diff --git "a/data/67.csv" "b/data/67.csv"
new file mode 100644--- /dev/null
+++ "b/data/67.csv"
@@ -0,0 +1,64939 @@
+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"""
+"""1BE426A8E5FA479E_FC49BEECD17CFE26_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2=CC=C(C)S2)=O""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""C9C20043CC1DEDF7_B579E9C946F99D00_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2C(=O)CCC2=O""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""B67F950115FF3D85_E55B120D2223A2E3_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCC(NC(N)=O)=O""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""050978733D040573_FCF9D5250D22D404_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NOC(=N2)C(C)C""",21,"""F6BB86EDAC317F0C"""
+"""25598AC8EB7542EC_4EFAEFF31F9F1A17_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CSC3=NCCN23""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""B46E060771246C31_7B47D23C74809CCA_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C[N]3C(=N2)SC=C3""",21,"""F6BB86EDAC317F0C"""
+"""21A14DA6FA7E1F15_CF54E9BA180D3F66_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCN2CCOCC2""",21,"""F6BB86EDAC317F0C"""
+"""0D40FD387E686D96_A5C834BA3F150616_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2OCCN(CC)C2""",21,"""F6BB86EDAC317F0C"""
+"""594838919144190C_40DF9AF85A463C54_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NN=N[N]2C(C)C""",21,"""F6BB86EDAC317F0C"""
+"""16C89FA03F241468_A7F09271111120C0_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCCC(N(C)C)=O""",21,"""F6BB86EDAC317F0C"""
+"""F2205269BF10BC64_324C4C49C0A6717F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)NCC2CCC2""",21,"""F6BB86EDAC317F0C"""
+"""74D33989F6D5B50F_E4C19C79AF0A368A_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2=C[N](C)N=C2)=O""",21,"""F6BB86EDAC317F0C"""
+"""B2A5030081A0FEB4_6C10A20D3B9C2F1B_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC[S](N(C)C)(=O)=O""",21,"""F6BB86EDAC317F0C"""
+"""1CD2272AC26ADD94_4060F12475AB2C3F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=N[N](C(C)C)C=C2""",21,"""F6BB86EDAC317F0C"""
+"""F518E17EEB4B2E21_3A64682CDC81E187_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(C)C=CC=C2C""",21,"""F6BB86EDAC317F0C"""
+"""D4DBA31310746CB6_B8FC82C2020BE822_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC=CC(=N2)OC""",21,"""F6BB86EDAC317F0C"""
+"""13F0D9E6BE6A9AD2_EC963794ECEA7784_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC=C(CC)C=C2""",21,"""F6BB86EDAC317F0C"""
+"""BBE0DE4789438CB2_3341A7549FFB8A7A_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2=CC=C(C)C=C2""",21,"""F6BB86EDAC317F0C"""
+"""AC53F563DA2CF743_F0D7F078E91E732F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CN=C(OC)C=C2""",21,"""F6BB86EDAC317F0C"""
+"""E52AF429F5A6659A_2D36B13980D91562_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2ON=C(C(C)C)C2""",21,"""F6BB86EDAC317F0C"""
+"""C2558BFF2C9A408D_D7E67E49686B0D42_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2COC(C)(C)O2""",21,"""F6BB86EDAC317F0C"""
+"""1FA0DF37C5126966_920CA1A76F94480C_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(NC(C)C(=O)O)=O""",21,"""F6BB86EDAC317F0C"""
+"""D70BF5C2ED84E5FE_8F6D389810CDCA2E_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(NCCOCC)=O""",21,"""F6BB86EDAC317F0C"""
+"""2BB91EF99A19048F_A3EDC3E3093EE865_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(C=CC(=C2)F)F""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""1219763ABA11B6B1_B9A584C13E5374BA_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCC2=C(C)N=CS2""",21,"""F6BB86EDAC317F0C"""
+"""BDABED8C787C6032_9F8BD2263BAC1688_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2CCC(C)CC2""",21,"""F6BB86EDAC317F0C"""
+"""A7D5BEA8FF6DFC08_E498D6FB1659D719_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC[S](C(C)C)(=O)=O""",21,"""F6BB86EDAC317F0C"""
+"""D5A3D58636AC8F9F_EC171F0AE8F803A8_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NN=C([N]2CC)C""",21,"""F6BB86EDAC317F0C"""
+"""9D0C1525BFE6A76E_81DFBB355130F321_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)C2CCOCC2""",21,"""F6BB86EDAC317F0C"""
+"""71055672D93AEEF8_494E5ABC302EFC67_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCN2CCCCC2""",21,"""F6BB86EDAC317F0C"""
+"""BC80B152C2E22BE1_FEDE8601A93DA384_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCC2=NN=C(C)O2""",21,"""F6BB86EDAC317F0C"""
+"""46CC105F14941ED5_4AF4DB2FAE8088CC_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCCN(CC)CC""",21,"""F6BB86EDAC317F0C"""
+"""87DCBCF40DBB6D4B_1C5D84B8EC06F1CE_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2CCC[S]2(=O)=O""",21,"""F6BB86EDAC317F0C"""
+"""9A559A75FF23116C_A6555B9FF5FB16AE_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(N(C)CC2CC2)=O""",21,"""F6BB86EDAC317F0C"""
+"""07B08A5AA0CC91CE_AF0DB20354B53F1E_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2=CC=C[N]2C)=O""",21,"""F6BB86EDAC317F0C"""
+"""932DB4ECA88E5344_D5E45F1AB0FDF02F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC(NC(NC)=O)=O""",21,"""F6BB86EDAC317F0C"""
+"""DAEE079D378B7808_CEE1E90CA7F5FBAA_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC=C(C(C)C)O2""",21,"""F6BB86EDAC317F0C"""
+"""9EEBC8F98059AE55_CE91368FDB22408C_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(ON=C2)C3CC3""",21,"""F6BB86EDAC317F0C"""
+"""7C788117927C466F_1033DAA82E4FC823_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(N2CCNCC2)=O""",21,"""F6BB86EDAC317F0C"""
+"""A8838F1A8C658AC9_47C592284AF26A10_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)C[C@H]2NC(O[C@@H]2C)(C)C""",21,"""F6BB86EDAC317F0C"""
+"""BE49925D479386CD_FCF11BB248A64CDB_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(NCCCCC)=O""",21,"""F6BB86EDAC317F0C"""
+"""E9D30B3CDDE91230_41F2CE54CCEB1792_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2=C[N](C)C=C2)=O""",21,"""F6BB86EDAC317F0C"""
+"""AFF259DDA5648CA6_2A9740FBFED6C85F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CSC(=N2)COC""",21,"""F6BB86EDAC317F0C"""
+"""2CC8C24D68759E36_6349A540DDF7109E_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2=C(ON=C2C)C""",21,"""F6BB86EDAC317F0C"""
+"""D77072B810E4C92B_B48AC2004864BFD2_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NN=C(O2)C3CC3""",21,"""F6BB86EDAC317F0C"""
+"""04DA19FD8E0C0D52_5E2FEF3ED41DC00B_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCN[S](CC)(=O)=O""",21,"""F6BB86EDAC317F0C"""
+"""F955E03EBF38DEA4_66938F04114632C7_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC(=C(F)C=C2)F""",21,"""F6BB86EDAC317F0C"""
+"""1551E997CB8FD3B6_8F38FE8905F2202E_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC[N]2C=CN=C2C""",21,"""F6BB86EDAC317F0C"""
+"""660912F49EF2BBBE_20EDFCE6AF0FF325_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(OC)C=CC=C2""",21,"""F6BB86EDAC317F0C"""
+"""AD0E92C93A91109B_D17F5CDE6536E715_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCOCC(OCC)=O""",21,"""F6BB86EDAC317F0C"""
+"""4857A90FF87CEB6A_BF2FA55EFE782C07_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC[N]2N=C(C)N=C2C""",21,"""F6BB86EDAC317F0C"""
+"""82FF125B2BEF28E4_0CA1BC4C88D0862C_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(ON=C2CC)C""",21,"""F6BB86EDAC317F0C"""
+"""B900FA558724CF74_CB56392ECCB361D9_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(OC=N2)C3CC3""",21,"""F6BB86EDAC317F0C"""
+"""C09222E736F50ADE_DD487F360C5B1628_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2CCN(C)CC2""",21,"""F6BB86EDAC317F0C"""
+"""455E23A39AC7F70A_1759260AECD74CCD_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(C(C)C)OC=N2""",21,"""F6BB86EDAC317F0C"""
+"""C0FD167E8A856EC2_39DAB86302B31EA6_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2C(C=CC=C2)=O""",21,"""F6BB86EDAC317F0C"""
+"""6E0281ACA9E009E9_8D907836DBD1F579_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC(=NO2)COC""",21,"""F6BB86EDAC317F0C"""
+"""C78F8C4B3E0B8ACD_0BDA1DB36D15098A_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC=C(CF)C=C2""",21,"""F6BB86EDAC317F0C"""
+"""799D7E3A4DBD6485_4FA8DFD0B32CAD05_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)NC2CCCC2""",21,"""F6BB86EDAC317F0C"""
+"""15C3D8D0F0DAE9BB_F929F9578EB82F53_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)NC2=NC=CS2""",21,"""F6BB86EDAC317F0C"""
+"""111C513D1963AAC4_3F155CB29B3438CF_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NN=C(CCC)S2""",21,"""F6BB86EDAC317F0C"""
+"""EE5D9F08C38C9FD5_9265B26A59AA7A70_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CSC(=N2)C3CC3""",21,"""F6BB86EDAC317F0C"""
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+"""AF2F36219AF67120_ABE79D8B64E96032_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=N[NH]C(=N2)C(C)C""",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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+"""A9B602988C60B1F9_8A2463350D7CF300_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)CC2CCCO2""",21,"""F6BB86EDAC317F0C"""
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+"""DCC96CC352C5AA6C_A4115AAB326BEFB2_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC=CC(=C2F)F""",21,"""F6BB86EDAC317F0C"""
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+"""F90E0A9625492E5B_F4FC03FFC8EC48E5_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCNC(NC(C)C)=O""",21,"""F6BB86EDAC317F0C"""
+"""6A8DCB62A249D3BB_4E7D0BB84E442630_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCC2=CN=C[N]2C""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""F657BAF8E946AA5B_C31C97B89A7CBBAD_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NN=C(S2)C3CC3""",21,"""F6BB86EDAC317F0C"""
+"""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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+"""340268BACA3923F6_42F746312704CEBB_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CON=C2C(C)C""",21,"""F6BB86EDAC317F0C"""
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+"""2EAD90CCC8157C69_CCD18C11DECAE469_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)C2CCCCO2""",21,"""F6BB86EDAC317F0C"""
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+"""F653FAA551D8607D_D66A026B1EA72C83_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2N(C)[S](CC2)(=O)=O""",21,"""F6BB86EDAC317F0C"""
+"""520498FD930D29C1_02B78B6DAD9DA63B_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCOC2(CCC2)C#N""",21,"""F6BB86EDAC317F0C"""
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+"""CAA4442668D15703_12DA6C602EC55831_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2OCC3CCOC23""",21,"""F6BB86EDAC317F0C"""
+"""1979CADC6A6330A1_EDAF8E4036EBE100_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2COCC(C)(C)O2""",21,"""F6BB86EDAC317F0C"""
+"""46E5EC0EDE2E9877_D31C9655BF7F4FE4_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2OCCC23CNC3""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""E7B8782EA6463E60_EF5EF09CD31FF876_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC#CC2CCCCC2""",21,"""F6BB86EDAC317F0C"""
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+"""1C80C9CB8F196579_B375644E3B931F7F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC=C[N]2C(C)C""",21,"""F6BB86EDAC317F0C"""
+"""D6D11A8C74C0F721_33096D5F0AF5D6D4_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC(OCC)OCC""",21,"""F6BB86EDAC317F0C"""
+"""2C0C8017BE29CBFE_AA786DC31035E712_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2CCCC(C)C2""",21,"""F6BB86EDAC317F0C"""
+"""4F1874230EA13F83_236FFE495905291E_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC=C(O2)C3CC3""",21,"""F6BB86EDAC317F0C"""
+"""FB1B400F78878F11_E7AA9935373BF3BD_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC(=NC=C2)OC""",21,"""F6BB86EDAC317F0C"""
+"""6D329ADF7C3BD0ED_A481DABF950F3151_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NN=C(CC)[N]2C""",21,"""F6BB86EDAC317F0C"""
+"""4CC6718F46372561_7374FC45A1811CFB_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CN=C(N(C)C)S2""",21,"""F6BB86EDAC317F0C"""
+"""841173E71E371E1B_2A6B2A5D9E25D82B_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)NC2=NN=N[NH]2""",21,"""F6BB86EDAC317F0C"""
+"""B943481EB30CA541_79FB46F80D986CFB_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2CCCNCC2""",21,"""F6BB86EDAC317F0C"""
+"""E44857230F00495C_DD1AE34E318DD2E9_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCOC(NC(N)=O)=O""",21,"""F6BB86EDAC317F0C"""
+"""68F9C1DD9CBA8B61_88644119B4F26CA2_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC=C(CC)C=C2""",21,"""F6BB86EDAC317F0C"""
+"""59BBBADEDA6D824C_E5DD05C23623859C_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(=O)N2CCCCC2""",21,"""F6BB86EDAC317F0C"""
+"""29D97882DA38A120_0181684F3A94FC14_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC(C)(C)C(F)(F)F""",21,"""F6BB86EDAC317F0C"""
+"""0BC40DB66724956E_11CA6248A6D669FC_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(F)C(=NC=N2)Br""",21,"""F6BB86EDAC317F0C"""
+"""708F9FEB5E030A2B_4CE90D4428BC3A79_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CSC3=CN=C[N]23""",21,"""F6BB86EDAC317F0C"""
+"""0507DA1BB41B02D6_986C85E7E694B3FC_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NC(=C[NH]2)C(O)=O""",21,"""F6BB86EDAC317F0C"""
+"""155D070DF749418C_2455F49F2EC816D7_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2CC(F)(F)C(N2)=O""",21,"""F6BB86EDAC317F0C"""
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+"""9CCF091984E10AB5_8AEFBC479F7E262D_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2=C[N](CC)N=C2""",21,"""F6BB86EDAC317F0C"""
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+"""C41F5893DA4C9E70_A376D57309FA2EE8_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCCC[S](Cl)(=O)=O""",21,"""F6BB86EDAC317F0C"""
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+"""A37D3889087F26BE_561E62EDDFF7FF21_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CN=C(C(C)C)S2""",21,"""F6BB86EDAC317F0C"""
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+"""4497526465BFD301_459A0F286D166C36_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC(=C(C=C2)F)C""",21,"""F6BB86EDAC317F0C"""
+"""8FD47FAAB071F5EB_07335ABD71C94847_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2N(C)CC(C2)(C)C""",21,"""F6BB86EDAC317F0C"""
+"""C402BD98BA88CBB2_EA7E5798FC5F0666_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2CC(F)(F)C2)=O""",21,"""F6BB86EDAC317F0C"""
+"""729BA75669298585_97149B0FEEB84C2C_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC=C(C=C2)C#C""",21,"""F6BB86EDAC317F0C"""
+"""F8445355DFF6EB30_59F59DEB2203CB21_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC(=O)N2CCCC2""",21,"""F6BB86EDAC317F0C"""
+"""36435CB670AFD174_399CC98F78B15307_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC(=CC=C2)C#C""",21,"""F6BB86EDAC317F0C"""
+"""E22CEEA0092199A7_94A046239D683410_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)CC([C@@H](N)C(C)(C)C)=O""",21,"""F6BB86EDAC317F0C"""
+"""EE01B823D6DC6FD9_295A1DD066FA3CCC_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCN2CCNCC2""",21,"""F6BB86EDAC317F0C"""
+"""755898214D6ABD26_AB4AB9D82CEB988B_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NOC(=C2)COC""",21,"""F6BB86EDAC317F0C"""
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+"""17C1A6B8D204D964_975A50F04BA2C0F5_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2(CC2)[S](=O)(=O)Cl""",21,"""F6BB86EDAC317F0C"""
+"""A429CB869D2429D7_A849904CD7443D07_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)CCOC2CCNCC2""",21,"""F6BB86EDAC317F0C"""
+"""4D407B694C718DCA_AE0475D96813A422_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC(N(CC)CC)=O""",21,"""F6BB86EDAC317F0C"""
+"""E688DAB91F5546FD_F1EDD9EF6546F0ED_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(NC(CC)(C)C)=O""",21,"""F6BB86EDAC317F0C"""
+"""4A83DB2A13ABEA56_7EE5D8D540908C9B_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2=C[N](CC)N=N2""",21,"""F6BB86EDAC317F0C"""
+"""5C02ECB1821D3A9A_B6B15E8D668BD957_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2=CC=CC(=C2)C""",21,"""F6BB86EDAC317F0C"""
+"""16E964E59C9A3FAE_33ECD92BFB24294C_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN(C)CC(F)(F)F""",21,"""F6BB86EDAC317F0C"""
+"""36F3C0C95FB3AF3D_F580355EA6B47F90_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2CC(C(C)C2)C""",21,"""F6BB86EDAC317F0C"""
+"""92F86EAB135DC36B_E72194E630AB2D3A_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=N[NH]C(=C2)C(C)C""",21,"""F6BB86EDAC317F0C"""
+"""24FA03126B62F276_3B34A30DF38639ED_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2C[C@H]([C@@H](C)C2)C""",21,"""F6BB86EDAC317F0C"""
+"""19E85E75FE9772B3_80625F37678793E0_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2=C[N](C)C=N2)=O""",21,"""F6BB86EDAC317F0C"""
+"""1357F975B9668F92_03E3DC2137A84CDE_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(OC)C=CC=N2""",21,"""F6BB86EDAC317F0C"""
+"""1733CB641F57A7CF_CBFEF0C7F8C11494_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(N=CC(=C2)C)F""",21,"""F6BB86EDAC317F0C"""
+"""CEF5BC9A0B2AFBF7_F75A1C5B170B2D97_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCN2CC(F)(CC2)F""",21,"""F6BB86EDAC317F0C"""
+"""614615365E88F51B_F603B768C67B6170_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC(=NC=C2)C#N""",21,"""F6BB86EDAC317F0C"""
+"""543EA477D527A5BA_C31E7A8ED31957E8_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCOC(C)(C)C(=O)O""",21,"""F6BB86EDAC317F0C"""
+"""B8D192F89C9971CF_FF7AF938E45F95F1_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC3CC2OCCC2O3""",21,"""F6BB86EDAC317F0C"""
+"""485596320E6F7FD5_6AF0A923841B66B4_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2=CC=C(C)O2)=O""",21,"""F6BB86EDAC317F0C"""
+"""DDA566B7F24DA7A2_0C5FCDD33D718654_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCCC2(C(O)=O)CC2""",21,"""F6BB86EDAC317F0C"""
+"""71D5C4D0E0591EB6_C7BA430B1E570FD2_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(COC)OC=N2""",21,"""F6BB86EDAC317F0C"""
+"""0CCCB2BD881BFDEE_B1731C1AA1F3A60F_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2CC(C)(C)OC2""",21,"""F6BB86EDAC317F0C"""
+"""4AABE5395544CAF3_BBA883C4155E9215_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCC2NC(=O)NC2=O""",21,"""F6BB86EDAC317F0C"""
+"""62340AAE172AE2DE_735F5E51C53685F7_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NO[C@@H]3COC[C@H]23""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""63AE4B0661C76AD1_B255F97D7E39C97E_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=NOC(C(O)=O)C2""",21,"""F6BB86EDAC317F0C"""
+"""EC613A6DC0D384D0_836F73F5A3678F69_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC(=NC=N2)OC""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""9F8A75BB95872154_6F16F34BB5E61892_6039_DP""","""O(CC(C(=O)O)C1=CC=CC=C1)CC(C2CCNCC2)F""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""90F5149E904617EA_D415E40E7635DC7E_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=CC=NC(=N2)OC""",21,"""F6BB86EDAC317F0C"""
+"""6FFE8F13717D042C_5F6DF0FEB82ED7FA_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=C(ON=C2OC)C""",21,"""F6BB86EDAC317F0C"""
