
+"""F10DA1860EF70474_DB7E297A8468FE90_6003_UN""","""CCOC1=C(C(=CC(=C1)C#N)Cl)OC2=CC=C(C=C2)[N+]#[C-]""",21,"""C759E844D912F463"""
+"""1038F775006B520B_5545AC983B4529EE_6003_UN""","""CCOC1=C(C(=CC(=C1)C#N)Cl)OC2=CC=CC(=C2)[N+]#[C-]""",21,"""C759E844D912F463"""
+"""72A609ACB4EA0C0C_57D4E5879DCBAD24_1031_UN""","""[N]2(CC1(CCC1)C#C)C3=C(C(=C2C)C(OCC)=O)CCC3""",21,"""C84F5008BEF2719F"""
+"""53A472FE824413CD_3FA5801E474DF086_2267_UN""","""NCC1(CCC1)C#CC2=CC=C(C(CCC(O)=O)=O)C=C2""",21,"""C84F5008BEF2719F"""
+"""FF9DABAD4E5F8BE1_A1760948A8BAA7D5_2267_UN""","""NCC1(CCC1)C#CC2=C(C(O)=O)C=C(C(=C2)F)[N](=O)=O""",21,"""C84F5008BEF2719F"""
+"""D64DB09EA52DFA9F_4588FA0B4A8ABA70_2267_UN""","""NCC1(CCC1)C#CC3=CC2=CC=CC(=C2N=C3)[N](=O)=O""",21,"""C84F5008BEF2719F"""
+"""CC86E9A052B8A69B_22BE0CE5F91439FB_2267_UN""","""NCC1(CCC1)C#CC2=C[NH]C3=C2C=C(C(OC)=O)C=C3""",21,"""C84F5008BEF2719F"""
+"""0630C7F3211B6168_A93FA7177F06F0EA_2267_UN""","""NCC1(CCC1)C#CC3=CC(=C2C=CC=CC2=C3)C(O)=O""",21,"""C84F5008BEF2719F"""
+"""94A286C225EFBA0B_59B4B590C94218BF_2267_UN""","""NCC1(CCC1)C#CC3=C(C(O)=O)C=C2C=CC=CC2=C3""",21,"""C84F5008BEF2719F"""
+"""65F46EE4D9A9C6E5_99BBB44D43904424_2267_UN""","""NCC1(CCC1)C#CC2=CC=C(C=C2)C(=O)C3CCCO3""",21,"""C84F5008BEF2719F"""
+"""4174360B9C668327_DEDE2E3539006348_2267_UN""","""NCC1(CCC1)C#CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""C84F5008BEF2719F"""
+"""C8D4E9483D32B93F_D1F37EE017AAE0A4_2267_UN""","""NCC1(CCC1)C#CC2=C([N](=O)=O)C=C(C=C2)C(F)(F)F""",21,"""C84F5008BEF2719F"""
+"""532D69AEEE0CB374_B70F402BB6BF8DC2_2267_UN""","""NCC1(CCC1)C#CC2=C(C(NCC(O)=O)=O)C=CC=C2""",21,"""C84F5008BEF2719F"""
+"""CD5BA8387EE791FE_1DDBF06C387C976D_2267_UN""","""NCC1(CCC1)C#CC2=N[N](CC[S](CC)(=O)=O)C=C2C""",21,"""C84F5008BEF2719F"""
+"""D1F9AA9D236DAE86_FD5FA361709ECFB3_2267_UN""","""NCC1(CCC1)C#CC2=N[N](C=C2C)C3CC[S](=O)(=O)C3""",21,"""C84F5008BEF2719F"""
+"""2BD4849F2F72CE80_98746C979B0D49BA_2267_UN""","""NCC1(CCC1)C#CC2=C(C(N)=O)C=C(C=C2)C(F)(F)F""",21,"""C84F5008BEF2719F"""
+"""8449A472824227DD_5A5E5829709D83E8_2267_UN""","""NCC1(CCC1)C#CC3=C2CCC(C(OC)=O)CC2=N[NH]3""",21,"""C84F5008BEF2719F"""
+"""4C2CE063466EAA82_E49367C0D6969467_2267_UN""","""NCC1(CCC1)C#CC2=CC(=CC(=C2C)C(=O)O)[N](=O)=O""",21,"""C84F5008BEF2719F"""
+"""B89FA701502CE706_CC787688CCD3FF6A_2267_UN""","""NCC1(CCC1)C#CC2=C(C(OCC)=O)C=N[N]2C(C)C""",21,"""C84F5008BEF2719F"""
+"""FE540CE888665015_0F078061CE5B2454_2267_UN""","""NCC1(CCC1)C#CC2=CC=CC(=C2)[C@@H](CC(OC)=O)N""",21,"""C84F5008BEF2719F"""
+"""715AE1C5EEE737B4_DA17A2DD5F13BA07_2267_UN""","""NCC1(CCC1)C#CC3=CC=C(CC2(C)NCCC2)C=C3""",21,"""C84F5008BEF2719F"""
+"""EABCBAFD08DC4FBE_79A9EBD0D18ADD6B_2267_UN""","""NCC1(CCC1)C#CC2=C[NH]C3=CN=C(C(F)(F)F)C=C23""",21,"""C84F5008BEF2719F"""
+"""401B6AA299B19C8B_52A646C42EF49748_2267_UN""","""NCC1(CCC1)C#CC2=C(C)C=C(C(=C2)C)C3OCCO3""",21,"""C84F5008BEF2719F"""
+"""ECFD76631398C0EF_BE2B37E75ECCBE95_2267_UN""","""NCC1(CCC1)C#CC2=CC=C(C=C2)C3NCCNC3=O""",21,"""C84F5008BEF2719F"""
+"""019B7975C5DEFCD6_44962CDB60E4C293_2267_UN""","""NCC1(CCC1)C#CC2=C(C(C)=O)C=CC3=C2C=CC=C3""",21,"""C84F5008BEF2719F"""
+"""0F050DE28884524C_E2FAB8BE42210557_2267_UN""","""NCC1(CCC1)C#CC(B2OC(CN(C)CC(O2)=O)=O)=C""",21,"""C84F5008BEF2719F"""
+"""E99A83B5E0F0DF5F_689789B145AF8E03_2267_UN""","""NCC1(CCC1)C#CC2=C[N](CC(OCC)OCC)N=C2""",21,"""C84F5008BEF2719F"""
+"""05F19214D2FAAD51_B401496320647448_2267_UN""","""NCC1(CCC1)C#CC2=CN=C3C=C(C(OC)=O)C=C[N]23""",21,"""C84F5008BEF2719F"""
+"""7FE70F0DAFE30B9F_0213DD6524831BE4_2267_UN""","""NCC1(CCC1)C#CC2=CC=CC(=C2)[C@H](CC(OC)=O)N""",21,"""C84F5008BEF2719F"""
+"""1A6D6714384EB7AE_071E441E4C747C71_2267_UN""","""NCC1(CCC1)C#CC3=CC=C(C2=NN=C(C)N=N2)C=C3""",21,"""C84F5008BEF2719F"""
+"""6778A8B5B7924111_FEDB8C56FEACD25B_2267_UN""","""NCC1(CCC1)C#CC2=CC3=C(C=C2)C4=C(O3)C=CC=C4""",21,"""C84F5008BEF2719F"""
+"""A04EE21BBD8533EB_DA01888CA802D9D3_2267_UN""","""NCC1(CCC1)C#CC2=C(C(OC)=O)[NH]N=C2C3CNC3""",21,"""C84F5008BEF2719F"""
+"""DBD4F814906320D7_AD69359E6FD7B3A4_2267_UN""","""NCC1(CCC1)C#CC2=CC(=CC(=C2)C(F)(F)F)C(O)=O""",21,"""C84F5008BEF2719F"""
+"""04920A7F87052DF2_7B22D1BCA7086A95_2267_UN""","""NCC1(CCC1)C#CC2=C(C=CC(=C2)C(OC)=O)C(C)C""",21,"""C84F5008BEF2719F"""
+"""37C73E8E42CCDC84_5FBD2E549FF6B02E_2267_UN""","""NCC1(CCC1)C#CC2=CC(=C(C(OC)=O)C=C2)[N](=O)=O""",21,"""C84F5008BEF2719F"""
+"""4CDD312C362BB6FF_D0ADD9C85E7AD1A7_2267_UN""","""NCC1(CCC1)C#CC2=CC(=CC=C2)CC3=CC=CC=C3""",21,"""C84F5008BEF2719F"""
+"""6862C3209ADB00DE_99B8F479D1D2CEB4_2267_UN""","""NCC1(CCC1)C#CC2=CC=C(C=C2)CN3CCCCC3""",21,"""C84F5008BEF2719F"""
+"""DC77ED1C8AD62A60_459CCE1BEE55F03E_2267_UN""","""NCC1(CCC1)C#CC2=CC(=C(C=C2)F)C[C@H](N)C(=O)O""",21,"""C84F5008BEF2719F"""
+"""099B2DCC025B555D_8A2EDAEDF9CD1D8F_2267_UN""","""NCC1(CCC1)C#CC2=C(C(OC)=O)[NH]C3=C2C=CC=C3""",21,"""C84F5008BEF2719F"""
+"""106E55AA3E2D699A_CE042D486EE3C959_2267_UN""","""NCC1(CCC1)C#CC2=C[NH]C3=C2C=NC(=N3)C(OC)=O""",21,"""C84F5008BEF2719F"""
+"""306A27AA57953CE4_B5A2A3158693EC09_2267_UN""","""NCC1(CCC1)C#CC3=CC2=C(N=C(C(O)=O)C=C2)C=C3""",21,"""C84F5008BEF2719F"""
+"""43EE68D3A3B8FC8B_87041B8DFD7CC453_2267_UN""","""NCC1(CCC1)C#CC2=CC=C(CCCCC(O)=O)C=C2""",21,"""C84F5008BEF2719F"""
+"""2E79C5697F97F846_B227134ACB09BF5C_2267_UN""","""NCC1(CCC1)C#CC2=CC3=C(C=C2)C4=C(C3)C=CC=C4""",21,"""C84F5008BEF2719F"""
+"""08E6F6C954A9EACF_EA95D9100B554A49_2267_UN""","""NCC1(CCC1)C#CC2=CC(=C(C=C2)F)CC(N)C(=O)O""",21,"""C84F5008BEF2719F"""
+"""53D9F1F5F353E10B_B2F3AE7E1507B3D0_2267_UN""","""NCC1(CCC1)C#CC3=NC2=C(OC)C=CC(=C2S3)OC""",21,"""C84F5008BEF2719F"""
+"""6CF826F312A071DA_3F354C624A9DE91F_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](CC)(=O)=O)CC(=O)OC""",21,"""D4E104AA338F7790"""
+"""CC0574EFA8BB2FF7_1C68F9C6F55E0182_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([C@H](C(OC)=O)C)[S](=O)(=O)C""",21,"""D4E104AA338F7790"""
+"""ABE9A3813E1DC8FC_361FD6BF27D51C24_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Br)S2""",21,"""D4E104AA338F7790"""
+"""8C4B35970B0AC5F8_64AAC156EB4DA9BB_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2C3=C(C[S]2(=O)=O)C=CC=C3""",21,"""D4E104AA338F7790"""
+"""44B4DE7FE83BE44D_05E112F55B56CA41_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2CCCNC2""",21,"""D4E104AA338F7790"""
+"""AF7A1D78BCAC9223_33E32EDF693786F3_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)CC2CCCN2""",21,"""D4E104AA338F7790"""