+"""DD70E97B8F271F20_6A466FD161ED9D1D_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CCOCC(OC)OC""",21,"""F6BB86EDAC317F0C"""
+"""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"""
+"""68F23451A91C7046_D9262979AD39DDA0_6039_UN""","""O(CC(C(=O)O)C1=CC=CC=C1)CC2=N[NH]C3=C2CCC3""",21,"""F6BB86EDAC317F0C"""
+"""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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+"""4AFAA004D35F359B_5D65EA7FD6A523C7_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NC3=CC=NC=C3""",21,"""DC6EF671815BAD1F"""
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+"""6B58976CC87736FB_19A4C57F0506A527_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC[N]3C=C(C(O)=O)C=N3""",21,"""DC6EF671815BAD1F"""
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+"""C704DA5F9D0D7BA5_F30C4641372EE494_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCC3=CC(=C(F)C=C3)F""",21,"""DC6EF671815BAD1F"""
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+"""60DF1C6A46A34A45_7EE760AFDEE85342_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=C3)COC""",21,"""DC6EF671815BAD1F"""
+"""4CC5A5BEB7DB81F7_786E025642B6C7F3_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=C3)C(O)=O""",21,"""DC6EF671815BAD1F"""
+"""325A4C44ED5E2CC4_50278E514F4F8F9C_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NC3CCSC3=O""",21,"""DC6EF671815BAD1F"""
+"""BC36ECF7619FD809_4CE8DB0950C02CF9_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C=C(F)C=C3)C#N""",21,"""DC6EF671815BAD1F"""
+"""E295F22BA2763C29_055CA4F59293D74D_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCCCC[N]3C=CN=C3""",21,"""DC6EF671815BAD1F"""
+"""F772D60F1CFF15A9_BAF926C6D4625924_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCCOC(NC(N)=O)=O""",21,"""DC6EF671815BAD1F"""
+"""0BA86AAC816F0300_5122648B91A430A8_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCCC[N]3C=CN=C3C""",21,"""DC6EF671815BAD1F"""
+"""B0603D7368988DE8_601061EA3191C88B_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NC(=NO3)C(C)(C)C""",21,"""DC6EF671815BAD1F"""
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+"""9FA9FC2FFE264670_122418732325637E_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(N(CCCC)CC)=O""",21,"""DC6EF671815BAD1F"""
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+"""19DF6B2D9A29F52B_A34ACDD017BA6D07_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(OC)C=CC(=C3)F""",21,"""DC6EF671815BAD1F"""
+"""FFF2ACA577441144_5B23EFF9354130EB_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCC(=O)N3CCOCC3""",21,"""DC6EF671815BAD1F"""
+"""0BEDAEB496F9C398_AE9980CE8F75C659_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4=CC3=C(C=CC=C3)O4""",21,"""DC6EF671815BAD1F"""
+"""BEE83873D5BC39C3_DCC21CA1C10FF4F3_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(N(CC)CCC#N)=O""",21,"""DC6EF671815BAD1F"""
+"""954AFFB633CFC797_451CE2F57B3ACCB7_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NC(=CS3)C(F)(F)F""",21,"""DC6EF671815BAD1F"""
+"""2222D2DEFDF2EA88_A89B60E0A01C8033_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NC=C(OCC)C=C3""",21,"""DC6EF671815BAD1F"""
+"""8D3D30A57FCF157C_0A69055CB4E397AD_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCC3CC(CC(C)C3)C""",21,"""DC6EF671815BAD1F"""
+"""CFF1FF797D5ED9D3_F319276375173C9C_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(C3=C(N=C(C)O3)C)=O""",21,"""DC6EF671815BAD1F"""
+"""B3D4264F0D951D84_D80EF4102F4A3445_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NC3=NC=CN=C3""",21,"""DC6EF671815BAD1F"""
+"""DD5B0DBCCE265FF4_99E312B1FF3F16DA_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NC3=CN=CC=C3""",21,"""DC6EF671815BAD1F"""
+"""8961509373B8AE67_C9B07ABC1D3117A2_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=N3)N(C)C""",21,"""DC6EF671815BAD1F"""
+"""24AB852F5B05E770_6464570054D061EE_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=C(C)[N]3C4CC4""",21,"""DC6EF671815BAD1F"""
+"""2FCC47B8E4763185_F675EDEB1024D1F7_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4=CC3=C(C=CC=C3)S4""",21,"""DC6EF671815BAD1F"""
+"""E504A435DF7D0379_CF2BBD2725318BB2_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCN3CC4CCC(C3)O4""",21,"""DC6EF671815BAD1F"""
+"""351CA3EACB410BBA_CC8A0405E6C12B56_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CSC(=N3)C(F)(F)F""",21,"""DC6EF671815BAD1F"""
+"""2CC62D4FFE0F3297_C3D61A376193CE02_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NOC(=N3)C(F)(F)F""",21,"""DC6EF671815BAD1F"""
+"""82F4B969AABC4D2D_B52E469E2E8F996E_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=N3)C(C)C""",21,"""DC6EF671815BAD1F"""
+"""CDCA9120100392B6_DE2A1AB883A902CE_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC(=C3F)C#N""",21,"""DC6EF671815BAD1F"""
+"""83653E145F9C18A1_5D43C87CF204F7B7_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=C([N]3CCC)C""",21,"""DC6EF671815BAD1F"""
+"""E02BA174DA6ADD52_8BBE33EF0A86FFF0_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=C(C(C)C)[N]3C""",21,"""DC6EF671815BAD1F"""
+"""E1D9E379B8E6BDBC_FD6AAD7C07F2E46B_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NC(=CC(=N3)OC)C""",21,"""DC6EF671815BAD1F"""
+"""0E651A705408CC93_753BA398F756EEA5_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(N3CCN(C)CC3)=O""",21,"""DC6EF671815BAD1F"""
+"""032DA264D084EA9D_7EC44D6F1382D8DB_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCCC3=CC=CC(=C3)C""",21,"""DC6EF671815BAD1F"""
+"""3E05CD22E6CE158F_FF9E69D397122D7C_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC(=NC=C3)N(C)C""",21,"""DC6EF671815BAD1F"""
+"""3F39956D70712FEA_60D8705335A18D80_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NC(=CC(=C3)OC)C""",21,"""DC6EF671815BAD1F"""
+"""A64E2B7C4D963D51_0C991B97E7623D57_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(NCCCN(C)C)=O""",21,"""DC6EF671815BAD1F"""
+"""B18EAD8726EBC6F1_96FAF106902C6C12_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NC=C([N]3C)[N](=O)=O""",21,"""DC6EF671815BAD1F"""
+"""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"""
+"""BBA75812796C30EC_310FA1417B1FF02D_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCCC3=CC=C(C)C=C3""",21,"""DC6EF671815BAD1F"""
+"""C4BE02D1D5337367_DDF91E6C998E0CAA_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=C(C(F)F)C=C3""",21,"""DC6EF671815BAD1F"""
+"""873DB53658C5381E_D006FC5E338C74A8_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NCC3=CC=CO3""",21,"""DC6EF671815BAD1F"""
+"""2598FD9368994BD2_0AFB8104E80E5AB1_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCCOC3CCCCO3""",21,"""DC6EF671815BAD1F"""
+"""F15E32E6FEF0C202_26AFAF634D614FD9_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NC3=CC=CC=C3""",21,"""DC6EF671815BAD1F"""
+"""0D865C0EA07C6BB1_1E25330C2C7736A7_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)N(CC=C)CC=C""",21,"""DC6EF671815BAD1F"""
+"""B07B982088D60F0A_D92E0E6C1FC4FCEB_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NN=N[N]3C(C)(C)C""",21,"""DC6EF671815BAD1F"""
+"""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"""
+"""C59A36E0F264FC11_5CF57CB991B3705D_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(N3CCCC3(C)C)=O""",21,"""DC6EF671815BAD1F"""
+"""3E5A707F21748FE6_18F30DEDE836C829_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NC3(CCC3)C#N""",21,"""DC6EF671815BAD1F"""
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+"""5950D818D302CACD_1287D3B5005C61A6_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NOC(=N3)C(C)(C)C""",21,"""DC6EF671815BAD1F"""
+"""B01A929270969693_D01C4D66065398BD_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(N(C)CC(F)(F)F)=O""",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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+"""FE102D0A58E12A66_E884760969079A08_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=C(C=C3)N=[N]#N""",21,"""DC6EF671815BAD1F"""
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+"""9A26B1BD3799AF11_8DD3E4CBC133489B_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4CN(C3CC3)C(=O)O4""",21,"""DC6EF671815BAD1F"""
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+"""9F69A5110B001AE4_470CF515B02A25EA_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(C3=N[N](CC)N=C3)=O""",21,"""DC6EF671815BAD1F"""
+"""C56B4CAF3093225F_C576CD13F8774E9A_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=N[N](C(C)(C)C)N=N3""",21,"""DC6EF671815BAD1F"""
+"""25813CB40A50D6FD_6EA8EE0364B83DD6_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCN3NC(=O)C=CC3=O""",21,"""DC6EF671815BAD1F"""
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+"""20B8B2697D3AB940_D326689BA03A4517_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCN3C(CN(C)C3=O)=O""",21,"""DC6EF671815BAD1F"""
+"""D7DA3A5986055D44_FB428CCEDB0AD305_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4=N[N]3CCCCC3=C4""",21,"""DC6EF671815BAD1F"""
+"""97FCD8ACCFB24D47_29FFD548973F167F_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3CN=C(C(C)(C)C)O3""",21,"""DC6EF671815BAD1F"""
+"""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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+"""3B7C2826C0377E88_CE7710A99ECCD773_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C(C)C)C=CC=C3""",21,"""DC6EF671815BAD1F"""
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+"""C338BB4B54D5D53F_9B22D369C9E5562F_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(C3=C(N=C(C)S3)C)=O""",21,"""DC6EF671815BAD1F"""
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+"""92B51CF1776D9B6C_AA9DF75E9657FAFB_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(ON=C3C)C4CC4""",21,"""DC6EF671815BAD1F"""
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+"""4FC89BDBF56EEF28_60B25051D741C3B6_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC(=O)NC3=NN=CC=C3""",21,"""DC6EF671815BAD1F"""
+"""0B2C6ED379759855_0E8BC6AFC1A0137B_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=N[NH]C4=C3COCC4""",21,"""DC6EF671815BAD1F"""
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+"""C33940A951D9C64F_F1077E19D2A2200E_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4=C3C=CC=CC3=NO4""",21,"""DC6EF671815BAD1F"""
+"""FD7F205425BC77A6_9B8AF9F77F097AEB_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC4=C(C=C3)[NH]N=C4""",21,"""DC6EF671815BAD1F"""
+"""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"""
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+"""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"""
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+"""C61AC96A27FC4CF1_11D3617F94E5BC7B_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CSC=C3C(F)(F)F""",21,"""DC6EF671815BAD1F"""
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+"""B29A237663E3D340_02B95A1A677DA8F3_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C([S](C)(=O)=O)C=CS3""",21,"""DC6EF671815BAD1F"""
+"""6BB2DAFB24A123B9_B20415C48B0FA8FB_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(OC)C=CC(=N3)C""",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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+"""96DACE8493F86699_6E809EDAB636CDE1_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4CC3(CC3)[S](=O)(=O)N4""",21,"""DC6EF671815BAD1F"""
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+"""7D2271EDC7ABFAB8_09CD265F019322CB_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC=CC4=CC=N[N]34""",21,"""DC6EF671815BAD1F"""
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+"""9123ABB0DA783913_1C626CB445158453_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=CC(=CS3)C(F)(F)F""",21,"""DC6EF671815BAD1F"""
+"""F8DDC5C00C436F8D_2C7B27EC0098E1B8_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=N[N](C)C=C3[N](=O)=O""",21,"""DC6EF671815BAD1F"""
+"""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"""
+"""C01FF7C6BA4B8604_EA29AB0DB6DADC1C_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CC4=CC3=C(CNC3)C=C4""",21,"""DC6EF671815BAD1F"""
+"""2EE51C8127715DC5_F2649C53063C0AA5_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NCC(C(OC)=O)O3""",21,"""DC6EF671815BAD1F"""
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+"""3ED0392161C80560_89E520181E7BE8DB_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=NOC(=C3)CC(C)C""",21,"""DC6EF671815BAD1F"""
+"""B0F27449BA78D27C_3AAAB25D98BDF9D1_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=N[NH]C(=C3)C(OC)=O""",21,"""DC6EF671815BAD1F"""
+"""5A4FFAAADA10542D_320595B2153BCB7C_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CC(N3CC(C)NCC3)=O""",21,"""DC6EF671815BAD1F"""
+"""8C3E43DFF3AB5266_E6874F8F1FBDA6E7_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC4=CC3=C(C=CC=N3)S4""",21,"""DC6EF671815BAD1F"""
+"""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"""
+"""4C7BB899BC4F8CAF_04278C8B2D64B39D_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CCN3CCCO[P]3(N)=O""",21,"""DC6EF671815BAD1F"""
+"""5BEF74B41707F799_C3408053C0D93EA6_6039_DP""","""O(C1(CCC1)C2=CN=CC=C2)CC3=N[NH]C4=C3CNCC4""",21,"""DC6EF671815BAD1F"""
+"""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"""
+"""B50437CE71766E0C_0DE925A8F2C9F1BF_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C(F)F)C=NC=C3""",21,"""DC6EF671815BAD1F"""
+"""766598B6468CE29D_8127E281F9EAE7AD_6039_UN""","""O(C1(CCC1)C2=CN=CC=C2)CC3=C(C(F)(F)F)SC=C3""",21,"""DC6EF671815BAD1F"""
+"""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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+"""59934868ACDCD78C_99D0B905815E22B1_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3=C(C)OC(O3)=O""",21,"""549D54927626150A"""
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+"""D9177F28EE3D4D6E_24A01217637DD5D3_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCC3=C[N](C)N=C3""",21,"""549D54927626150A"""
+"""F1C31E7DD8BA1768_F2558C3B79E2A0A9_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3=CN=C(C)C=C3""",21,"""549D54927626150A"""
+"""500168D30E3AC756_033423F6896FEB03_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCCC[S](C)(=O)=O""",21,"""549D54927626150A"""
+"""224BA3CC8E2E3BAD_979B868B5789BFFB_6039_DP""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3=CC=CC(=C3)N""",21,"""549D54927626150A"""
+"""8E505C2F2D645C72_129BA8C400A03798_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCC3N(C)CCC3""",21,"""549D54927626150A"""
+"""12250B301C968D31_A1D24838579B04C5_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCN3CC(C)CC3""",21,"""549D54927626150A"""
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+"""CCEA216E3D9BA2F4_6B95F87C466BF955_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCOCCN(C)C""",21,"""549D54927626150A"""
+"""597C8A39CBB08204_C1D6919E3DE1464D_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3=C(C)C=CN=C3""",21,"""549D54927626150A"""
+"""8913C578615D3978_F5FBD2D4C34CC34D_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCCSCC(C)C""",21,"""549D54927626150A"""
+"""A16F213E551B8D1E_C2B3E83468847D42_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCCCC(F)(F)F""",21,"""549D54927626150A"""
+"""CEDD72D6C18B1C82_3DEC155915FF8D4C_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCC3=CN=CC=C3""",21,"""549D54927626150A"""
+"""5AD9858165FBC004_A647105CBF07BD7E_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC(OC)(OC)OC""",21,"""549D54927626150A"""
+"""D3C3956E52AB1A0B_88667376123BB3B6_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCC(=O)NC3CC3""",21,"""549D54927626150A"""
+"""C9CEC85C3C3EA85C_E92D4AD4334BDE67_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC(=O)NCC3CC3""",21,"""549D54927626150A"""
+"""A1B2924246968589_96C05154B91121FC_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCC(NC(N)=O)=O""",21,"""549D54927626150A"""
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+"""BAA4CE01A28A1309_ACFC894AC08EF849_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCCC3=NN=N[NH]3""",21,"""549D54927626150A"""
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+"""244113BFF15021BD_A16268AF793BC5C0_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCOC3CC3(F)F""",21,"""549D54927626150A"""
+"""A73B4F4B82003E9B_570B020960341153_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3CCC[S]3(=O)=O""",21,"""549D54927626150A"""
+"""AF6FD8DD68843AF3_5A67E97001F21AB2_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3=C[N](CC)N=C3""",21,"""549D54927626150A"""
+"""E79F74507A4FD0B9_23EA3ED5AC25D8D1_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC(OC)C3CCC3""",21,"""549D54927626150A"""
+"""5CF509025197984D_9D34D0AFC6BB60C2_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCC3=NC=CC=C3""",21,"""549D54927626150A"""
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+"""E62BDF4386CD0DC6_A0BFC11800D17E23_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3=C(F)C=CC=N3""",21,"""549D54927626150A"""
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+"""F1D66A7B4999FCD0_1CF95C904258A037_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3=NN=C[N]3CC""",21,"""549D54927626150A"""
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+"""6BF1C1F2AB0D5CB3_5683265F9440EC63_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3CCCCCO3""",21,"""549D54927626150A"""
+"""A99103BA38D5E7CF_5C89F9FFCBF5F29D_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3CCC(C)(C)O3""",21,"""549D54927626150A"""
+"""FECB66CE26775F59_873A8F7865CD5117_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC[N]3N=CC=C3C""",21,"""549D54927626150A"""
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+"""AF5E016F32D4BD61_4B54E21908590AE6_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3=NC=CC(=C3)C""",21,"""549D54927626150A"""
+"""FA2427EE3246DAEE_EEEC29C15BA9A296_6039_DP""","""O(CCSC2=NC1=C(C=CC=C1)O2)CCC3OCCNC3""",21,"""549D54927626150A"""
+"""A720070DDD4214D9_CCFCFE594FD7D563_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3=C(F)N=CC=C3""",21,"""549D54927626150A"""
+"""AB8962388B0ACD3A_79FEC4D2BACF99EE_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC3=CC(=N[N]3C)C""",21,"""549D54927626150A"""
+"""E5FC8D0848485F8F_C851FF8D62F7F751_6039_UN""","""O(CCSC2=NC1=C(C=CC=C1)O2)CC=C3CCOCC3""",21,"""549D54927626150A"""
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+"""AA325C7D4D944595_498F9F48CE1C5F17_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC=C(O1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
+"""E4C57B57894FDE5C_FF7831D34EC445B1_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(OC)C=CC(=C1)[N](=O)=O""",21,"""5B32D544AE694BD0"""
+"""51F653D9CE3DBFAE_2F53679A8211E858_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=NO1)C2=CC=CC=C2""",21,"""5B32D544AE694BD0"""
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+"""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"""
+"""9D5CE3428421DD51_4D34E95A3A8FD502_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC(=C1C=CC=CC1=N2)C""",21,"""5B32D544AE694BD0"""
+"""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"""
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+"""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"""