+"""4D1915CBF223B406_173C6D62C28CF6E5_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2=CC=C(Cl)S2""",21,"""D4E104AA338F7790"""
+"""B8A0DD364E07FCC9_D818587683D13F45_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C)(=O)=O)C2CCCNC2""",21,"""D4E104AA338F7790"""
+"""0AF83D32365398A1_0D5F5FEF7057820F_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C)(=O)=O)C2=NN=C(N)S2""",21,"""D4E104AA338F7790"""
+"""226A0E54C43AEC81_B5196B4AE687FF74_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(CC)[S](=O)(=O)C2CCNC2""",21,"""D4E104AA338F7790"""
+"""3BA6B4B0426B2925_70BAE5705A47D08D_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C(C)(C)C)(=O)=O)CC=C""",21,"""D4E104AA338F7790"""
+"""A7A5D83E8989134B_D5E1701418A2D77A_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)CC[S](=O)(=O)C""",21,"""D4E104AA338F7790"""
+"""05DE04BA2F3AB686_DB70075E21C4A4F5_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C(C)(C)C)[S](=O)(=O)CCN""",21,"""D4E104AA338F7790"""
+"""000411CDB0E8B252_35E96A6F96FB02F5_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C)(=O)=O)CCNC2CC2""",21,"""D4E104AA338F7790"""
+"""6BD6B441ED917250_8A752F105FEF815D_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C)(=O)=O)C(=O)CN=[N]#N""",21,"""D4E104AA338F7790"""
+"""FCF98A83E7E50DDD_3DFBDF631D936754_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2CCNCC2""",21,"""D4E104AA338F7790"""
+"""2777827EB850E196_9369BC23C78468FB_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2[S](CCC2C(OC)=O)(=O)=O""",21,"""D4E104AA338F7790"""
+"""69AA0A2AA3FE128A_8B4D6DCFF541A44C_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2[S](=O)(=O)C3=C(C2)C=CC=C3""",21,"""D4E104AA338F7790"""
+"""C206B8E9FCB1793A_6B012499A8E32720_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C)(=O)=O)CC2=CC=NO2""",21,"""D4E104AA338F7790"""
+"""79555CF6632CAD3D_276F999A94E57B04_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C)(=O)=O)C2CCNCC2""",21,"""D4E104AA338F7790"""
+"""E1FE3FF56A3871A8_58744CDB0BC1B66A_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C)(=O)=O)C2=NC=CC=C2""",21,"""D4E104AA338F7790"""
+"""F40E4E24D32B4E8F_880B1FD951EE9E8C_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2=CN=CC=C2""",21,"""D4E104AA338F7790"""
+"""70DA872DEA2EECEC_5A3ACC8B39423E84_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C(C)(C)C(=N)N)[S](=O)(=O)C""",21,"""D4E104AA338F7790"""
+"""EC2D63C7597D24FE_E16B151031D511C0_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C)[S](=O)(=O)C2=C[N](C)C=N2""",21,"""D4E104AA338F7790"""
+"""37E9A76C947EA90D_13CA4E0379CECFFA_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2CCCC(C(C)C)[S]2(=O)=O""",21,"""D4E104AA338F7790"""
+"""D05921621CD2C6B2_33DE5A8A790E8FC6_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C)(=O)=O)CC2CNCC2""",21,"""D4E104AA338F7790"""
+"""134E16D81111E8C4_0FA2E19C2EFB2070_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C)(=O)=O)[C@@H]2CNCCC2""",21,"""D4E104AA338F7790"""
+"""D0781DFC3C601B24_06EAFC0553FD510F_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(CCCCl)[S](=O)(=O)C2CC2""",21,"""D4E104AA338F7790"""
+"""A0E1CC4760A6B499_A4DF25DD2E2AF984_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2C(=O)C3=C([S]2(=O)=O)C=CS3""",21,"""D4E104AA338F7790"""
+"""9D89A99438CF2C34_B5CBF6FE3D5FCAB0_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(C(C(C)(C)N)=O)[S](=O)(=O)C""",21,"""D4E104AA338F7790"""
+"""922E36A4E59B7375_407DC8D2C7C4248B_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(CCCN)[S](=O)(=O)C2CC2""",21,"""D4E104AA338F7790"""
+"""6D974BFE0113483D_7C79FCCB8FD332E5_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2CCCC(CC=C)[S]2(=O)=O""",21,"""D4E104AA338F7790"""
+"""60E11EE89E3682D5_950FC6EC9EFDF8BA_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(CCCN)[S](=O)(=O)C(F)F""",21,"""D4E104AA338F7790"""
+"""58748BAC58783FC5_660F6C0104E2176E_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2[S](C3(CC2CI)CC3)(=O)=O""",21,"""D4E104AA338F7790"""
+"""3C7E5D708D36215E_6F617CE2FDF788D1_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2CCCCNCC[S]2(=O)=O""",21,"""D4E104AA338F7790"""
+"""CD66252CECF95FAD_1B39BB41FEDE5479_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2[S](=O)(=O)C3(C2)CCOCC3""",21,"""D4E104AA338F7790"""
+"""201C4A38AC8629BF_F4E24B5528B29B0F_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2C(CN)CC3([S]2(=O)=O)CC3""",21,"""D4E104AA338F7790"""
+"""BAC126A1DCDCAC87_531C641DEB158815_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](=O)(=O)C2CC2)C3CNC3""",21,"""D4E104AA338F7790"""
+"""478B3BDE614EE82F_6B5B954C33A49A1A_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N2CC3(C[S]2(=O)=O)CCCC3""",21,"""D4E104AA338F7790"""
+"""507F9AADBBF06838_C1059746EA79F7BC_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](=O)(=O)C2CNC2)C3CC3""",21,"""D4E104AA338F7790"""
+"""2F5A68D0E77099FA_65A7119EB4151EC7_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N([S](C)(=O)=O)CC[S](=O)(=O)Cl""",21,"""D4E104AA338F7790"""
+"""C08CB657E3FE0EFC_75EBCFE2ED12D522_6036_UN""","""C(CCC1=C(C=CC=C1)Br)N(CCC)[S](=O)(=O)C(F)(F)F""",21,"""D4E104AA338F7790"""
+"""9D973ADB08C067EB_08E50B2F7F7BBF1F_6016_UN""","""OCCCC1=C(C=CC=C1)C(=O)C2=CC3=C(C=C2)OCO3""",21,"""D4E104AA338F7790"""
+"""C7F5DFF927C882EC_3F84F750AA0768E1_6014_UN""","""COC1=C(C=C(C=C1)Cl)C#CC=CC2=CC=C([N](=O)=O)O2""",21,"""536BC9BB88378E9C"""
+"""9D440CC1F136BCCE_D1A0FF493FED86ED_6014_UN""","""COC1=C(C=C(C=C1)Cl)C#CC2=CC(=C(C)NC2=O)C#N""",21,"""536BC9BB88378E9C"""
+"""4F7A9AFC1143DDBC_60006F8E0FDF9B9A_6014_UN""","""COC1=C(C=C(C=C1)Cl)C#CC=CC2=C(C=C(C)C=C2)C""",21,"""536BC9BB88378E9C"""
+"""92B489461479FFFE_3591FA278DDA435E_6014_UN""","""COC1=C(C=C(C=C1)Cl)C#CC2=C(C(NC(=C2C)C)=O)C""",21,"""536BC9BB88378E9C"""
+"""AF1C2D38140A6DE3_DE5717C3C5F18E42_6014_UN""","""COC1=C(C=C(C=C1)Cl)C#CC2=CC(=CNC2=O)C(O)=O""",21,"""536BC9BB88378E9C"""
+"""D010F22725240481_E88777A6F56BD2E4_6014_UN""","""COC1=C(C=C(C=C1)Cl)C#CC2=CCN([S](Cl)(=O)=O)CC2""",21,"""536BC9BB88378E9C"""
+"""1833AB289EEDB7CF_D5D5EE6F11CF6C58_6014_UN""","""COC1=C(C=C(C=C1)Cl)C#CC2=CCC(C(C)(C)C)CC2""",21,"""536BC9BB88378E9C"""
+"""46B053CDE1765B60_01223F45A6EFEC1A_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C(C(C)C)Br)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""916AE0BB6CE40B2A_13C913302952A176_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(CCC(C)C)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""B82D17A3D2B16B6B_8A179FB5D4710657_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)C3=CN=CS3)Cl""",21,"""536BC9BB88378E9C"""