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+"""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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+"""F90DCCB27B538E00_AA63162287F42A90_6039_UN""","""O(CCOCCN=[N]#N)CC(N(CC(NCCC)=O)C)=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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+"""BECFC8DB1917315B_CF8A652450B65EB9_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC(=CC=C1)[N]2N=CC=C2""",21,"""5B32D544AE694BD0"""
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+"""7A12C3D6B2D16562_C64ECB0FD61EA406_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NC1CCCCCCC1""",21,"""5B32D544AE694BD0"""
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+"""5D7627C1833E0A83_3E64735F53B0C96B_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=C(C=CC(=C1)F)F)=O""",21,"""5B32D544AE694BD0"""
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+"""77DC073FABBB5AFE_41C90F107EF2C231_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=C(C=CC(=C1)C)C)=O""",21,"""5B32D544AE694BD0"""
+"""9F8D54F98E985885_A41CE6AA070263C2_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=CC(=CC(=C1)C)C)=O""",21,"""5B32D544AE694BD0"""
+"""3E7DC3CC9BAF11C2_FDAA9A44AAFAD044_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=CC(=C(C)C=C1)C)=O""",21,"""5B32D544AE694BD0"""
+"""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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+"""C64B026AD7DCA76E_13515578E2989C87_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)N(CCC#N)CCC#N""",21,"""5B32D544AE694BD0"""
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+"""942860FD10DC5E7B_6785C1CEA986F6F5_6039_UN""","""O(CCOCCN=[N]#N)CC(NC(CCCCCC)C)=O""",21,"""5B32D544AE694BD0"""
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+"""7B62DA4C82567A74_6F89D2387402FC34_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(C=C1)N2CCCC2""",21,"""5B32D544AE694BD0"""
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+"""C002E4325BADC920_BA70107C7991D250_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(C=C1)[N]2C=CC=N2""",21,"""5B32D544AE694BD0"""
+"""390C9B0AC1D1BC54_BD7CB2029EF04EDD_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC(=NO1)C2=NC=NC=C2""",21,"""5B32D544AE694BD0"""
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+"""A2A32E8C61521718_43AC1F5EFB21BA32_6039_UN""","""O(CCOCCN=[N]#N)CC(N(C(C)C)C1CCCC1)=O""",21,"""5B32D544AE694BD0"""
+"""5D1F38C3B35B3A9E_EECCA589802159BE_6039_UN""","""O(CCOCCN=[N]#N)CC(NCC(NC(C)(C)C)=O)=O""",21,"""5B32D544AE694BD0"""
+"""1B1DB4F43987DF0D_DC41F59324B71D5D_6039_UN""","""O(CCOCCN=[N]#N)CCCCCCCCCC(O)=O""",21,"""5B32D544AE694BD0"""
+"""6CD2BFEACD949191_E65C0780D5B18794_6039_UN""","""O(CCOCCN=[N]#N)CCC(C1=C(C=C(F)C=C1)F)=O""",21,"""5B32D544AE694BD0"""
+"""8FA9847BB097E276_F54D7594FED3D2D7_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C(=C(F)C(=C1F)F)F)F""",21,"""5B32D544AE694BD0"""
+"""09A09FFD9CB35F6E_944E42E9C8608A21_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC=C(C(OCC)=O)C=C1""",21,"""5B32D544AE694BD0"""
+"""6B67530790C4B423_071283EF6048717E_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=CC(=C(C=C1F)F)C)=O""",21,"""5B32D544AE694BD0"""
+"""2A21B5D84DB595AF_9AFFC3C8FA846639_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C(OC)=O)C=CN=C1F""",21,"""5B32D544AE694BD0"""
+"""30A52FF6864DACF0_38DCF7FA40CC8B45_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C=C(C(OC)=O)C=C1)F""",21,"""5B32D544AE694BD0"""
+"""84570829D1796F98_B1A973A58213B96F_6039_UN""","""O(CCOCCN=[N]#N)CC2=NC1=C(C=CC=C1)NC2=O""",21,"""5B32D544AE694BD0"""
+"""174A44844A268011_3B03B83BF015E927_6039_UN""","""O(CCOCCN=[N]#N)CCOC1=C([N](=O)=O)C=CC=C1""",21,"""5B32D544AE694BD0"""
+"""F7ADC8364FA5763C_66BA83EA74CFFF08_6039_UN""","""O(CCOCCN=[N]#N)CC1=NOC(=N1)C2CCOCC2""",21,"""5B32D544AE694BD0"""
+"""EB7C2313F42EF6AE_44E1EC08D210542E_6039_UN""","""O(CCOCCN=[N]#N)CC1=NC(=CS1)C2=CN=CC=C2""",21,"""5B32D544AE694BD0"""
+"""94E7770970E60057_63912609466A1369_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)CC1=CC=C(C=C1)C#N""",21,"""5B32D544AE694BD0"""
+"""C94E8D87648D3D90_A7B6A038663D34A1_6039_DP""","""O(CCOCCN=[N]#N)CC(N[C@@H]([C@H](CC)C)C(=O)O)=O""",21,"""5B32D544AE694BD0"""
+"""5BC580D34BFFC997_6187A63D0B0D6B6C_6039_DP""","""O(CCOCCN=[N]#N)CC(N[C@H](CC(C)C)C(=O)O)=O""",21,"""5B32D544AE694BD0"""
+"""4FA0854890DD7E75_F500628961CF714A_6039_UN""","""O(CCOCCN=[N]#N)CC2=CC1=C(C=CC(=C1)C)N=C2""",21,"""5B32D544AE694BD0"""
+"""103F5B6B994343AD_F97E3E48BD4DD88E_6039_UN""","""O(CCOCCN=[N]#N)CC(NC1=C(F)C=CC=C1F)=O""",21,"""5B32D544AE694BD0"""
+"""FACB654CA9EA3D29_9488AA4FB7F8CDAE_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=CC(=C1)OC(F)(F)F""",21,"""5B32D544AE694BD0"""
+"""C1311AB77A9EF2B0_27B536FC4637BAF6_6039_UN""","""O(CCOCCN=[N]#N)CCC=CC1=CN=CC(=C1)OC""",21,"""5B32D544AE694BD0"""
+"""D5F85EA4FD5D9A10_83E33B1B4736F021_6039_UN""","""O(CCOCCN=[N]#N)CCOC(CC)C1=CC=CC=C1""",21,"""5B32D544AE694BD0"""
+"""A0794E2302FDB46C_DADD1A4A06078AED_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C([S](N(C)C)(=O)=O)S1""",21,"""5B32D544AE694BD0"""
+"""CC5D1032042F8518_99A28CEE95FD66EA_6039_UN""","""O(CCOCCN=[N]#N)CC1=C([N](=O)=O)C=C(C=C1)C#N""",21,"""5B32D544AE694BD0"""
+"""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"""
+"""EB48225E01F2E17F_EBF387856590BA5E_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(OC(F)F)C=CC(=C1)F""",21,"""5B32D544AE694BD0"""
+"""B9D1FA24688F3FB8_BCC9A42F7762A217_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=C(C[S](C)(=O)=O)C=C1""",21,"""5B32D544AE694BD0"""
+"""6B3FCA8A0B4ECA13_A7F8404E00C059A3_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(OC(F)F)C(=CC=C1)F""",21,"""5B32D544AE694BD0"""
+"""850DF86E9584D9DF_B243CDC24B0B1506_6039_UN""","""O(CCOCCN=[N]#N)CC1=CC=CC2=C1OC(F)(F)O2""",21,"""5B32D544AE694BD0"""
+"""1B972B8AB714B2E5_D23181501C89E41F_6039_UN""","""O(CCOCCN=[N]#N)CCOCCN1C(=O)CSC1=O""",21,"""5B32D544AE694BD0"""
+"""6BDA4D682FC52C55_2D69D2D7C81EB816_6039_UN""","""O(CCOCCN=[N]#N)CC2CN=C(C1=C[N](C)N=C1)O2""",21,"""5B32D544AE694BD0"""
+"""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"""
+"""9B561B2ADB7AC3B1_19AC70872C32EDF5_6039_UN""","""O(CCOCCN=[N]#N)CC(C1=CC=C(C(OC)=O)S1)=O""",21,"""5B32D544AE694BD0"""
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+"""639323CAA0817306_80056D5B131E790F_6039_UN""","""O(CCOCCN=[N]#N)CC(=O)NC1=C(C=CC=C1)C#N""",21,"""5B32D544AE694BD0"""
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+"""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"""
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+"""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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+"""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"""
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+"""0978CC9F35B31FDD_E712F5DC231D2DE3_6039_UN""","""O(CCOCCN=[N]#N)CCCCO[S](C(F)(F)F)(=O)=O""",21,"""5B32D544AE694BD0"""
+"""2C9E70AFDC5522F4_3F4DC0998CBEB4D6_6039_UN""","""O(CCOCCN=[N]#N)CC(N=[S](N(C)C)(=O)N(C)C)=O""",21,"""5B32D544AE694BD0"""
+"""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"""
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+"""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"""
+"""8ED4B9F97159B208_64EF9765FE1204CE_6039_UN""","""O(CCOCCN=[N]#N)CC1=C(C(OCC)=O)C=N[N]1C""",21,"""5B32D544AE694BD0"""
+"""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"""
+"""90CD9E8F2CCF42B0_682C0E6B3EBF40F8_6039_UN""","""O(CCOCCN=[N]#N)CC1=CN=C(C=C1)[N]2C=CC=N2""",21,"""5B32D544AE694BD0"""
+"""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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+"""D4D860C759AC56AC_B1EFF1D12F03EA3B_6039_UN""","""CN3CCC(COCC2=NC1=CC(=C(C=C1[NH]2)F)F)C3=O""",21,"""B2562BC268A944A0"""
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+"""A03F3BC9B10A573C_127608EFF2220A3F_6039_UN""","""CN2CCC(COCC(NC1=CC(=C(C)C=C1)F)=O)C2=O""",21,"""B2562BC268A944A0"""
+"""B3104C50DE0D5099_1F9E43C95E7441C9_6039_UN""","""CN2CCC(COCC(NC1=NC=C([N](=O)=O)S1)=O)C2=O""",21,"""B2562BC268A944A0"""
+"""DB14D775E91BC8AC_B2879613D69776C3_6039_UN""","""CN3CCC(COCC1=N[N](N=C1)C2=CC=CC=C2)C3=O""",21,"""B2562BC268A944A0"""
+"""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"""
+"""BD65F0739DBEF64F_581DAAEE97C52350_6039_UN""","""CN3CCC(COCC(=O)C1=CC2=C(N=C1)OCO2)C3=O""",21,"""B2562BC268A944A0"""
+"""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"""
+"""88B8CEB50AAAD677_8384420A457738EF_6039_UN""","""CN2CCC(COCC1=C(C(C)(C)C#N)C=CC=C1)C2=O""",21,"""B2562BC268A944A0"""
+"""478F37192E7C9F98_BCA1FD6BB6FF713B_6039_UN""","""CN2CCC(COCC(N(C)C1=CC=C(C=C1)C)=O)C2=O""",21,"""B2562BC268A944A0"""
+"""ECF133A6F290EDF7_0CF6434F6C01C3B8_6039_UN""","""CN3CCC(COCC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2)C3=O""",21,"""B2562BC268A944A0"""
+"""7F19091B53236A71_B59640412CBF4E70_6039_UN""","""CN1CCC(COCCCCCCCCCN=[N]#N)C1=O""",21,"""B2562BC268A944A0"""
+"""83375F6E2C98E023_7F965E42062B71E9_6039_UN""","""CC(C)(OCC1=NN=C(O1)C3=CC2=C(CCCC2)S3)C#N""",21,"""41575F74219DC187"""
+"""D185C61F08890FD1_B3AD22D9001A109C_6039_UN""","""CC(C)(OCC(C1=CC=C(NC(CCC)=O)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""051FF7E32C310ECD_9EC2D6EABDC9A692_6039_UN""","""CC(C)(OCC(C1=C([N](CCCOC)C(=C1)C)C)=O)C#N""",21,"""41575F74219DC187"""
+"""A4A23E78779C9FBF_ACFF71E6540F27A1_6039_UN""","""CC(C)(OCC(NC1=CC=C(C(N(C)C)=O)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""95660D2DB81B6B25_05725D18E2869A04_6039_UN""","""CC(C)(OCC(NCC(N(C)C)C1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""649565DBF02D15E7_6B7A68638CA05F1A_6039_UN""","""CC(C)(OCC(C1=C([NH]C(=C1C(OCC)=O)C)C)=O)C#N""",21,"""41575F74219DC187"""
+"""F691EF0D9F4F8986_D70234A551DC1CB2_6039_UN""","""CC(C)(OCC(N(C1=CC=C(C)C=C1)CCC#N)=O)C#N""",21,"""41575F74219DC187"""
+"""7ED3087FC710E08A_5755DEF5F3DDE731_6039_UN""","""CC(C)(OCC2=NN=C(C1=CC=C([N](=O)=O)C=C1)O2)C#N""",21,"""41575F74219DC187"""
+"""EDCC8E2D265D8914_83326B7082235DF4_6039_UN""","""CC(C)(OCC(NC1=C(C(OC)=O)C(=C(S1)C)C)=O)C#N""",21,"""41575F74219DC187"""
+"""5A7A62D563294A93_9EC51154A6D8AF0C_6039_UN""","""CC(C)(OCC2=NN=C(C1=CC=CC(=C1)[N](=O)=O)O2)C#N""",21,"""41575F74219DC187"""
+"""2C48D3A788F11ED8_6C8E43A5440A15FC_6039_UN""","""CC(C)(OCC(C1=CC=C(CCCCCC)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""0021C8C749DF4C9E_3D26EFC59B6E4F5E_6039_UN""","""CC(C)(OCC1=C(C(OCC)=O)OC2=C1C=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""DC2FEBEF30F04576_B12C949BF1CEFF16_6039_UN""","""CC(C)(OCC2=NC1=C(C=CC(=C1)C(O)=O)C(=O)N2)C#N""",21,"""41575F74219DC187"""
+"""D901A90624D5E169_B0FD18B0FF15197F_6039_UN""","""CC(C)(OCC(NC1=CC=CC(=C1)C(NCC)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""ECEFDE6CDF1278A4_D376EE09005560F0_6039_UN""","""CC(C)(OCCOC1=CC=C([S](N(C)C)(=O)=O)C=C1)C#N""",21,"""41575F74219DC187"""
+"""FFE71CAE32EBBE4D_E4F6198B4E4C0F7C_6039_UN""","""CC(C)(OCC3=C1C=CC=CC1=C2C=CC=CC2=N3)C#N""",21,"""41575F74219DC187"""
+"""4A267DCDE42E3ADB_10527106378FC22D_6039_UN""","""CC(C)(OCC(NC(C)C2=CC1=C(C=CC=C1)O2)=O)C#N""",21,"""41575F74219DC187"""
+"""8C06ACFDF827FBE4_1EC5BB32C782848C_6039_UN""","""CC(C)(OCC1=CSC(=N1)COC2=CC=C(F)C=C2)C#N""",21,"""41575F74219DC187"""
+"""F1AFC9E12CA2CFE8_14974423EF88F245_6039_UN""","""CC(C)(OCC(N(C)C1CCCC2=C1C=CC=C2)=O)C#N""",21,"""41575F74219DC187"""
+"""C8C9700FC03539E2_8F46CF8FFD0446C8_6039_UN""","""CC(C)(OCC(=O)N1CCN(CC1)CC2=CC=CS2)C#N""",21,"""41575F74219DC187"""
+"""31EDA64F3C4A5AC2_85D29AC63F650F4F_6039_UN""","""CC(C)(OCC1=CSC(=N1)C2=CC=C(OCC)C=C2)C#N""",21,"""41575F74219DC187"""
+"""A55D9586832D1E81_39589AEABA333E41_6039_UN""","""CC(C)(OCC(C1=C(C)[N](C(=C1)C)C2=NC=N[NH]2)=O)C#N""",21,"""41575F74219DC187"""
+"""E5489352B2F17934_60B0E66BDB0B098D_6039_UN""","""CC(C)(OCC(NC(NC1CCCC(C)C1C)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""EEAB2821B4F26D3A_AC3B636561114CC7_6039_UN""","""CC(C)(OCC(NC(NC1=CC=C(OC)C=C1)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""75AA5482EFA7CBA4_4CB663EF157B78A5_6039_UN""","""CC(C)(OCC(NC(C1=CC=C(C(C)C)C=C1)C)=O)C#N""",21,"""41575F74219DC187"""
+"""5F9FCBE58D79CD2C_F720E75027EE7E03_6039_UN""","""CC(C)(OCC(C1=C(C)[N](C(=C1)C)C2=NOC=C2)=O)C#N""",21,"""41575F74219DC187"""
+"""DF4903EA5E678C63_87EDF6FFB3F36842_6039_UN""","""CC(C)(OCC(NN=C2C1(CCC(C1(C)C)C2)C)=O)C#N""",21,"""41575F74219DC187"""
+"""616C158CCE4EBB2D_E7B0727809C2C06C_6039_UN""","""CC(C)(OCC2=NC1=C(C(=C(C(C)=O)S1)C)C(N2)=O)C#N""",21,"""41575F74219DC187"""
+"""B832730BA97E4924_D72AC5F3ED802796_6039_UN""","""CC(C)(OCC(N(CC(C)C)C1CC[S](=O)(=O)C1)=O)C#N""",21,"""41575F74219DC187"""
+"""562D94C73C88EFF4_F21868BEEE9DD6A8_6039_UN""","""CC(C)(OCC(N(CC1=CC=C(OCC)C=C1)C)=O)C#N""",21,"""41575F74219DC187"""
+"""FD47504B010E0802_B852EA6F67569E30_6039_UN""","""CC(C)(OCCC(=O)NC(=O)NCC1=CC=CC=C1)C#N""",21,"""41575F74219DC187"""
+"""4BAF9FF8AE680E59_33921FE197D58ECE_6039_UN""","""CC(C)(OCC(N(CC1=CC(=C(OC)C=C1)F)C)=O)C#N""",21,"""41575F74219DC187"""
+"""AA2F63F31595F0E3_9C277889077F46F6_6039_UN""","""CC(C)(OCC1=C(C(=N[N]1C2=CC=CC=C2)C)C#N)C#N""",21,"""41575F74219DC187"""
+"""6CA7D3C12AC4686F_B22676FA9C6F28A4_6039_UN""","""CC(C)(OCC(=O)NCCCOCC1=CC=CC=C1)C#N""",21,"""41575F74219DC187"""
+"""87C4B755AFD7C9E8_CBF7C11CCE95B2D5_6039_UN""","""CC(C)(OCC(=O)C1=CC=C(C=C1)N2CCCC2=O)C#N""",21,"""41575F74219DC187"""
+"""A616656AE0DDDEE7_BEF4D9AEFDA29AB4_6039_UN""","""CC(C)(OCC(N1CCN(C(C(C)C)C#N)CC1)=O)C#N""",21,"""41575F74219DC187"""
+"""1BDAF47D15143E0C_CB3ABDD36E7BC641_6039_UN""","""CC(C)(OCC(C1=CC(=C(C=C1)OC(F)F)OC)=O)C#N""",21,"""41575F74219DC187"""
+"""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"""
+"""E2528600C23B40AC_14795EFE3028D8DA_6039_UN""","""CC(C)(OCC1=C(C(OC)=O)SC2=C1C(=CC=C2)F)C#N""",21,"""41575F74219DC187"""
+"""A3C2051871E9737A_4D7DC31564A1DAF8_6039_UN""","""CC(C)(OCC(=O)NCC1(CCC1)C2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""D85CCB5299B080F9_EA09E6392D0C17D6_6039_UN""","""CC(C)(OCC(NC1=C(C=CC(=C1C)C)[N](=O)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""0F35E6C714FE4E1C_6796DB69CED5DFC3_6039_UN""","""CC(C)(OCC(N(C1=CC=C(F)C=C1)CCC#N)=O)C#N""",21,"""41575F74219DC187"""
+"""59669C0C728401CC_3C10D7B5E229648F_6039_UN""","""CC(C)(OCCC(=O)NC1=C(C2=C(S1)CCC2)C#N)C#N""",21,"""41575F74219DC187"""
+"""80AB978014783CC1_6D48B06D9E15A4C5_6039_UN""","""CC(C)(OCCC(=O)NC1=CC=N[N]1C2CCCC2)C#N""",21,"""41575F74219DC187"""
+"""2D5FEA4EAA08C203_4FA6F0DC2A22C93C_6039_UN""","""CC(C)(OCCC(NC1=CC=CC(=C1C)[N](=O)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""6437F545EFB32EB4_6FB5720E9B4161C8_6039_UN""","""CC(C)(OCC(N(CCOC)C1CC[S](=O)(=O)C1)=O)C#N""",21,"""41575F74219DC187"""
+"""B7AC0EE231ED977A_D2017CE63EA711F5_6039_UN""","""CC(C)(OCC(C1=C(C(=C(C)[NH]1)C(OCC)=O)C)=O)C#N""",21,"""41575F74219DC187"""
+"""8F59F91F81256331_5B4F7FE6F8B03916_6039_UN""","""CC(C)(OCC2=NC1=C(C=CC(=C1)[S](CC)(=O)=O)O2)C#N""",21,"""41575F74219DC187"""
+"""F6B3EC82DCB80526_59A563F3BC93F76E_6039_UN""","""CC(C)(OCC(=O)NCCC2=NC1=C(C=CC=C1)S2)C#N""",21,"""41575F74219DC187"""
+"""D454D6F694DFDAAF_48ED3BD219787971_6039_UN""","""CC(C)(OCC(N(CC)C2=NC1=C(C=CC=C1)S2)=O)C#N""",21,"""41575F74219DC187"""
+"""FF74808815402C41_DE9D52520858F4BB_6039_UN""","""CC(C)(OCC(C1=CC=C(C(C)NC(=O)C)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""C56E3D7C86E1D363_995FD333DD5EBDCD_6039_UN""","""CC(C)(OCC1=NC(=NO1)COC2=CC=C(F)C=C2)C#N""",21,"""41575F74219DC187"""
+"""D0D78BA27029480F_6D12254F34D355E4_6039_UN""","""CC(C)(OCC(N1CCN(CC(N(C)C)=O)CC1)=O)C#N""",21,"""41575F74219DC187"""
+"""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"""
+"""385F67FC70640E54_B66C5A98844F8CCB_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC=C([N](=O)=O)C=C2)C#N""",21,"""41575F74219DC187"""
+"""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"""
+"""E57FC756B7D7412D_DE584CA022EE9A12_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=C(OCC)C=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""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"""
+"""47DDEF4ECCAF3918_9C8CEDA4947DF988_6039_UN""","""CC(C)(OCC(NC(NC1=CC(=C(C)C=C1)C)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""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"""
+"""8DE5A0C4B9E1E9B9_3C82B12DB4EF057B_6039_UN""","""CC(C)(OCC(C1=C(C)[N](C(=C1)C)CC(F)(F)F)=O)C#N""",21,"""41575F74219DC187"""
+"""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"""
+"""2ED7739F8BFF8FAA_6A22EE2288B9EA3F_6039_UN""","""CC(C)(OCC(C1=CC=C(NC(C(C)C)=O)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""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"""
+"""0369989FFC165747_B6AD0C187618BA4B_6039_UN""","""CC(C)(OCC(NCC1=CC=C(OCCC)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""AC1307A4A6D21ECD_BE839B7D48D4DC92_6039_UN""","""CC(C)(OCC(NCC1=CC=CC(=C1)OC(C)C)=O)C#N""",21,"""41575F74219DC187"""
+"""F4FDF5CC0F4A66CB_5A07CFA8EFB3FF2D_6039_UN""","""CC(C)(OCC(NC(C)CC1=C(C=CC=C1F)F)=O)C#N""",21,"""41575F74219DC187"""
+"""B2556AB4C90BB59D_8A462D7A60074BFF_6039_UN""","""CC(C)(OCC(NCCCOC1=C(F)C=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""11F920426BC0212A_953254788F0C7B72_6039_UN""","""CC(C)(OCC(N(C)CCCOC1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""28EC7D117BBFAE0F_2268CA2BB22D61F0_6039_UN""","""CC(C)(OCC(N(CC)C(C)C1=CC=C(C=C1)F)=O)C#N""",21,"""41575F74219DC187"""
+"""FD30300E966CA27A_5FC50293CA6DDCD4_6039_UN""","""CC(C)(OCC(N(C)CC1=C(C=CC(=C1)C#N)F)=O)C#N""",21,"""41575F74219DC187"""
+"""7DDA77E666C00415_9692DD153449391D_6039_UN""","""CC(C)(OCC(NCCOC1=CC=CC(=C1)OC)=O)C#N""",21,"""41575F74219DC187"""
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+"""56EDF0A5D22E12B1_4B3815C7D997F581_6039_UN""","""CC(C)(OCC(NC(C(NC)=O)C1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""FE43F87ABD842068_F42D74EB4C8D07A3_6039_UN""","""CC(C)(OCC(C2=C(F)C=C1NC(CCC1=C2)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""FADFACF8648793DE_3160CA9247C655E2_6039_UN""","""CC(C)(OCC(NCCCN1CC(OC(C)C1)C)=O)C#N""",21,"""41575F74219DC187"""
+"""C3FEB5990970A03F_5D987DB646540B50_6039_UN""","""CC(C)(OCC1=CSC(=N1)C2=CC=C(C(N)=O)C=C2)C#N""",21,"""41575F74219DC187"""
+"""8E60CEA0822D17E7_33927FFA4DA6025F_6039_UN""","""CC(C)(OCC1=CC=C(C=C1)OCC2=CC=NC=C2)C#N""",21,"""41575F74219DC187"""
+"""36253F8EC3444C9B_54AA0A3BC456E34D_6039_UN""","""CC(C)(OCC1=CC=C(C=C1)OCC2=NC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""79F6EDADD6898D4A_76E9EC6268CAA642_6039_UN""","""CC(C)(OCC(=O)N1CCN(CC1)C2=NC=CN=C2)C#N""",21,"""41575F74219DC187"""
+"""8937A626AABB04EB_29FF362AFB40EAA0_6039_UN""","""CC(C)(OCCCCOC1=C(C(F)(F)F)C=CC=C1)C#N""",21,"""41575F74219DC187"""
+"""5EC3D1BF17E3FDC5_CC298C74A547CE98_6039_UN""","""CC(C)(OCC1=CC2=C(C=C1)OC(=C2)C(OCC)=O)C#N""",21,"""41575F74219DC187"""
+"""FFA5460A767DED51_3E12D1EB62B1F9F7_6039_UN""","""CC(C)(OCC(C2=CC1=C(OC(C)C(N1)=O)C=C2)=O)C#N""",21,"""41575F74219DC187"""
+"""84070605EB87415B_08602FB7BD0FEFEC_6039_UN""","""CC(C)(OCC1=CC=C(C=C1)OCC2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""883F555E0CB2666D_886315CBCDEBFCA1_6039_UN""","""CC(C)(OCC(=O)NC1=NC(=CS1)CN2CCCC2)C#N""",21,"""41575F74219DC187"""