+"""3694E8AF46C3E1F0_07C76CF048C8603D_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C(C)(C)C#C)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""260A636256137872_40FD1B94E56A4B94_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)CCCC#C)Cl""",21,"""536BC9BB88378E9C"""
+"""98C371EAEA3A0330_73A5E68C126DBA03_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(CCN(C)C)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""62B7441360A42CBD_F72113A75CB37E2D_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C(CCC)C)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""FF5BD2961270CF4D_C71346418B786E3E_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)CCCCBr)Cl""",21,"""536BC9BB88378E9C"""
+"""A116D39B7B546448_7676678C197F721F_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C3(C)CCC3)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""E47D92A2C8911A14_F814CA95C9920438_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(CCCCCl)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""86624C7CA09A721E_E8C74B406FEADA51_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C3CC3(C)C)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""D4955470F15E7FB9_356686834212871B_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)C3=COC=C3)Cl""",21,"""536BC9BB88378E9C"""
+"""52086CEE13FAD912_A2AC08CC532E2386_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)C3=CSC=C3)Cl""",21,"""536BC9BB88378E9C"""
+"""C22EF72A1ED1EB02_0A1E07AB60C93FE9_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C=COCC)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""9C70E61750EF706E_FFB8E4F85B94A7D9_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(CC(C)(C)Br)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""C3BC8D3332950BBC_E404057F8E428B40_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C(C(C)C)Cl)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""AC0E8D5EAFA1BBF2_5D9C673D35F15CF1_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)C3CCOC3)Cl""",21,"""536BC9BB88378E9C"""
+"""20C96F2A68CBBF73_02F68DF3F65BB529_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)C3=CC=NS3)Cl""",21,"""536BC9BB88378E9C"""
+"""7C7DA6E6CB5A9C26_9CFFD718C44575D1_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C3CC(Cl)C3)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""191E767567A93E1F_19BB813C7CA206C3_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)C3(Br)CCC3)Cl""",21,"""536BC9BB88378E9C"""
+"""A0F75B6652B4153C_4197CC14EB131BF4_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C(C(C)C)C)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""D93552E853EB295E_7FEB4059DAD6E50C_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C(OCC)=O)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""45AC8BC3033D7C38_4FEE5AD0D049D73B_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(COC(C)=O)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""4D495FB692459E94_EAF2382227E9BF63_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(CC(OC)=O)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""1D3E30D33F82114C_4208411BB21E324D_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C=CC=CC)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""3CADFF1C3C8F159E_8710CE09DA3E9CC5_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(CC(F)(F)F)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""C7FA956DE9F5335B_18F0B7D80DC1DD7B_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(COCCCl)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""90A1FED0527E16CB_4E32DC16EF55CC17_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C(C)(C)CCl)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""B0AFFEB917627A6E_F0AD11315F351B8D_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(COC(C)C)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""A233A18DF96C2CBE_B89CA8C20E110160_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)C3CCCO3)Cl""",21,"""536BC9BB88378E9C"""
+"""95978DF4CA0620C9_941DBD7B62BDBFDF_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(CCC(C)Cl)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""2CFEA2383C83F25C_BE4BD2D58DCF338B_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)C3=CSC=N3)Cl""",21,"""536BC9BB88378E9C"""
+"""E6BC7CE65D284EA6_BDE1FFDD1DFE5333_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(C(C)CCCl)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""F9B5996D34174226_6DA1435C97CC1AD2_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(CCSCC)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""C261C937C3C4B1EC_BE8535F0DFFE11D1_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(CCCSC)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""79E302F222A8FBA0_82A6510EA4FB9B55_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(=O)C3CCCC3)Cl""",21,"""536BC9BB88378E9C"""
+"""54A7E484C729903D_AA8D7953FE889265_2684_UN""","""O2C1=CC=C(C=C1C(=C2[Si](C)(C)C)C(CCCOC)=O)Cl""",21,"""536BC9BB88378E9C"""
+"""653A832F55F5A2EE_F1F8B223D0850C79_6031_UN""","""CC(CC(=O)OCC(C)=C)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""F8F264FB4DAA6159_EDE6C2C00F0BDCD8_6031_UN""","""CC(CC(=O)OCC(F)F)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""E4D0123FB3B3959B_5123E333B909BCED_6031_UN""","""CC(CC(=O)OC[C@H](C)N)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""806FB8AAD1A4D827_8D7792A5ADE9D42E_6031_UN""","""CC(CC(=O)OCC(C)S)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""3A94A2760800F8A6_F055669DF928D123_6031_UN""","""CC(CC(=O)OCCSC)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""438C9FB9C8DD6BF7_E73243C25EB0BDD5_6031_UN""","""CC(CC(=O)OCC#CC)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""A2FBE04E02ACD852_7243746C24A40E0A_6031_UN""","""CC(CC(=O)OCCON)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""A473EEAD07EAD52B_4C99AA7D8F915C1A_6031_UN""","""CC(CC(=O)OCC(C)N)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""A1328B57FE2BBCEF_7538E68CC04DB50A_6031_UN""","""CC(CC(=O)OCC(=C)Br)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""66104E8C2AA10B83_5F0A8605AC0C4013_6031_UN""","""CC(CC(=O)OC[C@@H](C)N)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""8FF94B63075D972F_6E51BAF56DB7D791_6031_UN""","""CC(CC(=O)OC[CH]=[C]=[CH2])NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""A6777DA7D72A0358_E917086D7613FEA0_6031_DP""","""CC(CC(=O)OC[C@H]1C[C@H](CN1)O[Si](C)(C)C(C)(C)C)N""",21,"""FD99C003F77F1AFA"""