+"""53F217A0B5C26067_521308D843F1D4F2_6039_UN""","""CC(C)(OCC1=C(OC(C)C)C=CC2=C1C=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""45461358C88D3C08_E73C26ADC46628DE_6039_UN""","""CC(C)(OCC(OC1=C(C(=C(F)C(=C1F)F)F)F)=O)C#N""",21,"""41575F74219DC187"""
+"""DEA0DB36AE4B69E7_B7922FBDEFA05B9E_6039_UN""","""CC(C)(OCC(=O)NNC(=O)C1=CC(=CC=C1)C#N)C#N""",21,"""41575F74219DC187"""
+"""3DB28E18049E800E_C4E5F720AEB82275_6039_UN""","""CC(C)(OCC(=O)NNC(=O)C1=CC=C(C=C1)C#N)C#N""",21,"""41575F74219DC187"""
+"""E5A687ED06FC706B_FAC66AA86BAE4747_6039_UN""","""CC(C)(OCC(=O)NC(=O)NC1=CC(=CC=C1)C#C)C#N""",21,"""41575F74219DC187"""
+"""C86D154FDFA38849_0172302EC31D5DB0_6039_UN""","""CC(C)(OCC(=O)NC1=CC2=C(C=C1)OCC(=O)N2)C#N""",21,"""41575F74219DC187"""
+"""3AAC4B93F5FB15CD_690DA4CB4867847F_6039_UN""","""CC(C)(OCC(NC1=C(C)C=CC(=C1)[S](=O)(=O)N)=O)C#N""",21,"""41575F74219DC187"""
+"""577115551B027EE9_C6BEE91CBCB572A5_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC(=C(C(=C2)F)F)F)C#N""",21,"""41575F74219DC187"""
+"""C0CC7499E1FEBEBE_9EE99187F1E638E6_6039_UN""","""CC(C)(OCC(=O)CN2C(=O)C1=C(C=CC=C1)C2=O)C#N""",21,"""41575F74219DC187"""
+"""D7AC0329706F632D_5C2CC0ADBFC32D40_6039_UN""","""CC(C)(OCC1=CC(=C(C=C1)OC2=CC=CC=C2)F)C#N""",21,"""41575F74219DC187"""
+"""6FA92B272B870AAB_6C4AE3B6DB419F14_6039_UN""","""CC(C)(OCC(NNC(CC1=C(C)C=CC=C1)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""46ECAA15B2377E03_E3E92703FCCEAA60_6039_UN""","""CC(C)(OCCC(NC1=CC=CC(=C1)C(F)(F)F)=O)C#N""",21,"""41575F74219DC187"""
+"""7500AF20AE6E8D4B_BD98D61AB8239E37_6039_UN""","""CC(C)(OCC1=CC=C(C=C1)C(=O)C2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""A005B6E377BEBC22_730546C8863D957F_6039_UN""","""CC(C)(OCC(C2=CC1=C(NC(C1(C)C)=O)C=C2)=O)C#N""",21,"""41575F74219DC187"""
+"""A787F0EEA13A5564_D99FD5B203C188C1_6039_UN""","""CC(C)(OCC(NC1=C(C(N)=O)C2=C(S1)CCC2)=O)C#N""",21,"""41575F74219DC187"""
+"""578EDBCB9603F346_672FA061DB79F32F_6039_UN""","""CC(C)(OCC(NC(NC1=C(C=C(C)C=C1)C)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""D817F50A4F3315EA_FB36756661ECA625_6039_UN""","""CC(C)(OCC(=O)C1=CC=C(C=C1)C2CCCCC2)C#N""",21,"""41575F74219DC187"""
+"""63E4BE524DDDA979_E2EC4F2362277478_6039_UN""","""CC(C)(OCC(N1CCC(C)SC2=C1C=CC=C2)=O)C#N""",21,"""41575F74219DC187"""
+"""ADB883C596822CDD_45951A7170324785_6039_UN""","""CC(C)(OCC(C1=CC(=C(SC)C=C1)NC(=O)C)=O)C#N""",21,"""41575F74219DC187"""
+"""B26E3795F0CF17C3_E3C5C8C99F4C856B_6039_UN""","""CC(C)(OCC(N(CC1=C(F)C=CC=C1)C2CC2)=O)C#N""",21,"""41575F74219DC187"""
+"""069B4488AC0C4690_2FBC88E51915FD96_6039_UN""","""CC(C)(OCC(N(C(CC)C)C1CC[S](=O)(=O)C1)=O)C#N""",21,"""41575F74219DC187"""
+"""99B84A79EBB8FE39_A134802C0C049E4C_6039_UN""","""CC(C)(OCC(C1=CC=C(N(C)[S](=O)(=O)C)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""1BE78C2E0CB0EFAA_A1DDB79BAE726BF2_6039_UN""","""CC(C)(OCC(C)=C(C#N)C2=NC1=C(C=CC=C1)S2)C#N""",21,"""41575F74219DC187"""
+"""276612B6B1E8A69D_3A605F479E3B9942_6039_UN""","""CC(C)(OCC(C1=C[N](C)C(=C1)C(=O)C(Cl)(Cl)Cl)=O)C#N""",21,"""41575F74219DC187"""
+"""9FCD820A0E314B29_FA455043B277A358_6039_UN""","""CC(C)(OCC(NC1=CC(=C(C(OCC)=O)S1)C)=O)C#N""",21,"""41575F74219DC187"""
+"""3B8A1701E3F4291F_C93D93C8C9AC07EA_6039_UN""","""CC(C)(OCC3=NC1=C(C2=C(S1)CCCC2)C(=O)N3)C#N""",21,"""41575F74219DC187"""
+"""856C3D3C29219C40_F92D9F66BFA504DD_6039_UN""","""CC(C)(OCC1=C(C(OCC)=O)C2=C(O1)C=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""F0536D3D555A84FE_EAFC02A0E4B6FC5A_6039_UN""","""CC(C)(OCC(NC1=C(C(OCC)=O)C=N[N]1C)=O)C#N""",21,"""41575F74219DC187"""
+"""EFA5BF563FC444FA_D79FB12CC9905A65_6039_UN""","""CC(C)(OCC(=O)N1CCN(CC1)CC2=CSC=C2)C#N""",21,"""41575F74219DC187"""
+"""B15E4F499F10F5CE_5988BDB1A702F16D_6039_UN""","""CC(C)(OCC(=O)N1CCN(CC1)CC2=CC=CO2)C#N""",21,"""41575F74219DC187"""
+"""DF3076D9DE86161C_C02E9D4F2607D4FD_6039_UN""","""CC(C)(OCC(C2=CC1=C(N(C)C(=O)CC1)C=C2)=O)C#N""",21,"""41575F74219DC187"""
+"""3A60321DC1BDEE31_A04CF359920C2102_6039_UN""","""CC(C)(OCC(NC2=NN=C(C1=C(C)C=CS1)O2)=O)C#N""",21,"""41575F74219DC187"""
+"""B7B2EDDDDE6027BF_3322AE93FF0F8901_6039_UN""","""CC(C)(OCC(NC1=C(C)C=C(C=C1C)SC#N)=O)C#N""",21,"""41575F74219DC187"""
+"""8D5FD56E9843163E_AD53C1D2A7FDECC0_6039_UN""","""CC(C)(OCC(N1CCC2=C1C=C([N](=O)=O)C=C2)=O)C#N""",21,"""41575F74219DC187"""
+"""23C0D2A1A073B59F_5A206AD4D4C5C9AF_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC=C(C(C)C)C=C2)C#N""",21,"""41575F74219DC187"""
+"""969DBEA160DB70F4_2E6F2E3BB59642BC_6039_UN""","""CC(C)(OCC(NCC1=CC=C(CN(C)C)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""49250F5E4901E673_AB7200492AEB244F_6039_UN""","""CC(C)(OCCCC(NC1=C(C=C(C)C=C1C)C)=O)C#N""",21,"""41575F74219DC187"""
+"""BF8FC8606863E147_0B4F0D16CFFD73FD_6039_UN""","""CC(C)(OCC(NCCOC1=C(C)C=CC=C1C)=O)C#N""",21,"""41575F74219DC187"""
+"""1EA104641EAF29EE_7259BA0F9243C8A2_6039_UN""","""CC(C)(OCC(NCCCOC1=CC=CC(=C1)C)=O)C#N""",21,"""41575F74219DC187"""
+"""60DADE272BEE630A_DC5EA09688D0EDEB_6039_UN""","""CC(C)(OCC(N2C1=C(C=C(OC)C=C1)CCC2)=O)C#N""",21,"""41575F74219DC187"""
+"""F2BC8BD5E806FEC8_266CD996BBD63CC2_6039_UN""","""CC(C)(OCC(N2C1=C(C=C([N](=O)=O)C=C1)CC2)=O)C#N""",21,"""41575F74219DC187"""
+"""53691BF8A4E0CB9D_5D1F5AA3389C1468_6039_UN""","""CC(C)(OCC(NC(C(C)C)C1=CC=C(C=C1)F)=O)C#N""",21,"""41575F74219DC187"""
+"""E2F63F6A140571BD_AE96574268BF69E4_6039_UN""","""CC(C)(OCC(=O)N1CCN(CC1)C2=NC=CC=N2)C#N""",21,"""41575F74219DC187"""
+"""AD02588BF8186C8A_6E84FDB9DDF686C2_6039_UN""","""CC(C)(OCC(NC(C1=CC=CC(=C1)[N](=O)=O)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""A73ACF77355CBCB4_36642B234CAE4C81_6039_UN""","""CC(C)(OCC1=COC(=N1)C2=CC=C(OCC)C=C2)C#N""",21,"""41575F74219DC187"""
+"""8C6D4C1E363F0B75_F13FAC81AA825D4A_6039_UN""","""CC(C)(OCC(NNC(C1=CC(=C(CC)S1)C)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""D98CD2481CE7F2F7_BAC36C16EDC1A5A5_6039_UN""","""CC(C)(OCC(NCC1OCCN(CC(C)C)C1)=O)C#N""",21,"""41575F74219DC187"""
+"""3CAB8729909369B0_A44A083777C21BAC_6039_UN""","""CC(C)(OCC(NCC1=CC=C([S](N)(=O)=O)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""B86D5E8EFBEF1478_4C4CD3DE016A60C6_6039_UN""","""CC(C)(OCC(NCCCN(C)C1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""DFECE2F8874717F2_958A714429D9A6E4_6039_UN""","""CC(C)(OCC(NC2=NC1=C(OC)C=CC=C1S2)=O)C#N""",21,"""41575F74219DC187"""
+"""9A86D4D0562C11A7_17DB2E1189F3FA18_6039_UN""","""CC(C)(OCC(N(CC1=CC=C(N(C)C)C=C1)C)=O)C#N""",21,"""41575F74219DC187"""
+"""2F4C30ACF9E1420E_4179BBECC14C1B2D_6039_UN""","""CC(C)(OCC(C2=C[N](C1=CC=CC(=C1)C)N=N2)=O)C#N""",21,"""41575F74219DC187"""
+"""A0D9FE7E71342DB6_8DE7B89F8E8C39FE_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC(=C(C=C2)C)OC)C#N""",21,"""41575F74219DC187"""
+"""4839DBD1AADF3A00_217C6E2F1F8494DD_6039_UN""","""CC(C)(OCC2C[N]1C(=NN=C1S2)C3=CN=CC=C3)C#N""",21,"""41575F74219DC187"""
+"""A103826E2768A70D_6F9CB9370E44CFB4_6039_UN""","""CC(C)(OCC1=CC(=CC(=C1)C(=O)OC)C(OC)=O)C#N""",21,"""41575F74219DC187"""
+"""86C9613DE572DAE2_715026DB61456EF9_6039_UN""","""CC(C)(OCC(C2=CC1=C(CCN(C(C)=O)C1)S2)=O)C#N""",21,"""41575F74219DC187"""
+"""5A0721E3D668FA40_BA035640C08B6A6D_6039_UN""","""CC(C)(OCC1=CN=C(C=C1)OCC2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""4F8E0BBF1DBA64BF_01FDFCFB19802F65_6039_UN""","""CC(C)(OCC(NC1=CC=C(OC(F)(F)F)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""980A44E3AFB94A58_48155D792E0F9D07_6039_UN""","""CC(C)(OCCCCOC1=CC=CC(=C1)C(OC)=O)C#N""",21,"""41575F74219DC187"""
+"""2931D80D5E4F0FB2_2F7AF42A41534C2B_6039_UN""","""CC(C)(OCCCCN2C(=O)C1=C(C=CC=C1)C2=O)C#N""",21,"""41575F74219DC187"""
+"""3EA8D71F652E05B5_66CC1683A07483AC_6039_UN""","""CC(C)(OCCCCOC1=CC=C(C(OC)=O)C=C1)C#N""",21,"""41575F74219DC187"""
+"""4BEE6095AA8C4A84_96A3282842AFE61B_6039_UN""","""CC(C)(OCC(NC1=NC(=CS1)CC(OCC)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""DF81BA480F19AF1B_5956AC6356797BC9_6039_UN""","""CC(C)(OCC1=C(C=CC=C1)SCC2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""8B11E581C61452F0_2855E7C61D76B4F3_6039_UN""","""CC(C)(OCC(NC1=CC=C(C(OCC)=O)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""F56CECB7880FE63B_466D7A261F9A20B1_6039_UN""","""CC(C)(OCC1=C[N](C)N=C1C2=CC=C(C=C2)C#N)C#N""",21,"""41575F74219DC187"""
+"""610AC4A7CC9A22BC_6FA91B7933251CFE_6039_UN""","""CC(C)(OCC2C[N]1C(=NN=C1S2)C3=CC=CC=C3)C#N""",21,"""41575F74219DC187"""
+"""53D3897AEAD37430_B3BAC29ADB1BCF77_6039_UN""","""CC(C)(OCC2C[N]1C(=NN=C1S2)C3=CC=NC=C3)C#N""",21,"""41575F74219DC187"""
+"""CEE753C28D767D8A_138135544E874A2B_6039_UN""","""CC(C)(OCC1=CC=C(OCCOCCOC)C=C1)C#N""",21,"""41575F74219DC187"""
+"""304E6450C7403E12_913B21554D93E82A_6039_UN""","""CC(C)(OCC(C1=CC2=C(C=C1)NC(N(C)C2)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""66CA5FC8EC6A126D_CDDE1BC15D01F049_6039_UN""","""CC(C)(OCC2CN(CC1=CC=CC=C1)CCCO2)C#N""",21,"""41575F74219DC187"""
+"""965C10F2413BCAB3_FFA27A5C3B86A437_6039_UN""","""CC(C)(OCCCN1CCN(CC1)C2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""D186C97E708A7C19_F8D33880499BC600_6039_UN""","""CC(C)(OCCCCOC1=C(OC)C=CC=C1OC)C#N""",21,"""41575F74219DC187"""
+"""20D96BBF5D2C9897_A569D734273D257D_6039_UN""","""CC(C)(OCC(NCC(C(C)C)C1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""06D6B70484B3A00F_F52B43DFEC3A9759_6039_UN""","""CC(C)(OCC(=O)NC1=C(C2=C(S1)CCCC2)C#N)C#N""",21,"""41575F74219DC187"""
+"""C6787327AC9CAD8E_C4A88503146423AB_6039_UN""","""CC(C)(OCCCC(NC1=CC=CC(=C1)[N](=O)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""F45A6E848D396785_625FF67853119D3E_6039_UN""","""CC(C)(OCCC(=O)NC2=C1C=CC=CC1=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""BF907D97E22299C8_6818C686BA776F98_6039_UN""","""CC(C)(OCC(NCCC1=CC=C(C(C)C)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""C0FB951F6AB69443_FACB3CCCC44F9666_6039_UN""","""CC(C)(OCC(=O)NC1=CC=N[N]1CC2=CC=CS2)C#N""",21,"""41575F74219DC187"""
+"""5B3236F348263458_44E77EBD080D641E_6039_UN""","""CC(C)(OCC(=O)NC1=NN=C(O1)C2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""8EA24382CB36A79B_F34EF5579645B520_6039_UN""","""CC(C)(OCC(N(C1=C(F)C=CC=C1)CCC#N)=O)C#N""",21,"""41575F74219DC187"""
+"""DB991C0A3128E4FB_8B685E9CBB52BC14_6039_UN""","""CC(C)(OCC2=NC1=C(C=CC=C1)C(=O)N2CC#N)C#N""",21,"""41575F74219DC187"""
+"""344C8D4174DC4EE3_2F03FA795F63F190_6039_UN""","""CC(C)(OCCCC2=NC(C1=C(SC(=C1C)C)N2)=O)C#N""",21,"""41575F74219DC187"""
+"""D45ED5987E6F3B37_C099B52C614ED83E_6039_UN""","""CC(C)(OCC2=CC=C(N1CCC(OC)CC1)C=C2)C#N""",21,"""41575F74219DC187"""
+"""06AB5D224DA14C3A_0ED414983B8F398E_6039_UN""","""CC(C)(OCC(NNC(C1=CC(=C(S1)C)CC)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""039E462CC21A1C89_42D95FEBFBF5CA5F_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC3=C(C=C2)OCO3)C#N""",21,"""41575F74219DC187"""
+"""7473ADBCED55CBF4_3E20231860DAE165_6039_UN""","""CC(C)(OCC(C2=CC1=C(C=C(OC)C=C1)C=C2)=O)C#N""",21,"""41575F74219DC187"""
+"""7F18000BD52217AE_E15A8123D448B511_6039_UN""","""CC(C)(OCC(C2=C1OCC(C1=C(OC)C=C2)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""439012282A6ACE28_F443B382301C319F_6039_UN""","""CC(C)(OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""A3553EACFA05D9C3_BDC77C2D62C871B9_6039_UN""","""CC(C)(OCC(=O)NC1=C(C=NO1)C2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""4528B0F27CEF8C6E_63440511265A1B37_6039_UN""","""CC(C)(OCCCON2C(=O)C1=C(C=CC=C1)C2=O)C#N""",21,"""41575F74219DC187"""
+"""952D7F19D4DBB5BD_04ED8C68F58D91AE_6039_UN""","""CC(C)(OCC(C1=CC=C([S](N(C)C)(=O)=O)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""AB74A752D5431640_6562B205D569EF7D_6039_UN""","""CC(C)(OCC1=CC(=CN=C1)OCC2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""43FC183A5F7EE47A_CDF31579DB9B24BA_6039_UN""","""CC(C)(OCC1=COC(=N1)C2=CC=C([N](=O)=O)C=C2)C#N""",21,"""41575F74219DC187"""
+"""8214AFED5F5E89D2_8E2171F489C6CE34_6039_UN""","""CC(C)(OCC(NC(C(C)=O)CC1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""89C96399DCB9A6E7_40C7D7871CBE0817_6039_UN""","""CC(C)(OCC3=NC1=C(OC2=C1C=CC=C2)C(=O)N3)C#N""",21,"""41575F74219DC187"""
+"""235FDE1C6C987F8C_68DEB6A68E59CB1B_6039_UN""","""CC(C)(OCC(=O)NNC(=O)CC1CC[S](=O)(=O)C1)C#N""",21,"""41575F74219DC187"""
+"""F1C77A22A73B94BF_D611B67C139F9EC9_6039_UN""","""CC(C)(OCC1=CSC(=N1)C2=CC=C(C(O)=O)C=C2)C#N""",21,"""41575F74219DC187"""
+"""19BCB25952CEE294_24FE114D1D9015AA_6039_UN""","""CC(C)(OCCC(=O)NC1=CC2=C(C=C1)OCCO2)C#N""",21,"""41575F74219DC187"""
+"""116368032AE127C3_67F399E8352EF877_6039_UN""","""CC(C)(OCC2=NN=C3N(C)C(=O)C1=C(C=CS1)[N]23)C#N""",21,"""41575F74219DC187"""
+"""6F420094CE475F77_D008A9BB4D243B75_6039_UN""","""CC(C)(OCCC(NC1=C(C)C=CC(=C1)[N](=O)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""78A049E331C76205_17AB905CC18982B3_6039_UN""","""CC(C)(OCC2=CC=C(OCC1=NC=C[N]1C)C=C2)C#N""",21,"""41575F74219DC187"""
+"""7965F5140D39789F_1995E0C86BD8FD1F_6039_UN""","""CC(C)(OCC(NC(C1=CC=C(C)C=C1)C2CC2)=O)C#N""",21,"""41575F74219DC187"""
+"""088C416EC390631F_C1CF0A868EACEDE5_6039_UN""","""CC(C)(OCC(NC1=CC=CC(=C1)C(N(C)C)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""3E887B1F06C376CA_E29EC9D716D3F049_6039_UN""","""CC(C)(OCC(N(C)CCOC1=C(C=CC=C1)F)=O)C#N""",21,"""41575F74219DC187"""
+"""0B2E0473B4E3D34A_5ADB862A3DFDEB3F_6039_UN""","""CC(C)(OCC(=O)NC1=C(N=CC=C1)N2CCCC2)C#N""",21,"""41575F74219DC187"""
+"""F618A05DE91EA1F6_1AA7A9D4B22179B5_6039_UN""","""CC(C)(OCC(C1(NC(C(F)(F)F)=O)CCCC1)=O)C#N""",21,"""41575F74219DC187"""
+"""184895519FC32821_D298C762D0012327_6039_UN""","""CC(C)(OCC(=O)NCCC1=C[NH]C2=C1C=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""30AF3AC9ACEE467D_C05836E29D862E04_6039_UN""","""CC(C)(OCCC(N(CCCCC)CCCCC)=O)C#N""",21,"""41575F74219DC187"""
+"""E7EAFC69E38926CA_EC5060674FA7F061_6039_UN""","""CC(C)(OCC(=O)C1=CC=C(C=C1)N2CCOC2=O)C#N""",21,"""41575F74219DC187"""
+"""769DE5C0F23508AA_0D24123799784DAC_6039_UN""","""CC(C)(OCC(C2=C[N](C1=CC=C(F)C=C1)N=N2)=O)C#N""",21,"""41575F74219DC187"""
+"""8CC6759870BA239B_D5F198952B88BCE4_6039_DP""","""CC(C)(OCC(N[C@H](C(O)=O)CC1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""949FB52B730A8A25_062591660B11ADEB_6039_DP""","""CC(C)(OCC(N[C@@H](C(O)=O)CC1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""D3DA8917BCC23CB2_23FF67A20E49BDCD_6039_UN""","""CC(C)(OCC1=CC(=CC=C1)OCC2=NC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""28EED7A67D1C9EF2_4BB3572247F9D0F4_6039_UN""","""CC(C)(OCC1=C(C=CC=C1)OCC2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""498C760E0EDC3E3E_8AB2C725A906B606_6039_UN""","""CC(C)(OCC(C1CCN(C(C(F)(F)F)=O)CC1)=O)C#N""",21,"""41575F74219DC187"""
+"""1BAC9CA372778907_96A0C806E9411560_6039_UN""","""CC(C)(OCC#CCN2C(=O)C1=C(C=CC=C1)C2=O)C#N""",21,"""41575F74219DC187"""
+"""DB095F67F21BA25C_7FE3B97E94C8F970_6039_UN""","""CC(C)(OCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C#N""",21,"""41575F74219DC187"""
+"""9A00AE680AEB52C9_BD870F05810790BF_6039_UN""","""CC(C)(OCC1=C(C=C(C(OC)=O)C=C1)C(F)(F)F)C#N""",21,"""41575F74219DC187"""
+"""D1F7E6AE37AE53B8_07FB4D4E5841CB4E_6039_UN""","""CC(C)(OCC(=O)NC1=CC=C(C=C1)N2CCCC2)C#N""",21,"""41575F74219DC187"""
+"""0A960ED3165A205D_116126DC9BA258F4_6039_UN""","""CC(C)(OCC1=CSC(=N1)COC2=CC=C(C)C=C2)C#N""",21,"""41575F74219DC187"""
+"""24DFFCEDEF2D835E_9411328C2B06AEE2_6039_UN""","""CC(C)(OCC(N(C(C)(C)C)CC1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""0D0C4638AE3BE4CB_8ACAEC6EDD51B0A7_6039_UN""","""CC(C)(OCC(NCC1=CC(=C(OC)C=C1)OC)=O)C#N""",21,"""41575F74219DC187"""
+"""DE5ECB3614364D4C_E58D52332BFD5063_6039_UN""","""CC(C)(OCCCCCCCCCCCCCCC)C#N""",21,"""41575F74219DC187"""
+"""27510C47FB5B0E0F_3CE759682644DC42_6039_UN""","""CC(C)(OCC(=O)N1CCC(=CC1)C2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""BE15383250971E74_283741378056841A_6039_UN""","""CC(C)(OCC(NC1=C(C=CC(=C1)[S](C)(=O)=O)F)=O)C#N""",21,"""41575F74219DC187"""
+"""7705BDBF64650804_C6D39C4A5E501349_6039_UN""","""CC(C)(OCC(NC1=C(C=C([N](=O)=O)C=C1)C#N)=O)C#N""",21,"""41575F74219DC187"""
+"""B196474AFD129A84_19FC9F9E03EB6DA4_6039_UN""","""CC(C)(OCC(NC1=C(OC)C=C(C=C1)[N](=O)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""FD36790908D1D6DF_C09EE24D1321B2BB_6039_UN""","""CC(C)(OCC(NC1=C(C(OCC)=O)C=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""AB86F56C340C7B4F_89FBC71DA65871B4_6039_UN""","""CC(C)(OCC(C1=CC(=C(C(=C1)OC)OC)OC)=O)C#N""",21,"""41575F74219DC187"""
+"""01260FE0CD9B87EC_A714B5D96C3BB84F_6039_UN""","""CC(C)(OCC(N(CC(N(C)C)=O)CC(F)(F)F)=O)C#N""",21,"""41575F74219DC187"""
+"""F57C5F15823A633C_DB3DAEF814C4A367_6039_UN""","""CC(C)(OCCOC1=CC=C(C=CC(OC)=O)C=C1)C#N""",21,"""41575F74219DC187"""
+"""1C3066C4B455A7F3_A238B17DDBCAE349_6039_UN""","""CC(C)(OCC2=C1N=CC=CC1=C(C(OC)=O)C=C2)C#N""",21,"""41575F74219DC187"""
+"""B08C1E05786C7B68_E3A1EB5B6B6EE5C5_6039_UN""","""CC(C)(OCC1=C(C(OCC)=O)C(=CO1)C(F)(F)F)C#N""",21,"""41575F74219DC187"""
+"""243387E908F741A9_4BAA63A15BB5F912_6039_UN""","""CC(C)(OCC(C(C(OCC)=O)CCC(=O)OC)=O)C#N""",21,"""41575F74219DC187"""
+"""F8CA8C2E7131987D_4CE22D1B1A9C732D_6039_UN""","""CC(C)(OCC(NC(NC1=C(C=CC(=C1)C)C)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""A1DAE7FBBB5A303F_3D959F1C019580E2_6039_UN""","""CC(C)(OCCCOC1=CC(=C(C=C1C)CC=C)C)C#N""",21,"""41575F74219DC187"""
+"""6732595F6D34C45F_FE9401F3068E124C_6039_UN""","""CC(C)(OCC1=CSC(=N1)C3=CC2=C(C=CC=C2)O3)C#N""",21,"""41575F74219DC187"""
+"""661D87C720F094AC_E2DF961E0BBE761F_6039_UN""","""CC(C)(OCC(NNC(CC1=C(F)C=CC=C1)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""904472608BB5F650_3D6CF52BFAA6CFA4_6039_UN""","""CC(C)(OCC1=N[N](C2=C1CCC2)C3=CC=CC=C3)C#N""",21,"""41575F74219DC187"""
+"""E5E86E6672AA14EE_A3579A89A9595BEC_6039_UN""","""CC(C)(OCC(N(CCOC)CC1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""A4E1338CED71A055_9052BA7F2F9D1F74_6039_UN""","""CC(C)(OCC(NCCCN(C(C)C)[S](=O)(=O)C)=O)C#N""",21,"""41575F74219DC187"""
+"""E022F221BAD0523D_17B3923102E4733D_6039_UN""","""CC(C)(OCC(NC1=C(C(OCC)=O)C=C(S1)C)=O)C#N""",21,"""41575F74219DC187"""
+"""BBC499DDA3AD9CD1_3DC724D060B0D3A8_6039_UN""","""CC(C)(OCC(C1=CC(=C(C=C1)NC(=O)C)SC)=O)C#N""",21,"""41575F74219DC187"""
+"""97C331452BBA9D1B_5C89087A2D954D77_6039_UN""","""CC(C)(OCCC(NC1=CC=CC(=C1)[S](N)(=O)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""38844FA617268D61_5B47CA16FC89A9C7_6039_UN""","""CC(C)(OCC(NCC1=CC=C(OC(F)F)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""7373CD5BA23DC445_B2E1018F66076F69_6039_UN""","""CC(C)(OCC(NC1=C(C=CC(=C1)C(OC)=O)C)=O)C#N""",21,"""41575F74219DC187"""
+"""85331ECE6CC41D4A_C6DBA00358A7D245_6039_UN""","""CC(C)(OCC(N(CCC(N)=O)C1=CC=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""D9977458803A9741_DF8385F6BC35C4AA_6039_UN""","""CC(C)(OCCC(=O)NC1=CC2=C(C=C1)NC(=O)N2)C#N""",21,"""41575F74219DC187"""
+"""532F9FAD352E49D6_11814C4119442D17_6039_UN""","""CC(C)(OCC(C1=C(C)[N](C(=C1)C)C2=NC=CS2)=O)C#N""",21,"""41575F74219DC187"""
+"""03C9B16B3EA35DC8_39586B779BC3FF3B_6039_UN""","""CC(C)(OCC(=O)NC(=O)CCSC1=CC=CC=C1)C#N""",21,"""41575F74219DC187"""
+"""6AA2AF4B601714EA_696CFC7EFB688794_6039_UN""","""CC(C)(OCC(C1=C([NH]C(=C1C)C(OCC)=O)C)=O)C#N""",21,"""41575F74219DC187"""