+"""4D34A004CF9914F1_9989AED9A7A343DC_6031_UN""","""CC(CC(=O)OCC#CBr)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""C657E5EA10F3948D_17CD97EC733BDB52_6031_UN""","""CC(CC(=O)OCC(C)Cl)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""BF4A987AE8E06C3C_0774F86EC41DD4EF_6031_UN""","""CC(CC(=O)OCCCF)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""EA8C410244602C02_83B7E1D7351F3775_6031_UN""","""CC(CC(=O)OCC(N)=S)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""5FAA0FF9FF705771_822F3C314FD7E952_6031_UN""","""CC(CC(=O)OCCCS)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""6807B8B44EEB503E_388C93DABCB038F2_6031_DP""","""CC(CC(=O)OCC(CC1=C(OC)C=CC(=C1)Br)CN)N""",21,"""FD99C003F77F1AFA"""
+"""DB9EE3E8F22D12F2_0E47895777327303_6031_DP""","""CC(CC(=O)OCC(CC1=CC(=C(OC)C=C1)Br)CN)N""",21,"""FD99C003F77F1AFA"""
+"""32E4175C1C9F0D77_FDDE1C63951CE93C_6031_UN""","""CC(CC(=O)OCCCC)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""62395EC0B5D26116_7FBCD595574A7DC8_6031_UN""","""CC(CC(=O)OCCCN)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""1712D58CADC99FC8_9D05E7F9D4E63A1D_6031_DP""","""CC(CC(=O)OCC1=CC=CC(=C1)[N]2C=C(CN)N=N2)N""",21,"""FD99C003F77F1AFA"""
+"""27856515A794E75F_DFBD5277A2FABC7B_6031_UN""","""CC(CC(=O)OCCCBr)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""F7003A5230EC0803_9A6166C0075C105B_6031_UN""","""CC(CC(=O)OCC(C)C)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""6C668295713B0A1A_258041C22542F704_6031_UN""","""CC(CC(=O)OCCNC)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""C20A40D65A0EFE8A_A82BB8010CCF88EC_6031_UN""","""CC(CC(=O)OCC1CC1)NC(=O)OCC2=CC=CC=C2""",21,"""FD99C003F77F1AFA"""
+"""E91BE3716AEE716E_F6A404CF77D35BEB_6031_UN""","""CC(CC(=O)OCCC=C)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""E925706CCF28ACEF_37ACAE94B1C15B87_6031_UN""","""CC(CC(=O)OCCC#C)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""95F5ED6DBCA56484_2DC6DD4871C44148_6031_UN""","""CC(CC(=O)OCCCCl)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""9786C74DDB50B416_833C53DD32A367E7_6031_UN""","""CC(CC(=O)OCCC#N)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""306374FAFF7FAB7A_FC4A0E864B086FCF_6031_UN""","""CC(CC(=O)OCC(F)Br)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""97FE118CB6ED4EC1_B4DF1058C58388F6_6031_UN""","""CC(CC(=O)OCC(=C)F)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""B1B9A49DD4646159_B0175445276A7C53_6031_UN""","""CC(CC(=O)OCC=CBr)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""4E7F4197BF1EFAE5_22D3F94C51280346_6031_DP""","""CC(CC(=O)OCCCO)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""CB81BC612E2217BC_CCC89654ECF52261_6031_UN""","""CC(CC(=O)OCCOC)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
+"""3743784B2895F1A3_98CC01F46DE03CD5_6031_UN""","""CC(CC(=O)OC[C@@H]1CO1)NC(=O)OCC2=CC=CC=C2""",21,"""FD99C003F77F1AFA"""
+"""3DBA3459A976997D_7FC3507DE32477F2_6031_UN""","""CC(CC(=O)OC[C@H]1CO1)NC(=O)OCC2=CC=CC=C2""",21,"""FD99C003F77F1AFA"""
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+"""5A64D38837D79740_95BAB5A93A61F145_6031_UN""","""CC(CC(=O)OCC(Cl)Cl)NC(=O)OCC1=CC=CC=C1""",21,"""FD99C003F77F1AFA"""
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