+"""2E3F3B2587460B38_00C7401970E06339_6039_UN""","""CC(C)(OCCCCN(C(C)C)CC1=CC=CC=C1)C#N""",21,"""41575F74219DC187"""
+"""138E259256CB8197_BC8CACF66E921572_6039_UN""","""CC(C)(OCC(N(CCCC)C1CC[S](=O)(=O)C1)=O)C#N""",21,"""41575F74219DC187"""
+"""FF72F85A009C65AA_29F64D420ECCB022_6039_UN""","""CC(C)(OCCCCOC1=CC=CC(=C1)C(F)(F)F)C#N""",21,"""41575F74219DC187"""
+"""8469F2702CF7CCEA_BF70D7762CB50A01_6039_UN""","""CC(C)(OCC1=CC=C(C=C1)C2=C(C=CC=C2)C#N)C#N""",21,"""41575F74219DC187"""
+"""5D587ADF7F606BF0_F70586E031BC9547_6039_UN""","""CC(C)(OCCOC2=CC1=C(C(=CC(=O)O1)C)C=C2)C#N""",21,"""41575F74219DC187"""
+"""08956DD09CDE6784_B7EA54E6CB628C9F_6039_UN""","""CC(C)(OCC(N(C1=C(C(OC)=O)C=CC=C1)C)=O)C#N""",21,"""41575F74219DC187"""
+"""C4F73C36657DD1DF_E4ADE724123E7514_6039_UN""","""CC(C)(OCC(=O)NCC1CCCC2=C1C=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""E5E47B4C4417CBAA_1B844353BE703B5F_6039_UN""","""CC(C)(OCC(C1=CC=C(CCNC(C)=O)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""558DF4D0410B8617_EBCBA5C594BB8492_6039_UN""","""CC(C)(OCC1=CSC(=N1)C2=CC3=C(C=C2)OCO3)C#N""",21,"""41575F74219DC187"""
+"""C419F5F3EDC4E0FA_B7C4AB2860B3F7B2_6039_UN""","""CC(C)(OCC(C1=CC=C(CN(C)C(=O)C)C=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""4AB2FCA2282EA880_3F417900405B2498_6039_UN""","""CC(C)(OCC(NC1CCN(C(OCC)=O)CC1)=O)C#N""",21,"""41575F74219DC187"""
+"""84D4318F5B415202_0C42699624143BDC_6039_UN""","""CC(C)(OCC(C1=CC(=NO1)C2=CC=C(F)C=C2)=O)C#N""",21,"""41575F74219DC187"""
+"""40C3E3EC1C31189A_5E7D01471F3CCF6B_6039_UN""","""CC(C)(OCC2=NN=C(C1CC1)[N]2C3=CC=CC=C3)C#N""",21,"""41575F74219DC187"""
+"""4FF3CF555CBEFD0B_B97AF80399C994E0_6039_UN""","""CC(C)(OCC(C1=C([N](CC(OC)=O)C(=C1)C)C)=O)C#N""",21,"""41575F74219DC187"""
+"""62E6B2E4404F3273_23577E610B017CAA_6039_UN""","""CC(C)(OCCOC2=C1C=CC=CC1=C(OC)C=C2)C#N""",21,"""41575F74219DC187"""
+"""E6062B5C05F06600_B9D1078B60DD1377_6039_UN""","""CC(C)(OCC1=CC(=CC=C1)SCC2=CC=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""97C80B0954D65818_29A47EEDDF14BED4_6039_UN""","""CC(C)(OCC1=CC(=CC=C1)C(=O)N2CCCCC2)C#N""",21,"""41575F74219DC187"""
+"""12AEB6E106D7AA23_52BCB942C7ADF623_6039_UN""","""CC(C)(OCC(=O)NCCN1C2=C(CC1)C=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""03140932DF036FB7_4B6A26678DCF3609_6039_UN""","""CC(C)(OCC1CC(C(OCC)=O)(O1)C(=O)OCC)C#N""",21,"""41575F74219DC187"""
+"""44F94B7ACBF2A802_2FEBE41C2718BA01_6039_UN""","""CC(C)(OCC1=C(C)OC(=N1)C2=CC=C(CC)C=C2)C#N""",21,"""41575F74219DC187"""
+"""C693B5A6A79EDF7A_A8AAFCCD3A590EAC_6039_UN""","""CC(C)(OCCC[S](=O)(=O)C2=NC1=C(C=CC=C1)S2)C#N""",21,"""41575F74219DC187"""
+"""CA630D9E49A128AD_E83EA2D8D8ECA580_6039_UN""","""CC(C)(OCC1=CC(=CC2=C1C=CC=C2)C(OC)=O)C#N""",21,"""41575F74219DC187"""
+"""FADE34C387D0F0A2_F343466766F61431_6039_UN""","""CC(C)(OCC2=NC1=C(C=CC(=C1)C(OC)=O)[N]2C)C#N""",21,"""41575F74219DC187"""
+"""9D40D3E2B18A007B_24F81CCAA07818BE_6039_UN""","""CC(C)(OCC(NCC(C1=C(OC)C=CC=C1)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""4EB46B1BA9DFFBD2_7F198A78C83AF036_6039_UN""","""CC(C)(OCC(C(C1=CC=C([N](=O)=O)C=C1)=O)(F)F)C#N""",21,"""41575F74219DC187"""
+"""9E6245EBC061B9B0_BD30DBF949EC2CD2_6039_UN""","""CC(C)(OCC(C1=CC=CC(=C1)[S](N(C)C)(=O)=O)=O)C#N""",21,"""41575F74219DC187"""
+"""D194C8559957AED0_C3AC00B42FBE19CD_6039_UN""","""CC(C)(OCC2=CC1=CC(=C(OC)C=C1C=C2)OC)C#N""",21,"""41575F74219DC187"""
+"""3F4960FFAA42536D_27AD09FE5C6C219A_6039_UN""","""CC(C)(OCC3CCC1(CCC2(CC1)OCCO2)O3)C#N""",21,"""41575F74219DC187"""
+"""7905E3DBFF86E3EF_165E24A8CF02F2F9_6039_UN""","""CC(C)(OCC(C(C1=CC=CC(=C1)[N](=O)=O)=O)(F)F)C#N""",21,"""41575F74219DC187"""
+"""FE7DCC160E175012_618DEA7897BB6986_6039_UN""","""CC(C)(OCC(NC1=C(SCC(N)=O)C=CC=C1)=O)C#N""",21,"""41575F74219DC187"""
+"""D7B2F80CA0212CD1_6416BB2A23EAEE5F_6039_UN""","""CC(C)(OCCCCC[N]1C2=C(N=C1C)C=CC=C2)C#N""",21,"""41575F74219DC187"""
+"""3911CD0DC1DFEF2D_EFE82435A55D1914_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC=CC(=C2)[N](=O)=O)C#N""",21,"""41575F74219DC187"""
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+"""C632E94B4E3637AE_6D99705873430AC6_6039_UN""","""O(CC1(CC#N)COC1)CC(=O)NC2=NN=C(O2)C3CC3""",21,"""C86C30E70AE8053D"""
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+"""6F449D5753BF878D_A119F7193C2F3112_6039_UN""","""O(CC1(CC#N)COC1)CC(=O)NCCC2CCCCC2""",21,"""C86C30E70AE8053D"""
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+"""5DE694111EC69DDE_6756E0B328042BC5_6039_UN""","""O(CC1(CC#N)COC1)CC(NC2=CC=N[N]2CCC)=O""",21,"""C86C30E70AE8053D"""
+"""C1AA88D96185EF72_D3A6E2744030959E_6039_UN""","""O(CC1(CC#N)COC1)CC(=O)NCC2CC[S](=O)(=O)C2""",21,"""C86C30E70AE8053D"""
+"""CC3B1971714325C6_7B6D5AF308BDAE74_6039_UN""","""O(CC1(CC#N)COC1)CC2=CC=CC(=C2)C(N(C)C)=O""",21,"""C86C30E70AE8053D"""
+"""8FB99C9D3B5AFE6F_CD39161CFBB62483_6039_UN""","""O(CC1(CC#N)COC1)CC3=NC2=C(C=N[N]2C)C(N3)=O""",21,"""C86C30E70AE8053D"""
+"""DF159BFE6713624E_5F10CEFC98F56C7C_6039_UN""","""O(CC1(CC#N)COC1)CC(NC2=NC(=C(S2)C)CC)=O""",21,"""C86C30E70AE8053D"""
+"""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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+"""DCD96C1A187FF58C_AF4E081140C293DE_6039_UN""","""O(CC1(CC#N)COC1)CC2=NN=C(S2)C3=CC=CC=C3""",21,"""C86C30E70AE8053D"""
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+"""E64A4D414C4F834F_211D2861EF8A5BEB_6039_UN""","""O(CC1(CC#N)COC1)CC2=CC=CC3=C2OC(F)(F)O3""",21,"""C86C30E70AE8053D"""
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+"""0FB5DBECA84DD1A4_BE3737746C9FF6FB_6039_UN""","""O(CC1(CC#N)COC1)CC3CN=C(C2=C[N](C)N=C2)O3""",21,"""C86C30E70AE8053D"""
+"""75C606FC3403FD83_F153F53CF454C60F_6039_UN""","""O(CC1(CC#N)COC1)CC(COC2=CC=C(F)C=C2)=O""",21,"""C86C30E70AE8053D"""
+"""EE5F3D141C45F3A5_7C269888DD284D31_6039_UN""","""O(CC1(CC#N)COC1)CC3=NC2=C(C=CC=C2)C(=O)N3""",21,"""C86C30E70AE8053D"""
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+"""E2DEF6ADCA935B13_465B696E59685DD6_6039_UN""","""CC1=NOC(=C1OCC(NC2=CC=CC(=C2)C(C)C)=O)C""",21,"""03B42AC91C770167"""
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+"""6431970D1ED36237_4B5235AC64BF4F79_6039_UN""","""CC1=NOC(=C1OCCN3C(=O)NC2(CCCC2)C3=O)C""",21,"""03B42AC91C770167"""
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+"""38CBE524E3627751_02176291980531EC_6039_UN""","""O(CCOCC1CCCO1)CC2=NOC(=C2)C3=CC=CO3""",21,"""8F5BBBE7CFE6F605"""
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+"""3E33CFF0DDA8A8D5_9E70694E7E9EA915_6039_UN""","""O(CCOCC1CCCO1)CC(NCCOCCCC)=O""",21,"""8F5BBBE7CFE6F605"""
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+"""FACBB08FC9A3A6DA_E003B1168784A69D_6039_UN""","""O(CCOCC1CCCO1)CC2=CC=C(N(CC)C)C=C2""",21,"""8F5BBBE7CFE6F605"""
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+"""A712D1821B151677_12E49C73FD7130D9_6039_UN""","""O(CCOCC1CCCO1)CC2=NC(=N[NH]2)C3=CC=CS3""",21,"""8F5BBBE7CFE6F605"""
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+"""D868D076BE5618CE_018468B5A84F45D4_6039_UN""","""O(CCOCC1CCCO1)CC(=O)NNC(=O)C2CCC2""",21,"""8F5BBBE7CFE6F605"""
+"""5AF2C34AECC5AD8B_27BFE8B4F3BA84C2_6039_UN""","""O(CCOCC1CCCO1)CCCOCC2CCCCO2""",21,"""8F5BBBE7CFE6F605"""
+"""6FAF52FBD885DC23_39477FD24E4EB77F_6039_UN""","""O(CCOCC1CCCO1)CC2=C(C=C([N](=O)=O)C=C2)F""",21,"""8F5BBBE7CFE6F605"""
+"""5E612D1DCF5EE983_2E6B78AB648C463D_6039_UN""","""O(CCOCC1CCCO1)CC2=C(OC)C=C(C=C2)C#N""",21,"""8F5BBBE7CFE6F605"""
+"""DB10EDABB778C107_A496E19B96247EA4_6039_UN""","""O(CCOCC1CCCO1)CC2=CSC(=N2)C3CCCO3""",21,"""8F5BBBE7CFE6F605"""
+"""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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+"""BD8E267148C16710_30F45BAA68B7C128_6039_UN""","""O(CCOCC1CCCO1)CC(C2=C(C=C(C)C=C2)C)=O""",21,"""8F5BBBE7CFE6F605"""
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+"""BE3E0E820660D776_8674E4253CA6BDDE_6039_UN""","""O(CCOCC1CCCO1)CC2=C(C(OC)=O)C=CC=N2""",21,"""8F5BBBE7CFE6F605"""
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+"""CF51D32FB053D027_C507C0536189CEA5_6039_UN""","""O(CCOCC1CCCO1)CC(N(C)CC2=CC=CS2)=O""",21,"""8F5BBBE7CFE6F605"""
+"""928B476D24CC0787_FE7EBBE77F508A6F_6039_UN""","""O(CCOCC1CCCO1)CC2=NC(=NO2)C(OCC)C""",21,"""8F5BBBE7CFE6F605"""
+"""0BB872990C4E2EC5_6016AED1C567B6DC_6039_UN""","""O(CCOCC1CCCO1)CC2=NC(=NO2)CC(F)(F)F""",21,"""8F5BBBE7CFE6F605"""
+"""A7A78D2AE4C52C9D_C19F3DC315B296C1_6039_UN""","""O(CCOCC1CCCO1)CC(=O)C2=CC(=CC=C2)C#N""",21,"""8F5BBBE7CFE6F605"""
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+"""DDECDC21E541E3B3_5A092F6C05AF2622_6039_UN""","""O(CCOCC1CCCO1)CC2=C(OC(F)F)C=CC=C2""",21,"""8F5BBBE7CFE6F605"""
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+"""581E3634D85FFB4D_E32A5FF024A4F069_6039_UN""","""O(CCOCC1CCCO1)CC2=CC(=C(OC)C=C2)C#N""",21,"""8F5BBBE7CFE6F605"""
+"""FE90FBABF2946C85_DE14CFB5CF7CE826_6039_UN""","""O(CCOCC1CCCO1)CC2=CC=CC(=C2)NC(C)=O""",21,"""8F5BBBE7CFE6F605"""
+"""FFE0C9A3DA02AEED_F678C6D52625E7D3_6039_UN""","""O(CCOCC1CCCO1)CC2=CC=C(OC(F)F)C=C2""",21,"""8F5BBBE7CFE6F605"""
+"""230197D75CF0EE12_C38B45DBF881FCD4_6039_UN""","""O(CCOCC1CCCO1)CC(C2=NC=C[N]2C(C)C)=O""",21,"""8F5BBBE7CFE6F605"""
+"""C976BC66F7FE78F9_764DB73225B973D3_6039_UN""","""O(CCOCC1CCCO1)CC2=N[N](C)C(=C2)C(F)(F)F""",21,"""8F5BBBE7CFE6F605"""
+"""26721AD15D0193E7_0295E6A715D072E6_6039_UN""","""O(CCOCC1CCCO1)CC2=CC(=N[N]2C)C(F)(F)F""",21,"""8F5BBBE7CFE6F605"""
+"""6D3AA2EB84D21B26_8FEC1AB0880424C4_6039_UN""","""O(CCOCC1CCCO1)CC(NC(CCCCC)C)=O""",21,"""8F5BBBE7CFE6F605"""
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+"""D948EAC3AD9DD0A5_7610F928BEA8E715_6039_UN""","""O(CCOCC1CCCO1)CC2=C(C=CC(=C2)[N](=O)=O)F""",21,"""8F5BBBE7CFE6F605"""
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+"""53C56A386BEC32AA_ECC2EB7049E2115E_6039_UN""","""O(CCOCC1CCCO1)CC2=CC(=NC(=C2)OC)OC""",21,"""8F5BBBE7CFE6F605"""
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+"""E9B1D160FCA20DC6_4B97516CB84F0A3F_6039_UN""","""O(CCOCC1CCCO1)CC2=CC(=NC(=N2)C3CC3)C""",21,"""8F5BBBE7CFE6F605"""
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+"""197069DD6DCD3754_DAEAFCBBC3166EA4_6039_UN""","""O(CCOCC1CCCO1)CC2=C(C(OCC)=O)C=N[NH]2""",21,"""8F5BBBE7CFE6F605"""
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+"""E3DDB3C7E0745B12_9632810CE0CD4FF1_6039_UN""","""O(CCOCC1CCCO1)CCCO[S](C(F)(F)F)(=O)=O""",21,"""8F5BBBE7CFE6F605"""
+"""01A7BB0ADB7A8C1B_070C76C410257B54_6039_UN""","""O(CCOCC1CCCO1)CC[S](=O)(=O)C2=CC=CC=C2""",21,"""8F5BBBE7CFE6F605"""
+"""7E299098732BAC7B_0CE06D7026B5B062_6039_UN""","""O(CCOCC1CCCO1)CC2=CN=C(OC)C=C2OC""",21,"""8F5BBBE7CFE6F605"""
+"""C20F978F33415168_8779805D9E13E642_6039_UN""","""O(CCOCC1CCCO1)CC2=CN=C(C(OC)=O)C=C2""",21,"""8F5BBBE7CFE6F605"""
+"""5825033AE1AB3DD2_21F6C3F94EEC937C_6039_UN""","""O(CCOCC1CCCO1)CC2=C([S](F)(=O)=O)C=CC=C2""",21,"""8F5BBBE7CFE6F605"""
+"""0B8237EBE355EE4B_F9061F29534971F5_6039_UN""","""O(CCOCC1CCCO1)CC2=NC=C(C(C)(F)F)C=C2""",21,"""8F5BBBE7CFE6F605"""
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+"""499C2C52C0C35A77_C811889958DBF5BD_6039_UN""","""O(CCOCC1CCCO1)CC2=NC(=C(C=C2)[N](=O)=O)C""",21,"""8F5BBBE7CFE6F605"""
+"""F83549979A1E99EE_B6ADD71F0CAFCD00_6039_UN""","""O(CCOCC1CCCO1)CC2=CC=CC(=N2)OC(F)F""",21,"""8F5BBBE7CFE6F605"""
+"""F67BC26CB0A47CA4_F1B81C18F4CFF03F_6039_UN""","""O(CCOCC1CCCO1)CC3=C[N]2C=CC=C(F)C2=N3""",21,"""8F5BBBE7CFE6F605"""
+"""53DCABC4B626B290_A4A850D6B2B1E3DE_6039_UN""","""O(CCOCC1CCCO1)CC2=NN=C(O2)C3=CC=CO3""",21,"""8F5BBBE7CFE6F605"""
+"""AF42C45C126E8A92_CC0E5E91CD7F5A59_6039_UN""","""O(CCOCC1CCCO1)CC(=O)C2CC3=C2C=CC=C3""",21,"""8F5BBBE7CFE6F605"""
+"""C1ADBB2833005DE7_E4DC8BE8D64C3394_6039_UN""","""O(CCOCC1CCCO1)CCN2CCN(CC2)C3CC3""",21,"""8F5BBBE7CFE6F605"""
+"""40706E43EBE9503C_C213C83F3B391B96_6039_UN""","""O(CCOCC1CCCO1)CC(=O)N2CCCCCCC2""",21,"""8F5BBBE7CFE6F605"""
+"""F1889B4296D99441_893F5DFD7325008C_6039_UN""","""O(CCOCC1CCCO1)CC(NNC(C(C)(C)C)=O)=O""",21,"""8F5BBBE7CFE6F605"""
+"""3EBB869A6FF9154F_2F403EAF711D74F7_6039_UN""","""O(CCOCC1CCCO1)CC(C2=C(C)[N](C(=C2)C)C)=O""",21,"""8F5BBBE7CFE6F605"""
+"""A4170E2C61488482_E2F54C51A3668D9B_6039_UN""","""O(CCOCC1CCCO1)CC2=C(SC(F)F)C=CC=C2""",21,"""8F5BBBE7CFE6F605"""
+"""D9B7E45F778333FD_8A27B3A0A2B923DF_6039_UN""","""O(CCOCC1CCCO1)CC2=CC(=C(O2)C)C(OC)=O""",21,"""8F5BBBE7CFE6F605"""
+"""8985A056C216F208_21304AC762B53385_6039_UN""","""O(CCOCC1CCCO1)CCC2=CC=C([N](=O)=O)C=C2""",21,"""8F5BBBE7CFE6F605"""
+"""4A2EF6E8EF0D26E8_439EA99282D7FACD_6039_UN""","""O(CCOCC1CCCO1)CCCCC(N[S](C)(=O)=O)=O""",21,"""8F5BBBE7CFE6F605"""
+"""A0C02106C40F6FFF_B6460822A3EB2460_6039_UN""","""O(CCOCC1CCCO1)CC(=O)NC(=O)C2=CC=C[NH]2""",21,"""8F5BBBE7CFE6F605"""
+"""64B98EFB58FB2413_AB85B698C2728B38_6039_UN""","""O(CCOCC1CCCO1)CCOC2=C(C=CC(=C2)C)C""",21,"""8F5BBBE7CFE6F605"""
+"""A9B121EAD20E7A50_C55FD4DB672E15FB_6039_UN""","""O(CCOCC1CCCO1)CC2=CC=CC(=C2)OCCC""",21,"""8F5BBBE7CFE6F605"""
+"""26B6CC41F51B6F9F_F642F65341209728_6039_UN""","""O(CCOCC1CCCO1)CC2=C([N](=O)=O)C=CC=C2F""",21,"""8F5BBBE7CFE6F605"""
+"""695A032FAB4535E8_B45205BAF24701C3_6039_UN""","""O(CCOCC1CCCO1)CCCN(CC)CC(F)(F)F""",21,"""8F5BBBE7CFE6F605"""
+"""D5A4C75D1E5A1F8A_C41C608F3C4F9D56_6039_UN""","""O(CCOCC1CCCO1)CC2=CN=C(C(C)(C)C)N=C2""",21,"""8F5BBBE7CFE6F605"""
+"""8644FE7109656431_CC42F9CA5BF02214_6039_UN""","""O(CCOCC1CCCO1)CC2=NC=C(C(OC)=O)C=C2""",21,"""8F5BBBE7CFE6F605"""
+"""74B7E6BDAB8707B7_AE889882F727A0B5_6039_UN""","""O(CCOCC1CCCO1)CC(N(C(CC(C)C)C)C)=O""",21,"""8F5BBBE7CFE6F605"""
+"""8F2931A0CF325646_5DA4740667159A9E_6039_UN""","""O(CCOCC1CCCO1)CC(N2CC(CC)OCC2)=O""",21,"""8F5BBBE7CFE6F605"""
+"""9F5CAD5E769E6E61_B3CC260765F4E45E_6039_UN""","""O(CCOCC1CCCO1)CCC2=CC=C(C(N)=O)C=C2""",21,"""8F5BBBE7CFE6F605"""
+"""AB8F56326A23B767_10D09E2F70F5D7C8_6039_UN""","""O(CCOCC1CCCO1)CC(C23CC(C)(C2)OCC3)=O""",21,"""8F5BBBE7CFE6F605"""
+"""81CA8E61ECBD4255_DEE8499FC6AFDBB5_6039_UN""","""O(CCOCC1CCCO1)CC2=C3C(=CC=C2)N=CC=C3""",21,"""8F5BBBE7CFE6F605"""
+"""A42F99A7DF2D8A55_346298A26253B266_6039_UN""","""O(CCOCC1CCCO1)CC(C2CCC(C)(C)CC2)=O""",21,"""8F5BBBE7CFE6F605"""
+"""60BC4FB0F9705C3A_F9215018C8054DC8_6039_UN""","""O(CCOCC1CCCO1)CC2=C(C=C(C(N)=O)C=C2)F""",21,"""8F5BBBE7CFE6F605"""
+"""F5884B606239C05A_DACB46E3165779DF_6039_UN""","""O(CCOCC1CCCO1)CC2=C(C=N[N]2C)[S](=O)(=O)Cl""",21,"""8F5BBBE7CFE6F605"""
+"""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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+"""1059CE105340108F_842E9188783E8337_6039_UN""","""O(CCN=[N]#N)CC(C2=CC1=C(N(C)C(=O)CC1)C=C2)=O""",21,"""055753B37FA4964D"""
+"""BC89A471715199C0_E44CFF9ECC3576C8_6039_UN""","""O(CCN=[N]#N)CC(NC2=NN=C(C1=C(C)C=CS1)O2)=O""",21,"""055753B37FA4964D"""
+"""8966F87C05ADC9E0_7722A254A136DECB_6039_UN""","""O(CCN=[N]#N)CC(NC1=C(C)C=C(C=C1C)SC#N)=O""",21,"""055753B37FA4964D"""
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+"""7393882522F05AEE_1E2066138AFC9E65_6039_UN""","""O(CCN=[N]#N)CC1=NC(=NO1)C2=CC=C(C(C)C)C=C2""",21,"""055753B37FA4964D"""
+"""AF11C90CDB9EB4DD_6A6F22FCEBAF1576_6039_UN""","""O(CCN=[N]#N)CC(NCC1=CC=C(CN(C)C)C=C1)=O""",21,"""055753B37FA4964D"""
+"""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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+"""14BB3F0D1994B528_89F319BE85A27370_6039_UN""","""O(CCN=[N]#N)CC1=COC(=N1)C2=CC=C([N](=O)=O)C=C2""",21,"""055753B37FA4964D"""
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+"""E9A0BC7A4F08BC69_60FE1D8A43A94260_6039_UN""","""O(CCN=[N]#N)CCC(=O)NC1=CC2=C(C=C1)OCCO2""",21,"""055753B37FA4964D"""
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+"""5E73F989B21E834D_9698CBA58E3874ED_6039_UN""","""O(CCN=[N]#N)CC(=O)NCCC1=C[NH]C2=C1C=CC=C2""",21,"""055753B37FA4964D"""
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+"""890C3BFB2AB8DAE5_A8506CA0119EA7AB_6039_UN""","""O(CCN=[N]#N)CC(=O)C1=CC=C(C=C1)N2CCOC2=O""",21,"""055753B37FA4964D"""
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+"""DA054C7B49BB2DCE_CEB2CBE2F73FE1CC_6039_UN""","""O(CCN=[N]#N)CC(C1CCN(C(C(F)(F)F)=O)CC1)=O""",21,"""055753B37FA4964D"""
+"""641289C66E098BCC_D2A0C4C1B77842AA_6039_UN""","""O(CCN=[N]#N)CC#CCN2C(=O)C1=C(C=CC=C1)C2=O""",21,"""055753B37FA4964D"""
+"""AEA517477346AB34_3BE3B5B9CAF1AEBA_6039_UN""","""O(CCN=[N]#N)CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F""",21,"""055753B37FA4964D"""
+"""A85CD44CE02C144E_F98703C2DF3EC775_6039_UN""","""O(CCN=[N]#N)CC1=C(C=C(C(OC)=O)C=C1)C(F)(F)F""",21,"""055753B37FA4964D"""
+"""F732624CE1B42FAD_43FB418906789C84_6039_UN""","""O(CCN=[N]#N)CC(=O)NC1=CC=C(C=C1)N2CCCC2""",21,"""055753B37FA4964D"""
+"""829A1E385DDEA5FC_55612A1BC59B0F3E_6039_UN""","""O(CCN=[N]#N)CC1=CSC(=N1)COC2=CC=C(C)C=C2""",21,"""055753B37FA4964D"""
+"""584F266218899C59_D0113E4B753FF928_6039_UN""","""O(CCN=[N]#N)CC(N(C(C)(C)C)CC1=CC=CC=C1)=O""",21,"""055753B37FA4964D"""
+"""2C2DF3807197DF2E_CECAE0A98368E76D_6039_UN""","""O(CCN=[N]#N)CC(NCC1=CC(=C(OC)C=C1)OC)=O""",21,"""055753B37FA4964D"""
+"""F99C891B8A3AB29E_A18D5EF475C407A9_6039_UN""","""O(CCN=[N]#N)CCCCCCCCCCCCCCC""",21,"""055753B37FA4964D"""
+"""941A73957E0563B4_78E755AF787D8B88_6039_UN""","""O(CCN=[N]#N)CC(=O)N1CCC(=CC1)C2=CC=CC=C2""",21,"""055753B37FA4964D"""
+"""1179CC3C6C6BCAFE_6C374DF0DE6FD3D0_6039_UN""","""O(CCN=[N]#N)CC(NC1=C(C=CC(=C1)[S](C)(=O)=O)F)=O""",21,"""055753B37FA4964D"""
+"""B42A2082346CB4D4_82D3908D00694483_6039_UN""","""O(CCN=[N]#N)CC(NC1=C(C=C([N](=O)=O)C=C1)C#N)=O""",21,"""055753B37FA4964D"""
+"""BF2DCD2CBC0C13A8_5DFC93595DD23A6E_6039_UN""","""O(CCN=[N]#N)CC(NC1=C(OC)C=C(C=C1)[N](=O)=O)=O""",21,"""055753B37FA4964D"""
+"""4FB66774AF7E8977_849EEE8A4D18E571_6039_UN""","""O(CCN=[N]#N)CC(NC1=C(C(OCC)=O)C=CC=C1)=O""",21,"""055753B37FA4964D"""
+"""459C9BDF8CA7413E_CDFBCBDAF861267E_6039_UN""","""O(CCN=[N]#N)CC(C1=CC(=C(C(=C1)OC)OC)OC)=O""",21,"""055753B37FA4964D"""
+"""D0AD2D26DD845CF4_E314B91E3202EF85_6039_UN""","""O(CCN=[N]#N)CC(N(CC(N(C)C)=O)CC(F)(F)F)=O""",21,"""055753B37FA4964D"""
+"""EEE3C9973BCB7195_9F3DA23F4AFDF4AD_6039_UN""","""O(CCN=[N]#N)CCOC1=CC=C(C=CC(OC)=O)C=C1""",21,"""055753B37FA4964D"""
+"""7F2B396B3FF4910A_E638BDBA85F3B483_6039_UN""","""O(CCN=[N]#N)CC2=C1N=CC=CC1=C(C(OC)=O)C=C2""",21,"""055753B37FA4964D"""
+"""293A6F1ECE321722_A7A1E79C3557B20F_6039_UN""","""O(CCN=[N]#N)CC1=C(C(OCC)=O)C(=CO1)C(F)(F)F""",21,"""055753B37FA4964D"""
+"""967CC7AB1A33E762_0FAA6F66058CAED8_6039_UN""","""O(CCN=[N]#N)CC(C(C(OCC)=O)CCC(=O)OC)=O""",21,"""055753B37FA4964D"""
+"""52132E2E4959CE50_08E221DC44A524E7_6039_UN""","""O(CCN=[N]#N)CC(NC(NC1=C(C=CC(=C1)C)C)=O)=O""",21,"""055753B37FA4964D"""
+"""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"""
+"""80BDCEDCE5CADF35_796CF9ECA49F986E_6039_UN""","""O(CCN=[N]#N)CC1=N[N](C2=C1CCC2)C3=CC=CC=C3""",21,"""055753B37FA4964D"""
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+"""6C8288866E1FF8C9_1C2A9954E0A7C943_6039_UN""","""O(CCCN=[N]#N)CC(N(CC)CC(=O)NC(C)(C)C)=O""",21,"""F50619DBD6CBB094"""
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+"""8D41D65D3C04E29F_4BD3C3D5162ED0A8_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=CC(=C1)C(F)(F)F)=O""",21,"""F50619DBD6CBB094"""
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+"""09515CD7D9F80E24_3E684C99C4C49A7D_6039_UN""","""O(CCCN=[N]#N)CC(C1=CC=C(NC(CC)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""4C00855AEE90F481_CD2C1F486246DC28_6039_UN""","""O(CCCN=[N]#N)CC(NC1=NN=C(CCCCC)S1)=O""",21,"""F50619DBD6CBB094"""
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+"""01BC368FB81FA72F_B40C039B62704C26_6039_UN""","""O(CCCN=[N]#N)CC(C1=C[NH]C2=C(CC)C=CC=C12)=O""",21,"""F50619DBD6CBB094"""
+"""C5EA7990E53E48FA_940204A16F7D9415_6039_UN""","""O(CCCN=[N]#N)CC3=NC1=C(C2=C(S1)CCC2)C(=O)N3""",21,"""F50619DBD6CBB094"""
+"""7F72C18E0BBE0A9E_136F0D13FD75D8A1_6039_UN""","""O(CCCN=[N]#N)CC1=NC(=NO1)C2=CC=C(OC)C=C2""",21,"""F50619DBD6CBB094"""
+"""3E7C2F05511EB4F2_7AC62CA114F2A226_6039_UN""","""O(CCCN=[N]#N)CC2CN(CC1=CC=CC=C1)CCO2""",21,"""F50619DBD6CBB094"""
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+"""98F3A285CC89247F_C8F2762CC7EF194B_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=C([S](C)(=O)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""52ED7A11DAF2B18A_EF3A155CF8B97BE0_6039_UN""","""O(CCCN=[N]#N)CC(C1=CC=C(CCNC(C)=O)S1)=O""",21,"""F50619DBD6CBB094"""
+"""F83A5C3C4E9B28BF_E51FDF38DF432823_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=CC(=C1)[S](C)(=O)=O)=O""",21,"""F50619DBD6CBB094"""
+"""CD116A7CF8C30A35_1AE7D10102F68313_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C([S](C)(=O)=O)C=CC=C1)=O""",21,"""F50619DBD6CBB094"""
+"""C66039072F1055A5_DFA9D4FA146DF1AE_6039_UN""","""O(CCCN=[N]#N)CC1=CSC(=N1)C2=CC=CC(=C2)OC""",21,"""F50619DBD6CBB094"""
+"""789A1DD8884BB9B1_4E5624B463044B98_6039_UN""","""O(CCCN=[N]#N)CC1=CSC(=N1)C2=C(OC)C=CC=C2""",21,"""F50619DBD6CBB094"""
+"""68F4F42A2C52BE67_CD0CDCE92F277E6E_6039_UN""","""O(CCCN=[N]#N)CC(C1=C(C=CC(=C1)C)OC(F)F)=O""",21,"""F50619DBD6CBB094"""
+"""BC2E0FC2DF6A6708_DED753AFFEE6817B_6039_UN""","""O(CCCN=[N]#N)CC(NC(NC1CCCCC1C)=O)=O""",21,"""F50619DBD6CBB094"""
+"""43AD8621B1DB2E20_5ABB0E84A4CD7ABC_6039_UN""","""O(CCCN=[N]#N)CC(C1=C(C(=C(C)C(=C1C)C)C)C)=O""",21,"""F50619DBD6CBB094"""
+"""3932220FE9206F53_6251EE85B683E421_6039_UN""","""O(CCCN=[N]#N)CC2=CC=C([N]1N=C(C)C=C1C)C=C2""",21,"""F50619DBD6CBB094"""
+"""B0EA7C56C4153F5E_F0CD032E58E49044_6039_UN""","""O(CCCN=[N]#N)CC1=CC(=CC2=C1OCOC2)[N](=O)=O""",21,"""F50619DBD6CBB094"""
+"""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"""
+"""6E2E22F2388E3C70_EEE96EE5D5F3AC6E_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC(=O)NCC1=CC=CC=C1""",21,"""F50619DBD6CBB094"""
+"""D2B04A465C6BC9F3_58BCD448DD31EB94_6039_UN""","""O(CCCN=[N]#N)CC(=O)C1=CN=C(S1)N2CCCCC2""",21,"""F50619DBD6CBB094"""
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+"""71E71B51858D0B65_F00F9F89E6673D7B_6039_UN""","""O(CCCN=[N]#N)CC(=O)NCC1(CC1)C2=CC=CC=C2""",21,"""F50619DBD6CBB094"""
+"""AE108E9E1CD7805B_316564452C305EEB_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC(C1CC1)C2=CC=CC=C2""",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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+"""C05D9179F58D22DF_D9E7A1F5AB5EA7B5_6039_UN""","""O(CCCN=[N]#N)CC1=NC(=NO1)C2=C(OC)C=CC=C2""",21,"""F50619DBD6CBB094"""
+"""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"""
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+"""A6A9CDA7F8AD0B07_30AB55A8AA395781_6039_UN""","""O(CCCN=[N]#N)CC1=NC(=NO1)CC(NCCCC)=O""",21,"""F50619DBD6CBB094"""
+"""4C6088239949C0C0_45E6A2BB6C24489D_6039_UN""","""O(CCCN=[N]#N)CC(NCCOC1=CC=CC(=C1)F)=O""",21,"""F50619DBD6CBB094"""
+"""98BBB5CE2C25CED4_91C476EECB9C17A4_6039_UN""","""O(CCCN=[N]#N)CC(NCCOC1=CC=C(F)C=C1)=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"""
+"""6F10D6766FE9536E_276E7AE90F3A90F9_6039_UN""","""O(CCCN=[N]#N)CC(N(CC1=CC=C(C)O1)C2CC2)=O""",21,"""F50619DBD6CBB094"""
+"""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"""
+"""9A295E9E7480A3DE_2C506022913D889D_6039_UN""","""O(CCCN=[N]#N)CC1=COC(=N1)C2=CC=C(C=C2)C#N""",21,"""F50619DBD6CBB094"""
+"""1BB3297A991233D5_08466EF19F715488_6039_UN""","""O(CCCN=[N]#N)CC2=NC=C(C1=CC=C(OC)C=C1)O2""",21,"""F50619DBD6CBB094"""
+"""6F19B579EF506DBA_972BBAF3116F573C_6039_UN""","""O(CCCN=[N]#N)CC(=O)C1=CC2=C(C=C1)OCC(=O)N2""",21,"""F50619DBD6CBB094"""
+"""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"""
+"""BA4264A0CF716FB5_E5B01D6ABE43877C_6039_UN""","""O(CCCN=[N]#N)CCCCN(C)CC1=CC=C(C=C1)F""",21,"""F50619DBD6CBB094"""
+"""EA426102231855FA_F72B3291CC51F39A_6039_UN""","""O(CCCN=[N]#N)CC2=NC1=C(C=CC(=C1)C(F)(F)F)O2""",21,"""F50619DBD6CBB094"""
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+"""7F0A92BA628A441E_3D8ADA9C1BF68B48_6039_UN""","""O(CCCN=[N]#N)CC1=CSC(=N1)C2=CC=C(CC)C=C2""",21,"""F50619DBD6CBB094"""
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+"""5C11BDD68B26FE40_5F815B4E84E5A782_6039_UN""","""O(CCCN=[N]#N)CC(NC(C1=CC=C(OC)C=C1)=O)=O""",21,"""F50619DBD6CBB094"""
+"""58DEF11113B8AC6D_26EBA6F787AABEAA_6039_UN""","""O(CCCN=[N]#N)CC(NNC(C1=CC=C(C)C=C1)=O)=O""",21,"""F50619DBD6CBB094"""
+"""DF3D2BF872D09419_893BA3C370DA3164_6039_UN""","""O(CCCN=[N]#N)CCC(NC1=CC=C(OCC)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""41948D3D1BB4BB57_B5D4ACD4A03059C3_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(F)C=C(C=C1)SC#N)=O""",21,"""F50619DBD6CBB094"""
+"""91BD40370C61B241_C96D9A67249BA78A_6039_UN""","""O(CCCN=[N]#N)CC(C2=CC1=C(N(C)C(=O)C1)C=C2)=O""",21,"""F50619DBD6CBB094"""
+"""1AFF0BA349266AFC_E30D019E20FF621F_6039_UN""","""O(CCCN=[N]#N)CC(NCC1=CC=C(COC)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""C77D0C8DD3E100D8_1E2AD2B3E67D927B_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC(=N[N]1C(C)(C)C)C)=O""",21,"""F50619DBD6CBB094"""
+"""EF407983A657D309_52216865120E7636_6039_UN""","""O(CCCN=[N]#N)CC(NC1(C(OC)=O)CCCCC1)=O""",21,"""F50619DBD6CBB094"""
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+"""5DAB8EC20750C228_29DF7E439A8BB812_6039_UN""","""O(CCCN=[N]#N)CC#CC1=CC=C(OC(F)(F)F)C=C1""",21,"""F50619DBD6CBB094"""
+"""510796D9D887CDC0_49973F56BA1BFC69_6039_UN""","""O(CCCN=[N]#N)CC1=CC(=C(OC)C=C1)SC(F)(F)F""",21,"""F50619DBD6CBB094"""
+"""075C5F47E9013364_A9A8672869B0E554_6039_UN""","""O(CCCN=[N]#N)CC2=NC1=C(C=CC(=C1)C(F)(F)F)S2""",21,"""F50619DBD6CBB094"""
+"""079BFF4C944790F8_5E1774AFC2BA57F1_6039_UN""","""O(CCCN=[N]#N)CCC(NCC(C1=C(C)N=CS1)=O)=O""",21,"""F50619DBD6CBB094"""
+"""D7EB00D5686C9AB8_E6D4F8A6DFFFC47B_6039_UN""","""O(CCCN=[N]#N)CC1=NN=C(C=C1)OC2=CC=CC=C2""",21,"""F50619DBD6CBB094"""
+"""4A59FBBDD124CCDE_14E696D3B304FD48_6039_UN""","""O(CCCN=[N]#N)CCCC2=NC1=C(C=CC(=N1)OC)[NH]2""",21,"""F50619DBD6CBB094"""
+"""E84885B0C47E52B0_12B17D5741543C55_6039_UN""","""O(CCCN=[N]#N)CCN1C2=C(OC(C)C1=O)C=CC=C2""",21,"""F50619DBD6CBB094"""
+"""BE48EC7D7DEF8E6D_AE0B53CCD3E8AB8F_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=C(C(OC)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
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+"""EAEFD5E77588013F_5CC69FF48F67D1B0_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=C(C(CC)C)C=C1)=O""",21,"""F50619DBD6CBB094"""
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+"""C136FF2508B4080D_F1DF82AF80754159_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=C([S](N)(=O)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""8E0A80A8C496C03C_57F4BEE22B1C0772_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC(=C(C=C1)F)[N](=O)=O)=O""",21,"""F50619DBD6CBB094"""
+"""71D6D135B74E5622_3E3EA033045B15A4_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C=CC(=C1)OC)OC)=O""",21,"""F50619DBD6CBB094"""
+"""180D2DAB891D7F93_22059FCB1D8413D9_6039_UN""","""O(CCCN=[N]#N)CC[S](C1=CC=C([N](=O)=O)C=C1)(=O)=O""",21,"""F50619DBD6CBB094"""
+"""47C36CCB39631679_D4E41B89523445A3_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C(C)C)C=CC=C1C)=O""",21,"""F50619DBD6CBB094"""
+"""5EAD9C72F242BBC6_4D51DAE17C24354C_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(CC)C=CC=C1CC)=O""",21,"""F50619DBD6CBB094"""
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+"""B0CC435A2B501006_A6D82D49414E1F62_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=C(C(C)(C)C)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""1A05D0FBED33FAC5_A8B1CCE74233B1AC_6039_UN""","""O(CCCN=[N]#N)CC(=O)NCC1=CC2=C(C=C1)OCO2""",21,"""F50619DBD6CBB094"""
+"""52CA3AF3380DA1D9_15281C1E700F877B_6039_UN""","""O(CCCN=[N]#N)CC1=NC(=CS1)C2=C(F)C=CC=C2F""",21,"""F50619DBD6CBB094"""
+"""9C3B87125458A6BC_394190A2773CF6DD_6039_UN""","""O(CCCN=[N]#N)CC2=NC1=CC(=C(C=C1[NH]2)OC)OC""",21,"""F50619DBD6CBB094"""
+"""18E4E9400CE98AC2_2B533CBE1952456D_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=C(NC(C)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""F560C9B2FCEB22CD_7FC1093FF3A49C81_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=C(C(F)(F)F)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""1E6044EFD4D9BB15_6A88AB2BAB66A055_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C=CC(=C1)[N](=O)=O)F)=O""",21,"""F50619DBD6CBB094"""
+"""76DEA85DB7891703_D86DB9B5F84D10F1_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=CC(=C1)[S](N)(=O)=O)=O""",21,"""F50619DBD6CBB094"""
+"""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"""
+"""1798579F982B7FB5_2BC559147709C4BC_6039_UN""","""O(CCCN=[N]#N)CC2=N[N](C1=C(C=C(F)C=C1)F)C=C2""",21,"""F50619DBD6CBB094"""
+"""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"""
+"""AA9FEB0072FA3D5F_B25C23754D838F92_6039_UN""","""O(CCCN=[N]#N)CC(NCCC1=C(OC)C=CC=C1)=O""",21,"""F50619DBD6CBB094"""
+"""B41A2F2E4D04F6AB_1CA1C95CF5FB2CFF_6039_UN""","""O(CCCN=[N]#N)CCC(NC1=C(OCC)C=CC=C1)=O""",21,"""F50619DBD6CBB094"""
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+"""D0981E62A6197895_C5400CD6F9C0E8A3_6039_UN""","""O(CCCN=[N]#N)CC1=CC=C(C=C1)[S](=O)(=O)NC2CC2""",21,"""F50619DBD6CBB094"""
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+"""71C26BC7DBF77537_E2C5B8385C65E429_6039_UN""","""O(CCCN=[N]#N)CC1=COC(=N1)C2=CC(=CC=C2)C#N""",21,"""F50619DBD6CBB094"""
+"""3D9BBA8B38FD3882_2B4039E8FA13B92A_6039_UN""","""O(CCCN=[N]#N)CCC(C(C)=O)(C#N)C1=CC=CC=C1""",21,"""F50619DBD6CBB094"""
+"""95D447091C74C978_ED67E523065C3252_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC1=CC2=C(C=C1)C=CC=C2""",21,"""F50619DBD6CBB094"""
+"""E59C9A2BD20821F8_C4FF554717B7614A_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C=C(C)C=C1)[N](=O)=O)=O""",21,"""F50619DBD6CBB094"""
+"""09AE2C50F0E440A5_7D03952A47752010_6039_UN""","""O(CCCN=[N]#N)CC2CN=C(C1=CC=C(OC)C=C1)S2""",21,"""F50619DBD6CBB094"""
+"""6CB68D936EF2BF47_BAA21E4D8B7A4578_6039_UN""","""O(CCCN=[N]#N)CC(=O)C1=CC2=C(C=C1)OCCCO2""",21,"""F50619DBD6CBB094"""
+"""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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+"""B542F0792FEEB067_4ACD1E2DF8CF4BC6_6039_UN""","""O(CCCN=[N]#N)CC(=O)N(CCC#N)C1=CC=CC=C1""",21,"""F50619DBD6CBB094"""
+"""A0AF7AAD7975468C_7F2ECD4510C8B5C2_6039_UN""","""O(CCCN=[N]#N)CC(NCCC1=CC=C(OC)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""4929389D6B726E0F_D64C1E4BADB3EA24_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC1CCCC2=C1C=CC=C2""",21,"""F50619DBD6CBB094"""
+"""01D39E13CECDDCEA_D9271B139719BE15_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C([N](=O)=O)C=C(C=C1)F)=O""",21,"""F50619DBD6CBB094"""
+"""202764A5F90EFAC5_FCF6D4F57B7BC1F2_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=C(OC(F)F)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""0C6ACA934F4AB44E_D94C29B4A88BDAA3_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=CC(=C1C)[N](=O)=O)=O""",21,"""F50619DBD6CBB094"""
+"""8DFEB12148C6DB60_510C75A8D4A9CFC1_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C(C)(C)C)C=CC=C1)=O""",21,"""F50619DBD6CBB094"""
+"""572DBEE962CA1D4F_B288D579D79FCD37_6039_UN""","""O(CCCN=[N]#N)CC(N(C(C)C)CC1=CC=CC=C1)=O""",21,"""F50619DBD6CBB094"""
+"""4E1BC6E5FA0ADE12_8942D5C7E8261DAB_6039_UN""","""O(CCCN=[N]#N)CC1=NC2=C(S1)C(C)(C)CC(C)(C)C2""",21,"""F50619DBD6CBB094"""
+"""D58D640021DF3999_858E609D0A6B3FA3_6039_UN""","""O(CCCN=[N]#N)CC2=NC1=CC=CC(=C1[S](N2)(=O)=O)F""",21,"""F50619DBD6CBB094"""
+"""8DA371C70073699B_F6B85BDFD1BAB1E1_6039_UN""","""O(CCCN=[N]#N)CC2=NC1=C(C(O)=O)C=C(C=C1[NH]2)F""",21,"""F50619DBD6CBB094"""
+"""2E7C947FD77107CB_0988141D3D5A51B1_6039_UN""","""O(CCCN=[N]#N)CC1=NC=CC(=C1C)OCC(F)(F)F""",21,"""F50619DBD6CBB094"""
+"""90D3E635D3526B99_0EECC47BB5BB469B_6039_UN""","""O(CCCN=[N]#N)CC#CCOC1=CC=C(C(C)=O)C=C1""",21,"""F50619DBD6CBB094"""
+"""47555361ADB61205_839FC44161681961_6039_UN""","""O(CCCN=[N]#N)CC1=NC=C(O1)C2=CC=C(C=C2)C#N""",21,"""F50619DBD6CBB094"""
+"""82D73C99DDFE1FE8_F27A918705352B4B_6039_UN""","""O(CCCN=[N]#N)CC#CC1=CC=CC(=C1)OCCOC""",21,"""F50619DBD6CBB094"""
+"""C634FC93DCEA7C13_E5F9C3DEC7581F5E_6039_UN""","""O(CCCN=[N]#N)CC(NNC(C1=C(F)C=CC=C1)=O)=O""",21,"""F50619DBD6CBB094"""
+"""6EAA7F7CB7D5F703_E983CDB229578793_6039_UN""","""O(CCCN=[N]#N)CC(C1=CC=C(CNC(C)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""A7943A05F4135F22_41209035D5F787F4_6039_UN""","""O(CCCN=[N]#N)CC(NC1=C(C(F)(F)F)C=CC=C1)=O""",21,"""F50619DBD6CBB094"""
+"""3843DF12CFAF2E62_024850D30E7934C8_6039_UN""","""O(CCCN=[N]#N)CCC(NC1=CC=C(C(C)=O)C=C1)=O""",21,"""F50619DBD6CBB094"""
+"""6D107556154566B4_12D4D387B5112264_6039_UN""","""O(CCCN=[N]#N)CC(NC1=CC=CC(=C1)C(OC)=O)=O""",21,"""F50619DBD6CBB094"""
+"""A05D05BEE0D2FFBC_FEB1D1AB46194681_6039_UN""","""O(CCCN=[N]#N)CC2=NN=C(C1=CC(=C(CC)S1)C)O2""",21,"""F50619DBD6CBB094"""
+"""5ABEF17A55A564BC_0741AE4C6FF2AE77_6039_UN""","""O(CCCN=[N]#N)CC(=O)N1CCC(=N1)C2=CC=CC=C2""",21,"""F50619DBD6CBB094"""
+"""B2FAC170E8D4E311_9A2A8F121DDCD0F5_6039_UN""","""O(CCCN=[N]#N)CC(NC(C1=C(OC)C=CC=C1)C)=O""",21,"""F50619DBD6CBB094"""
+"""6DE33639FC0EDB1A_80CCBCA84417E796_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC1=C(C2=C(S1)CCC2)C#N""",21,"""F50619DBD6CBB094"""
+"""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"""
+"""FFD588156DB5CF56_6E836FA9073FD82D_6039_UN""","""O(CCCN=[N]#N)CCCC1=CC=CC(=C1)OC(F)(F)F""",21,"""F50619DBD6CBB094"""
+"""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"""
+"""B3CADB7459651B76_693509BC86641DAB_6039_UN""","""O(CCCN=[N]#N)CC1=C(C)OC(=N1)C2=C(C=CC=C2)C""",21,"""F50619DBD6CBB094"""
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+"""ECB7985AF761A039_CCA843B68B4EFA3F_6039_UN""","""O(CCCN=[N]#N)CC1=CC2=C(C=C1)OC(=C2)C(OC)=O""",21,"""F50619DBD6CBB094"""
+"""E8A0340F854EA057_ADDB720D82E08F34_6039_UN""","""O(CCCN=[N]#N)CC1=CSC(=N1)C2=CC=C(OC)C=C2""",21,"""F50619DBD6CBB094"""
+"""E61ACB2B6E3B9407_7196B1BA19C6702A_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC2C1CC3CC(C1)CC2C3""",21,"""F50619DBD6CBB094"""
+"""B43A1E24D022B535_CE7EEDD7E635014E_6039_UN""","""O(CCCN=[N]#N)CC(=O)NC1=CC2=C(N=C1)C=CC=C2""",21,"""F50619DBD6CBB094"""
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+"""E45BDFB5EC7898C3_2AAF26F8FE3078B3_6039_UN""","""O(CCCN=[N]#N)CC(C2=CC1=CC=CC(=C1O2)OC)=O""",21,"""F50619DBD6CBB094"""
+"""EB260A997E150D2B_A83AD6A4FC5A2AE1_6039_UN""","""O(CCCN=[N]#N)CCCOC1=CC=C(C(C)(C)C)C=C1""",21,"""F50619DBD6CBB094"""
+"""A604ECF9D4AAAC64_E2BDDFB24A67928E_6039_UN""","""O(CCCN=[N]#N)CC1=C(C(OCC)=O)SC2=C1SC=C2""",21,"""F50619DBD6CBB094"""
+"""42B2C3655434B320_80A4E85B0197538F_6039_UN""","""O(CCCN=[N]#N)CC2=NN=C(C1=CC=CC(=C1)OC)O2""",21,"""F50619DBD6CBB094"""
+"""5BDE6D205F9A7DF3_986DE7DB3D033F31_6039_UN""","""O(CCCN=[N]#N)CCCC(C(OCC)=O)C(=O)OCC""",21,"""F50619DBD6CBB094"""
+"""82AFFDC03AF1819D_061A9763AB24D2A0_6039_UN""","""O(CCCN=[N]#N)CC1=NN=N[N]1CCOCC(F)(F)F""",21,"""F50619DBD6CBB094"""
+"""C6D6FDED1519253B_A1DFD7BE86041DE2_6039_UN""","""O(CCCN=[N]#N)CC(NCC(C)(C)C1=CC=CC=C1)=O""",21,"""F50619DBD6CBB094"""
+"""EAC7DAB2266887B2_A7340A3A46A333CC_6039_UN""","""O(CCCN=[N]#N)CC(NC1CCN([S](C)(=O)=O)CC1)=O""",21,"""F50619DBD6CBB094"""
+"""8F9134D4FFB39D60_2FB0F4D95841C861_6039_UN""","""O(CCCN=[N]#N)CC(NCCC1=C(F)C=CC=C1F)=O""",21,"""F50619DBD6CBB094"""
+"""B6E8CCBC81F05243_1E510B9A0A7AABC6_6039_UN""","""O(CCCN=[N]#N)CC(NCCC1=CC=CC(=C1)OC)=O""",21,"""F50619DBD6CBB094"""
+"""0904B0EC02A2FC72_E771958F1B6FDD8F_6039_UN""","""O(CCCN=[N]#N)CC1=NN=N[N]1C2=C(C)C=CC=C2C""",21,"""F50619DBD6CBB094"""
+"""22F80D2D72625537_42BE0CE9929D02E8_6039_UN""","""O(CCCN=[N]#N)CC(N(CCOC)CC1=CC=CS1)=O""",21,"""F50619DBD6CBB094"""
+"""DFB95AAA57DD0439_9742F5223FDDC3DD_6039_UN""","""O(CCCN=[N]#N)CCCOC1=CC=C([S](Cl)(=O)=O)C=C1""",21,"""F50619DBD6CBB094"""
+"""946B48DAC74F8303_1D30498F42E55101_6039_UN""","""O(CCCN=[N]#N)CC1=C([N](N=C1C)CC[S](=O)(=O)C)C""",21,"""F50619DBD6CBB094"""
+"""029A33A15056B5A6_7AED642982F06ED7_6039_UN""","""O(CCCN=[N]#N)CC1=CC(=NC(=N1)C2=CC=CC=C2)C""",21,"""F50619DBD6CBB094"""
+"""B8253F86B45993E3_DE121F9C7EE38D6C_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCCCCCC""",21,"""081BFB862396070F"""
+"""61F1745FBA12A3AC_67A151B2AFEA6471_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)C2=CC=C[NH]2""",21,"""081BFB862396070F"""
+"""4EE1E872982E8231_60079C13E7E935F3_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(NC(OC)=O)=O""",21,"""081BFB862396070F"""
+"""94F06A0AC84CC71A_CE21B397B1600A9A_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(NNC(C)=O)=O""",21,"""081BFB862396070F"""
+"""3E10AF1EFA143334_60C277445D7BAD53_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCOCC(F)(F)F""",21,"""081BFB862396070F"""
+"""3D226D18203A751D_D1B66EF37921CF8D_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCCOC(C)=O""",21,"""081BFB862396070F"""
+"""E2864F65751CE33B_F2B970461DD5AB00_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(C(OCC)=O)=C""",21,"""081BFB862396070F"""
+"""8D992592BFC4AEC4_A0E6A23EC5768DF2_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=CSC(=N2)CC""",21,"""081BFB862396070F"""
+"""12783D223B44A4FE_0E977748EBAE090F_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=NC(=NO2)CC""",21,"""081BFB862396070F"""
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+"""A4A45EDF3B0F10D1_B56EE60C2085619A_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(NC(NC)=O)=O""",21,"""081BFB862396070F"""
+"""C6ABB2D573234398_197ED157120EC43D_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC(NC(C)C)=O""",21,"""081BFB862396070F"""
+"""EC4294DF073E30E4_BCA19C0A78DA38B6_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCN2CCCC2=O""",21,"""081BFB862396070F"""
+"""17748E361E355E03_2F08B5804F990129_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCOC2CCCC2""",21,"""081BFB862396070F"""
+"""1CBD24521CA5AAEA_A5CFAC0D1F3EB2EB_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCC(N(C)C)=O""",21,"""081BFB862396070F"""
+"""167CED309A570F61_218A5230B3A048DE_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=NOC(=N2)CC""",21,"""081BFB862396070F"""
+"""7B77037C3E765EF3_EC6D3189E7D09FEF_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCN2CCCCC2""",21,"""081BFB862396070F"""
+"""4F6DBED4FA90C9C8_D7180B2FED27EF14_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC[N]2C=CC=N2""",21,"""081BFB862396070F"""
+"""BF93EEC219B13384_EFE41A8FA0698575_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC[N]2C=CN=C2C""",21,"""081BFB862396070F"""
+"""D39425640BA322BB_7DE33F1FAB626F58_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=NC(=C(O2)C)C""",21,"""081BFB862396070F"""
+"""C8A31661CE13BA99_EEC3FF34D0C52221_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCOCCC(C)C""",21,"""081BFB862396070F"""
+"""1D104E1AEB3116AB_D0CAFAB3372FF7DF_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCN2CCCC2""",21,"""081BFB862396070F"""
+"""A6A1B5D7797F8F62_2595739F176212B3_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC[S](CCC)(=O)=O""",21,"""081BFB862396070F"""
+"""690D356E5F5CD155_5FB9A9B41FE13EAB_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=C(C)SC(=C2)C""",21,"""081BFB862396070F"""
+"""2795743BBBC22B0B_38A904C0B510E8E3_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2COC(C)(C)O2""",21,"""081BFB862396070F"""
+"""94C404B6F2F0C0E0_B4B841D1A0DA3C29_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2OCCN(C)C2""",21,"""081BFB862396070F"""
+"""F9C23F0899F2B459_7B45819C25AF4388_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=[N](=O)C=CC=N2""",21,"""081BFB862396070F"""
+"""8183586D3D45A468_853D4503870D4407_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC2=C(C)N=CS2""",21,"""081BFB862396070F"""
+"""776C6522B3BEF6FE_D15FF852B7F1D878_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCN2CCOCC2""",21,"""081BFB862396070F"""
+"""0D3712A1AD17003F_DC71F36CEE39EF80_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCN[S](CC)(=O)=O""",21,"""081BFB862396070F"""
+"""52431B6C11B925BD_C33F9544803B1F06_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=CN=C(C)C=N2""",21,"""081BFB862396070F"""
+"""D325497FD3A18283_84904F95C0D510B7_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC(OC(C)C)=O""",21,"""081BFB862396070F"""
+"""1919CE2C812AE60A_7563BCAC31ACA9ED_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=NC=C(CC)O2""",21,"""081BFB862396070F"""
+"""5F1D956C0237114A_EA88EE94CA41429B_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2ON=C(CC)C2""",21,"""081BFB862396070F"""
+"""1FEDD838BB30FC14_91D0F314C45A6E66_6039_DP""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2NC(OC2)(C)C""",21,"""081BFB862396070F"""
+"""21B50315EF3E5615_2F549ED51F427F74_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC[S](CC)(=O)=O""",21,"""081BFB862396070F"""
+"""F2285FB9EDF2D82C_FD54940B6A12840E_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCNC(=O)C2CC2""",21,"""081BFB862396070F"""
+"""79D3F32580F81F28_92BC5DDC78947A78_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC2CCOC2=O""",21,"""081BFB862396070F"""
+"""1B0A97702D79CA34_50A736129AEC695A_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC2CCCCC2""",21,"""081BFB862396070F"""
+"""34B8437F72E211B2_31DC90FF0333D197_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCC(OC)OC""",21,"""081BFB862396070F"""
+"""B6C91B69521830CE_C5561611D4EE30B4_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=C(C)OC(O2)=O""",21,"""081BFB862396070F"""
+"""01C6ED9591BBEB7B_6727F587AF22ED84_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(N(C)C2CC2)=O""",21,"""081BFB862396070F"""
+"""BB970850556650B4_CC4891857A52F6CF_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCN(CC)CC""",21,"""081BFB862396070F"""
+"""331FB2C859753155_7826BD0336CDC7D6_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC2=C[N](C)N=C2""",21,"""081BFB862396070F"""
+"""14781302D15BD26B_AED3232F2C52B2AC_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=CN=C(C)C=C2""",21,"""081BFB862396070F"""
+"""E2C64B4FD003A685_5FB28CE2DCDFF906_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCC[S](C)(=O)=O""",21,"""081BFB862396070F"""
+"""93F22340248121E9_CB1D299F0239ADFE_6039_DP""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=CC=CC(=C2)N""",21,"""081BFB862396070F"""
+"""124AF4C71F59F3B3_4E1D07D05510259D_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC2N(C)CCC2""",21,"""081BFB862396070F"""
+"""3318DE7DEC84E353_FD54E72C022B16C0_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCN2CC(C)CC2""",21,"""081BFB862396070F"""
+"""514A499FDA850AB6_6BA2CA546C95E6E7_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCN2CCSCC2""",21,"""081BFB862396070F"""
+"""F0EA19A02E6E28D6_3713576813DBEB50_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCOCCN(C)C""",21,"""081BFB862396070F"""
+"""03EF61CCABC47331_9D503E8A68515448_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=C(C)C=CN=C2""",21,"""081BFB862396070F"""
+"""FF3804DB63721B21_A97D7DC096FCD148_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCSCC(C)C""",21,"""081BFB862396070F"""
+"""3E1A8E33461E3668_9E3547203D346F47_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCCC(F)(F)F""",21,"""081BFB862396070F"""
+"""61F751B3E655C04A_616ABA4D404F9F49_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC2=CN=CC=C2""",21,"""081BFB862396070F"""
+"""7A065C7CEF78BD2C_FAC1BF48EAB7AF7B_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(OC)(OC)OC""",21,"""081BFB862396070F"""
+"""25E0E2F5BC733CDA_D4E0DC62478BA1B3_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC(=O)NC2CC2""",21,"""081BFB862396070F"""
+"""E637EAE2642B1B2B_B5ABE5C066FBCC62_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)NCC2CC2""",21,"""081BFB862396070F"""
+"""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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+"""5B138E6025D5B222_EB7C5FC20FC0FB5F_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=NC(=CS2)C#N""",21,"""081BFB862396070F"""
+"""0FCEA5F8825D67C9_E52B2A303E132857_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=C)C[S](=O)(=O)Cl""",21,"""081BFB862396070F"""
+"""EED962B59717D9B1_9B1017465D4A7163_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2CN2CC3CC3""",21,"""081BFB862396070F"""
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+"""2130B6B2087E195E_874C34FF346B6665_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(N=[S](C)(=O)C)=O""",21,"""081BFB862396070F"""
+"""629976400E831244_63F25CB8418AEE2E_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCN2CCOC2=O""",21,"""081BFB862396070F"""
+"""DC3890792AD17E91_8BEE5B6064750AEF_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCC2CCOC2""",21,"""081BFB862396070F"""
+"""204A3F38911FE3E1_2863E93A5CBA1B9B_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2CN2CC(C)C""",21,"""081BFB862396070F"""
+"""3BF2C9F34839E967_A6A909CF0191B6A0_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC(C)(C)C2CC2""",21,"""081BFB862396070F"""
+"""7322159C678A91AE_F07A265E953EEA4C_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCC2=NN=N[NH]2""",21,"""081BFB862396070F"""
+"""FB1A253EAFDEE197_02686BE1321E48EE_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC2=NOC(=N2)C""",21,"""081BFB862396070F"""
+"""54C082182A511F85_FDE4C7BB2C8BD7C5_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCOC2CC2(F)F""",21,"""081BFB862396070F"""
+"""22B4C6ED8D8C4004_0B8DAD1D35840356_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2CCC[S]2(=O)=O""",21,"""081BFB862396070F"""
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+"""C7818EE3C07C822F_C107E0104AA2D506_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)C2=CSN=C2""",21,"""081BFB862396070F"""
+"""0CC0FC67B44470F5_38B4D502B76C2B67_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)C2CCCO2""",21,"""081BFB862396070F"""
+"""E9E994CD7A1FBCA6_4C503F1477CB3F3D_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC[N]2N=CN=C2""",21,"""081BFB862396070F"""
+"""5C450BB68C7F06ED_4AEE289FC0C770A5_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=NN=C(C)C=C2""",21,"""081BFB862396070F"""
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+"""BD0B12FC55215EF7_88E787263EFF3E59_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCOCCC(C)=O""",21,"""081BFB862396070F"""
+"""94C404B6F2F0C0E0_1E53C14330626B4F_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2CN(C)CCO2""",21,"""081BFB862396070F"""
+"""C5CDF8058CB05CA3_5440EF5A70233D69_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCSC2CCOC2""",21,"""081BFB862396070F"""
+"""2052B55A75FA2D45_C6E3D28DC1A7710E_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCN(C)[S](=O)(=O)C""",21,"""081BFB862396070F"""
+"""C4A42912CD48D7B7_8D9F0AE147787304_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=NN=C(OC)S2""",21,"""081BFB862396070F"""
+"""7C24B9E235C957DE_0488EB1442A6C003_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=N[NH]C(=N2)CC""",21,"""081BFB862396070F"""
+"""EA3FC103B8AE5F44_2967F07519422017_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)NCCC#N""",21,"""081BFB862396070F"""
+"""ECAA11ED7F2198D5_3A9207DEE5094B12_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCCCC(O)=O""",21,"""081BFB862396070F"""
+"""3B71D8F431CFFD59_FE1A745B1EBFC6AD_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(NC(C)(C)C)=O""",21,"""081BFB862396070F"""
+"""FE9FDBCAEA559803_1CDF3864F46BCFA9_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=C(C)SC(=N2)C""",21,"""081BFB862396070F"""
+"""18E0BC650C849B3D_3D940BDE0D24BC9B_6039_DP""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(C2CCNC2)=O""",21,"""081BFB862396070F"""
+"""DF65826F21B52B09_E97B38A6A8B16C07_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=CC=N[N]2CC""",21,"""081BFB862396070F"""
+"""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"""
+"""0ECC9D5D01AF0EBA_7517EF6F30890533_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCC[N]2C=NN=N2""",21,"""081BFB862396070F"""
+"""83A865E97269D713_3B046D2828F2E33F_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC#CC2=CC=CS2""",21,"""081BFB862396070F"""
+"""51F0EA575B17196A_BE229F0D389A9938_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCCCCC(C)=O""",21,"""081BFB862396070F"""
+"""3A15E51FDA67846B_C22C0939C574E413_6039_DP""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=C(CN)OC=N2""",21,"""081BFB862396070F"""
+"""B7F7AADECF314462_29134DDF259B4737_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2CC[S](=O)(=O)N2""",21,"""081BFB862396070F"""
+"""7C03917927D26601_CC1C3C5A0BA882ED_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC#CCOC(C)=O""",21,"""081BFB862396070F"""
+"""4D361A4DAE35A8FD_C56B152CBC29FC3E_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)C2=COC=N2""",21,"""081BFB862396070F"""
+"""39743FE7A8FAE9F5_E1DD436F0C57E448_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=C(SC=C2)C#N""",21,"""081BFB862396070F"""
+"""44C8E1C71FF8F6C4_FC396E0C55616C26_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=C(F)C=CC=N2""",21,"""081BFB862396070F"""
+"""5E8BA11CB00CCA71_B13225B621CED7DE_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)C2=CC=CS2""",21,"""081BFB862396070F"""
+"""5EE8B06C78AC22A2_E37D74A239E43189_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)C2=CN=CO2""",21,"""081BFB862396070F"""
+"""370DD4B04ABE58D8_27419F842DD39764_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)C2=CSN=N2""",21,"""081BFB862396070F"""
+"""1F85569FE92C2864_1312905E736E61EC_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC(=O)C2=NOC=C2""",21,"""081BFB862396070F"""
+"""71C3936D6AB57AEC_407FF38417E8B232_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=NN=C[N]2CC""",21,"""081BFB862396070F"""
+"""4687292C6812A033_81843A44531CB043_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2=C(C)C=N[N]2C""",21,"""081BFB862396070F"""
+"""4EE1C23FF3A5BD67_DB32D59B39C10F65_6039_DP""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CCOCCC(O)=O""",21,"""081BFB862396070F"""
+"""AE6917E80E6EC41F_085BE843F536F5E3_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC#CC2=CC=NS2""",21,"""081BFB862396070F"""
+"""731E15BB0CE22B0F_0A05894BC1F0FE66_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2CCCCCO2""",21,"""081BFB862396070F"""
+"""F7E70CBBDAB6F1C9_000F56EB9E45E098_6039_UN""","""O(CC1=C(C=CC(=C1)F)OC(F)F)CC2CCC(C)(C)O2""",21,"""081BFB862396070F"""
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+"""A83B957FC0857AA7_869FDCEA4D2FAC05_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC3COCCO3""",21,"""4AC2EB6A93062D71"""
+"""B3B0FFE5D89956DB_80197D9BF616FCF5_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCC[S](C)(=O)=O""",21,"""4AC2EB6A93062D71"""
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+"""CF83421EBCFBC5B4_9894F7948D2EE805_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CC(C(CC)C)=O""",21,"""4AC2EB6A93062D71"""
+"""98888668A90B4437_0CAEF774CA5C2EB4_6039_UN""","""O(CC2=NC1=C(C=CC=C1C(=O)O)[NH]2)CCN[S](C)(=O)=O""",21,"""4AC2EB6A93062D71"""
+"""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"""
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+"""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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+"""DF122E95F41A20CA_848DEE69A01DDEC9_6039_DP""","""N2CCC(OCC1=C(OC)C=CC(=C1)[N](=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""E8F3BE500A345CB1_B4A97947EE46328D_6039_DP""","""N2CCC(OCCC(NC1=CC=C(F)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""567284B3E44259AD_117BD89E5B6AF4E0_6039_DP""","""N2CCC(OCC(C1=CC=C(CC(N)=O)S1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""BA48DA00C093EEB2_8B23FF1660BEB9F9_6039_DP""","""N2CCC(OCC(C1=C(OC)C=CC(=C1)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""458588265B6A948A_6DC5010E9A971F82_6039_DP""","""N2CCC(OCCCOC1=CC=C(OC)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""CDDF8D8E99840FB4_44930DCE507961BF_6039_DP""","""N1CCC(OCC(N(CCCC)CCCC)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
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+"""90646D692B65CBBA_4B749552C272660D_6039_DP""","""N1CCC(OCC(NC(NC(COC)C)=O)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
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+"""C2753EE40BF1994F_632663E0D6257A0B_6039_DP""","""N3CCC(OCC1=NOC(=C1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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+"""52C4D1C6B2DF7A1F_8EC2AAF3D9AAD72B_6039_DP""","""N3CCC(OCC1=NC(=NO1)C2=CN=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""A2E8B78E9CD9CBC5_297AB945A8CB9F5D_6039_DP""","""N2CCC(OCCCN1C(NC(C)(C)C1=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""11B90F7385353812_E128B2743F3A05DC_6039_DP""","""N2CCC(OCCOC1=CC=CC(=C1)[N](=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""D7CB669BDCC62643_30CEB9CE128C8EB2_6039_DP""","""N3CCC(OCC1=C[N](N=C1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""97D75C938A6B678D_B0B8E91E13FABFA6_6039_DP""","""N1CCC(OCC(NC(NCC(F)(F)F)=O)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""53DABAECD80A561A_547B36E521C53BA2_6039_DP""","""N2CCC(OCC(C1=C([N](CC)C(=C1)C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""D3AE87E8B5FFEB46_59B7430F67582F94_6039_DP""","""N2CCC(OCC(NCC1=C(F)C=CC=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""590703CC829A1717_FEF49280ADBCA362_6039_DP""","""N3CCC(OCC1=CN=C(S1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""C8B74C1FC70BABAE_9EE6891B2B92D30F_6039_DP""","""N2CCC(OCC(N(C)C1CC[S](=O)(=O)C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""F5D60F5A9DD772A4_1ED84F8CBB43F6E5_6039_DP""","""N2CCC(OCC(C1=CC=C(C(C)C)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""131D744B4FDCEC1D_ABAB5E67CDAA4CC1_6039_DP""","""N2CCC(OCC(=O)C(C#N)C1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""401EC8A4718E05E9_B27D456E3CB41C0D_6039_DP""","""N2CCC(OCC(NC1=CC(=CC(=C1)F)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""A5E168BEC1EBE784_C1C3828D3E0F657E_6039_DP""","""N2CCC(OCCCOCCC1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""8E18403CE6775E02_094F0871F6573916_6039_DP""","""N2CCC(OCC(C1=C[N](C)C(=C1)C(=O)N)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""E97C4AB972EACF6B_85324A41391BDF53_6039_DP""","""N3CCC(OCC(=O)NC1=NN=C(O1)C2CC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""6C3C33E4992EAC60_2AC1D17180BCE598_6039_DP""","""N3CCC(OCC1=CSC(=N1)C2CCCCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""A96495FDD1987F3F_96FC44D47E1FBBF5_6039_DP""","""N3CCC(OCC1=CSC(=N1)C2=CC=C(C)O2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""67ED634B4E35D44F_A22CB3D4B3FDB4EE_6039_DP""","""N2CCC(OCC1=CSC(=N1)CC(N(C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""237BDB4D86677A63_FF9E928283EF061D_6039_DP""","""N2CCC(OCC(NCC1=CC=CC(=C1)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""8353F14E414E18C1_62D01CDC35AB501A_6039_DP""","""N2CCC(OCC(N(C)CC1CCCCC1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""CFDAF8C6BADD47FA_49B2CD007677E487_6039_DP""","""N2CCC(OCC(=O)NCCC1CCCCC1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""293398D6F1D0E2A3_EE46677B2B411709_6039_DP""","""N2CCC(OCC(NCC1=CC=C(CC)S1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""0F985A5CBE81E5B2_B1C32845818A8699_6039_DP""","""N3CCC(OCC(=O)NC2=NC1=C(CCC1)S2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""6F78FE0BFDAFEDD5_CFB1677BB0179B6A_6039_DP""","""N3CCC(OCC(=O)N(C1CC1)C2CCCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""250D10B9DF359324_8FFDDAAA625CFE50_6039_DP""","""N2CCC(OCC(NC1=CC=N[N]1CCC)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""2C269F1F62AE1D70_3B0DD86D0A68400B_6039_DP""","""N2CCC(OCC(=O)NCC1CC[S](=O)(=O)C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""5A5F05A5FA5788B5_93C660EA42E57BE1_6039_DP""","""N2CCC(OCC1=CC=CC(=C1)C(N(C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""7163B7CB013E6910_25922C05B1EEF116_6039_DP""","""N3CCC(OCC2=NC1=C(C=N[N]1C)C(N2)=O)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""F1F41D038F851F11_B7BBF4E5D2ADB9E9_6039_DP""","""N2CCC(OCC(NC1=NC(=C(S1)C)CC)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""66BEBF7B5E84C282_97FF99ED1AA407FD_6039_DP""","""N2CCC(OCC1=CC=C([S](N(C)C)(=O)=O)O1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""033CF77171C72AB1_FB2B36C2BD4CFD94_6039_DP""","""N3CCC(OCC1=N[N](C=C1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""5F2399D888B6D106_F931FF1AB7AD06DA_6039_DP""","""N2CCC(OCCC1=CC=C([S](N)(=O)=O)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""57B19885DC19E1CD_EDBACD8977305EC6_6039_DP""","""N1CCC(OCC(NCCOCCC(C)C)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""FE26B309F2F29178_4041205617894A90_6039_DP""","""N3CCC(OCC(=O)C1=CC2=C(C=C1)CCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""87E8873CA0291026_C262ECBE44D3E52C_6039_DP""","""N2CCC(OCCOC(=O)NC1=CN=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""30DC9025F342272F_33F7D28FA2DA798E_6039_DP""","""N1CCC(OCCCN(CCCC)CCCC)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""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"""
+"""7F3E85CC868509E8_F85FE96AEA72C5E0_6039_DP""","""N3CCC(OCC1=C[N](N=N1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""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"""
+"""DAE18D85BDFED599_9E8837EE0F0ED1D5_6039_DP""","""N2CCC(OCC(C1=C(C)OC(=C1)C(=O)O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""35E69E6137D974CC_FF8BC9C8F7747CE0_6039_DP""","""N2CCC(OCC(=O)NCC(=O)C1=CC=CS1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""347423C7CA511F49_8814BFBC9449E58E_6039_DP""","""N2CCC(OCCCOC1=CC=C(C=C1)C#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""91DDDD0DE624F9B3_BFBD92A9B2450B9A_6039_DP""","""N2CCC(OCC(NCC1=CC=CC(=C1)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""41052186785319DF_98CD52C39F8EA04F_6039_DP""","""N2CCC(OCC1=NOC(=N1)CCC(OC)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""4F41BA289DA82461_92FBE5B748E61C8A_6039_DP""","""N3CCC(OCC1=CC(=NC2=C1C=CC=C2)C)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""EAD18A29C9A1CB0F_6422AAD232E6B8D1_6039_DP""","""N2CCC(OCC(NC1=C(C(=C(C)S1)C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""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"""
+"""81A7697F99EAF2E4_3989ED0BEF785E50_6039_DP""","""N2CCC(OCCCOC1=CC(=CC=C1)C#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""779E80C33217BEE9_567A9F6584B876A6_6039_DP""","""N2CCC(OCC(NC1=NN=C(C(C)C)S1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""4CF8CB568D7F1042_C21E029339077D7E_6039_DP""","""N3CCC(OCC2=C[N]1C=CC=CC1=C2C#N)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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+"""3E19D9837F3789C5_A88F287162249AE6_6039_DP""","""N3CCC(OCC(=O)C1=C[NH]C2=C1C=CC=N2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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+"""B0DA88F28C0FB05F_7D31C1F6681162B2_6039_DP""","""N2CCC(OCC(=O)NCCC1=CCCCC1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""95D46634B423175C_71A548E4271D96C0_6039_DP""","""N2CCC(OCC1=COC(=C1)[S](N(C)C)(=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""63F5A85372958108_B47FBA9EBE6FC5C1_6039_DP""","""N3CCC(OCC1=CC(=CC=C1)[N]2N=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""BD8F4E20E91E1CEB_5640EBD6325F49BF_6039_DP""","""N3CCC(OCCC1=CC2=C(C=C1)OCCO2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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+"""A99026FF5E7CB05C_8315F1966874DBE2_6039_DP""","""N2CCC(OCC(=O)NC1=CC(=CC=C1)C#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""092E3FCF6942EB3A_3A3CD0AA902B5949_6039_DP""","""N2CCC(OCC(NC1=C(C=CC(=C1)C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""F35691A8A97F1697_DFE93910E9DBF8BA_6039_DP""","""N2CCC(OCC(NC1=CC(=CC(=C1)C)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""025B4D3CB38DDECA_865F45FE44234B3C_6039_DP""","""N2CCC(OCC(NC1=CC(=C(C)C=C1)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""EEC9029050F44ABB_D19B73D5F4792227_6039_DP""","""N2CCC(OCCCC(C1=CC=C(F)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""BB77D668F90BB149_DA3E51F5E0E8636A_6039_DP""","""N2CCC(OCCOC(=O)NC1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""12344A6A5C2CC24B_D4D0E504E4CADD38_6039_DP""","""N2CCC(OCC1=C(C=CC(=C1)C(OC)=O)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""894A6098DD598AF3_213A2A51DA278030_6039_DP""","""N2CCC(OCC(NC1=C(CC)C=CC=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""F3FA07CB45305E14_428297EE77C9D391_6039_DP""","""N4CCC(OCC2=NN=C(C1CC1)[N]2C3CC3)C45CCC5""",21,"""20C70AFE40B0D0A8"""
+"""BB448111A2D92C68_47E532080A9A464B_6039_DP""","""N3CCC(OCC1=NN=C(S1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""93413C1B6DE5C911_F8C29FEC9AA7585B_6039_DP""","""N2CCC(OCC1=CC(=NC=C1)OCCOC)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""43DF5BCC4F78204D_81C69DE4378B062C_6039_DP""","""N2CCC(OCCC1=C(C(OC)=O)C=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""4DA9EC9F9A4409CC_F8F1ED93416D9067_6039_DP""","""N3CCC(OCC(=O)N1CCC2=C1C=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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+"""D600FA21298B91DC_2E50B4CB29AD62B8_6039_DP""","""N2CCC(OCC1=CC=C(C(C)(C)C#N)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""6C6422F7617FB8E3_D6711914CA76C82C_6039_DP""","""N2CCC(OCC(NC1=CC(=C(F)C=C1)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""8DEED6AEA7E727A2_83D20E684B6F90F7_6039_DP""","""N2CCC(OCC(CC1=CC=C(OC)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""D97B2E04B26762B5_C42B99666EC984F3_6039_DP""","""N2CCC(OCC(C1=CC=C([N](=O)=O)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""18226409A11F86E7_AAB59BE041D224A6_6039_DP""","""N2CCC(OCCC[S](=O)(=O)C1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""1306180262234AED_95ECEA12353D40F1_6039_DP""","""N3CCC(OCC1=CC(=NO1)C2=C[N](C)N=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""46DA3F13B8DC62BF_A5DEDBE44E40D7AA_6039_DP""","""N2CCC(OCCCN1CCN(C(C)C)CC1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""F86A0BA0EF20BA1A_095E98E1C2E8D464_6039_DP""","""N2CCC(OCC1=CC=C(C(C)C(=O)O)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""170CE1A75901A967_CE98FEB55B89A56E_6039_DP""","""N2CCC(OCC1=C(C(OCC)=O)C=NC=N1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""0C87A653616F13B0_214B66DC7397AA21_6039_DP""","""N3CCC(OCC1=CC=C(C=C1)C2=CC=CS2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""7067113BE188E772_B02F8FE5C68280EC_6039_DP""","""N3CCC(OCC1=CC=C(C=C1)OCC2CC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""FDE791AA8921D1CF_ED09A4785C118822_6039_DP""","""N3CCC(OCC1=NC=C[N]1C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""A2B74CB0CE3BC12F_DD73F0E448023CE5_6039_DP""","""N3CCC(OCC1=NC(=CS1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""FE92F147DD0D5FE2_B6E4B98CD80D1DE0_6039_DP""","""N3CCC(OCC1=NC(=CS1)C2CCCCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""8EEAC3EBC4C7EB36_9FD0E3E8E0EA3919_6039_DP""","""N3CCC(OCCCC2=NC1=C(C=CC=C1)[NH]2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""6ADC612847F403F9_A7057577A9A16211_6039_DP""","""N2CCC(OCCCC1=N[N](C)C=C1C(=O)O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""A897FD04DC279924_466F7E8BD48C666B_6039_DP""","""N3CCC(OCC1=NN=N[N]1C2CCOCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""61CAFC5F67606DCE_CBDEED34932B54FC_6039_DP""","""N2CCC(OCC(N(C)CC1=CC=CC=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""673FF76BDBDD3101_011EB714FB9D5403_6039_DP""","""N2CCC(OCC[S](=O)(=O)CC1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""59A9AE27B784C64D_124730398E208482_6039_DP""","""N3CCC(OCC(=O)C1(CC1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""AE8C1D9605A75768_637C0345B83F3EEC_6039_DP""","""N3CCC(OCC1=NC(=N[NH]1)C2=NC=NC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""9F0BB7616C99AE84_C7856AAB8E3045E6_6039_DP""","""N2CCC(OCCCB1OC(C)(C)C(O1)(C)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""70753269F0547B3C_AD1D83A63E226498_6039_DP""","""N2CCC(OCC(C1=CC=C(CCC)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""29D169FE489682B3_15A9DC60344CACB0_6039_DP""","""N2CCC(OCC1=CC=C(C(CC)(C)C)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""00947B2C3319F0F1_F4BD23E5E7808AB4_6039_DP""","""N3CCC(OCC2=CC1=C(OC(F)(F)O1)C=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""566DF306AF3D7310_D72D30C5A149DDDE_6039_DP""","""N1CCC(OCC(C(CC)(CC)C(=O)OC)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""47C2E74E51B67B6C_EFB227B6467F615C_6039_DP""","""N2CCC(OCC1=CC=CC(=C1)OCC(C)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""33773234C49E47E0_A8D4A81F9F8DBDB5_6039_DP""","""N2CCC(OCCC(C1=CC=C(OC)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""0D6E11E194D4BFA7_DB4DE4AEB192A329_6039_DP""","""N1CCC(OCC(N[C@H](C(OC)=O)C(C)C)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""3867CBFB6671CEB2_F78FA22B75D22FE6_6039_DP""","""N3CCC(OCC1=CN=N[N]1C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""0BF5CF28A69D5DD6_9AFF9528D013295E_6039_DP""","""N2CCC(OCC1=N[NH]C(=C1C(OCC)=O)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""C37A95E4286A84DC_790FA356501B9291_6039_DP""","""N2CCC(OCC1=NOC(=C1C(OCC)=O)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""9E0F390B28835D27_C6D5337C6DD8F273_6039_DP""","""N2CCC(OCC1=C([N](=O)=O)C=CC=C1C#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""D6883515A98E3B03_4083AFD7B4F76E3E_6039_DP""","""N3CCC(OCC2=C1N=CC=CC1=C(F)C=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""AF4139423F90A7E1_D693A0539882F44E_6039_DP""","""N2CCC(OCCCOC1=C(C)C=CC=C1C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""3935D235BFC3434D_F363C3E91B4DB713_6039_DP""","""N2CCC(OCC(N(C)CC1=C[N](N=C1)C)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""FF4E308833565872_3AA54C50F16E42DA_6039_DP""","""N1CCC(OCC(N(C(C)C)CC(F)(F)F)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""C1857AA444BFD67F_1C701E74475F6D8D_6039_DP""","""N1CCC(OCC(NC(CCCCCC)C)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
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+"""65DACE8A8DEE900D_9E911435216A3644_6039_DP""","""N2CCC(OCC1=C(OC)C=C(C=C1)[N](=O)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""F18DCA06DDC2A09E_147C0D829ADB674C_6039_DP""","""N3CCC(OCC1=CC=C(C=C1)N2CCCC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""7E63E86E336D7876_8649BD1D72AD212C_6039_DP""","""N2CCC(OCC(C1=CC=C(C(OC)=O)O1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""CAB05512CB51B65E_A59A7A85206E948A_6039_DP""","""N2CCC(OCC(C(C1=NC(=CS1)C)C#N)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""08F8E78E451E52C6_F9B3118C4110EBA0_6039_DP""","""N3CCC(OCC(=O)NC1=NC(=NO1)C2CC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""D7D35040DB0BC717_47B4F5662F899A9E_6039_DP""","""N2CCC(OCCC(NC1=C(F)C=CC=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""518798B3C7F3D326_C6896DB87029D5A5_6039_DP""","""N3CCC(OCC1=NC(=NO1)C2=NC=NC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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+"""DBC17CC05767803B_95397A336EF8C2C6_6039_DP""","""N1CCC(OCC(NCC(NC(C)(C)C)=O)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""70DE4D7DA29254F3_A7B42A29CA6E8625_6039_DP""","""N1CCC(OCCCCCCCCCC(O)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""7FA2DEDF59A6B44C_9DA9D83A3B681CEC_6039_DP""","""N2CCC(OCCC(C1=C(C=C(F)C=C1)F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""4016E1846860253F_8EB8AA2E100A49AF_6039_DP""","""N2CCC(OCC1=C(C(=C(F)C(=C1F)F)F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""FE14DB556378F857_CA5CAC1F6CCA2217_6039_DP""","""N3CCC(OCC2=NC1=C(C=CC=C1)NC2=O)C34CCC4""",21,"""20C70AFE40B0D0A8"""
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+"""390994E278259A75_3F1433B23CC9CF56_6039_DP""","""N3CCC(OCC1=NC(=CS1)C2=CN=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""C030B85263336543_1864F9B3A8B38811_6039_DP""","""N2CCC(OCC(=O)CC1=CC=C(C=C1)C#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""343F7D44173C2058_DC437F8288E4AFD9_6039_DP""","""N1CCC(OCC(N[C@@H]([C@H](CC)C)C(=O)O)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""8598E0E5C4F59B1D_1A727987E5D4F014_6039_DP""","""N1CCC(OCC(N[C@H](CC(C)C)C(=O)O)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""A1D9C35247C667EB_8EF5BD338F16EA32_6039_DP""","""N3CCC(OCC2=CC1=C(C=CC(=C1)C)N=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""804F29DE1A172E5B_828BE1F2539443F6_6039_DP""","""N2CCC(OCC(NC1=C(F)C=CC=C1F)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""64307FE065E5D5E9_EF7D75F5592156D6_6039_DP""","""N2CCC(OCC1=CC=CC(=C1)OC(F)(F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""7EE5BAE9E5693D91_5C40E946A8EE218E_6039_DP""","""N2CCC(OCCC=CC1=CN=CC(=C1)OC)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""B650E4E2709213F0_F816E4A1A9EF6B59_6039_DP""","""N2CCC(OCCOC(CC)C1=CC=CC=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""D5EE6EE354B25F8D_A128C5F0E8DE1195_6039_DP""","""N2CCC(OCC1=CC=C([S](N(C)C)(=O)=O)S1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""9B9592962CA2C5D5_E25753547B24FD92_6039_DP""","""N2CCC(OCC1=C([N](=O)=O)C=C(C=C1)C#N)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""22D681C8B98ADD63_A111B1FF1DCC0894_6039_DP""","""N2CCC(OCC1=C(OC)C=CC(=C1)C(C)C)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""DA6CD40E372E4228_B9F369DA134C0768_6039_DP""","""N2CCC(OCC1=CN=C([N]1C)SC(F)(F)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
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+"""B38BC170D1007A98_C73C7B9599BB396F_6039_DP""","""N2CCC(OCC1=CC=C(C[S](C)(=O)=O)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""076144EA03B23D6C_DC0D9FF4EE19C2DB_6039_DP""","""N2CCC(OCC1=C(OC(F)F)C(=CC=C1)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""1C8C856D312566D6_C9B61278A5D28E7E_6039_DP""","""N3CCC(OCC1=CC=CC2=C1OC(F)(F)O2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""DA98FB6E7531BE6B_A9C45EEAF2507F67_6039_DP""","""N2CCC(OCCOCCN1C(=O)CSC1=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""16162B86F820FB2E_569C0D6D26C7236E_6039_DP""","""N3CCC(OCC2CN=C(C1=C[N](C)N=C1)O2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""7E4CAE84AA119CF0_19F8CF25BE0C139A_6039_DP""","""N2CCC(OCC(COC1=CC=C(F)C=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""1716BD9995668F07_948DA291977098A4_6039_DP""","""N3CCC(OCC2=NC1=C(C=CC=C1)C(=O)N2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""1334D3B58300D4D7_781FC71CEC754035_6039_DP""","""N3CCC(OCC1=NC(=NO1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""4E48D62D4B392655_E0E8216AC4D69CDF_6039_DP""","""N2CCC(OCC1=CC=C([S](NC)(=O)=O)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""288AD28BCBA69C51_70425DF55B6F6454_6039_DP""","""N3CCC(OCC1=NN=C(O1)C2CCCOC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""C0C3824F52AD5827_652ACD28B8F6965D_6039_DP""","""N2CCC(OCC(N[C@H](C)C1=CC=CC=C1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""F556AB1E34F9CDBC_FF728DF60DB011AC_6039_DP""","""N3CCC(OCC1=CN=C(O1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""E2451A13E60039E6_ED7A2CA0BE27C778_6039_DP""","""N1CCC(OCC(CCNC(C(F)(F)F)=O)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""823B8033CCA5F6F4_F87204BCB7A9EC49_6039_DP""","""N1CCC(OCC(N(CCC)CC(F)(F)F)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""C0649A1143DDB6CB_6259AF3DC2EB768D_6039_DP""","""N2CCC(OCC(C1=CC=C(C(OC)=O)S1)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""23150575B19E4F0E_A9462AC38C910AA8_6039_DP""","""N2CCC(OCCN(C)CC1=CC=C(C=C1)F)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""77AE7CD59F611CA4_3AA66EC4E0DF0D6A_6039_DP""","""N3CCC(OCC2=CC1=C(OC(N1C)=O)C=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""73E0C4414DCD4DEC_308535F1E8EF18BA_6039_DP""","""N2CCC(OCC1=CC=CC(=N1)C(OCC)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""35A955EF4DDFBF5D_FDA67BA5CCF14304_6039_DP""","""N3CCC(OCC1=COC(=N1)C2=NC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""C2C61A1A7FF74AA8_13E74AB627CC2CEC_6039_DP""","""N3CCC(OCC1=COC(=N1)C2=CC=NC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""DB98EB7155A4718A_9782B132370209AA_6039_DP""","""N3CCC(OCC1=NC(=NO1)C2=CN=C[N]2C)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""08FF760159822369_451234F3451265D6_6039_DP""","""N3CCC(OCC2=NC1=C(COCC1)C(=O)N2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""40D0FF6BA7D64A6D_4D47ACB7A6BDF5AC_6039_DP""","""N3CCC(OCC1=CNC(=O)C2=C1C=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""5ABEA26DA654E4B2_0374D24C37B6A758_6039_DP""","""N3CCC(OCC1=NOC2=C1CC(C)(C)CC2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""A28057174B13E77E_95C14449595637AB_6039_DP""","""N3CCC(OCC1=CSC(=N1)C2=N[N](C)C=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""11846EF6532E07AF_63EEA7350463E281_6039_DP""","""N3CCC(OCC1=NN=C2[N]1C=CN(C)C2=O)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""36C06EEEBFB48859_DF769A73087BE181_6039_DP""","""N3CCC(OCC2CCC1(CCOCC1)CO2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""99EEA6C93C989B78_DDDDEA3431C1FEE0_6039_DP""","""N3CCC(OCC2OC1=C(C=C(OC)C=C1)C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""5550D639FB826D6A_8F8FB89245FB8426_6039_DP""","""N2CCC(OCC(NC1=CC=CC(=C1)CC)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""789864D30ED3BC2C_669644F0205909E9_6039_DP""","""N2CCC(OCC(NC1=CC=CC(=C1)SC)=O)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""780458C9DAEC50B4_F62349FAACAF86EB_6039_DP""","""N1CCC(OCCCC[S](NC(C)(C)C)(=O)=O)C12CCC2""",21,"""20C70AFE40B0D0A8"""
+"""E76D8ED988C12FC0_B77F7D8DD07360FB_6039_DP""","""N2CCC(OCC1=CC=C(C(N(C)C)=O)C=C1)C23CCC3""",21,"""20C70AFE40B0D0A8"""
+"""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"""
+"""DA77F57D23E36F46_23AD1C2A0C63AFBC_6039_DP""","""N3CCC(OCC1CCC(O1)C2=CC=CC=C2)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""5CFAB869494454EC_43BBEE820ABCCF7B_6039_DP""","""N3CCC(OCC1=C[N]2C(=N1)N=C(C)C=C2C)C34CCC4""",21,"""20C70AFE40B0D0A8"""
+"""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"""
+"""3004DF2E3CE67AF1_C903EEABC2C2622D_6039_UN""","""CC(C)(COCC1=NC(=N)NC(=N1)N(C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""FD903FADCB2958C1_1E3E742414BFCA29_6039_UN""","""CC(C)(COCC(NC(C)C1=CC=CS1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""9B9EEEE26EDFE26D_E4372B5E880CCDDC_6039_UN""","""CC(C)(COCC(C1=CC=C(CC)C=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D0E68718FB995864_5487B76DDD22D200_6039_UN""","""CC(C)(COCC(=O)NC(=O)C1=CC=CS1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""3DBA2050D6D0D7EF_9A7E550E2A3C9AC8_6039_UN""","""CC(C)(COCC1=NOC(=N1)C2=CC=CO2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""F64DB227F7BC5641_253DA746BD38788D_6039_UN""","""CC(C)(COCCC(=O)NC1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""239C27D9880BAC23_1946FCFA2CE31D19_6039_UN""","""CC(C)(COCC(=O)OCC1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8C96F370658B5090_4E2DEF1FB72AD369_6039_UN""","""CC(C)(COCC(NCCCC(OC)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""867D17A33E859F81_178968C5B25540E0_6039_UN""","""CC(C)(COCC1=CC=C(C(C)(C)C)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""7E9B4DF11F511FF9_C3F50E43CEFF9DCD_6039_UN""","""CC(C)(COCC(C1=C(F)C=CC=C1F)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""BBA08B30B4C1863A_D210532A1CB0E41F_6039_UN""","""CC(C)(COCC(NC(C(C)C)C(=O)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""ECF6D63046B01BB6_DE4E61BB9C93539E_6039_UN""","""CC(C)(COCC1OCCN(CC(C)C)C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""F1C89CB395C13524_C769F66AABDD58ED_6039_UN""","""CC(C)(COCC1=NOC(=C1)C2=CC=CO2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""65A3256AA15EB1A9_0E449955D517312C_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)OC(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8ACBA797B4F0FF11_BFDC504F2F87AFBA_6039_UN""","""CC(C)(COCC1=CC=C(C(OCC)=O)O1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""0CE980F573248C3E_B1EFED6676F42179_6039_UN""","""CC(C)(COCCOC1=C(OC)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""345EEFE885061280_BCD9042C319F2FD4_6039_UN""","""CC(C)(COCC(=O)NNC1=NC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""3655305512CBB876_45155239732FF9FD_6039_UN""","""CC(C)(COCC(N=C1N=C(SC)NS1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""683FB109E76E434A_AD4C20D6E32C88D2_6039_UN""","""CC(C)(COCC1=CC=CC(=C1C)[N](=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""ED3F275A2FFD9F3F_0F1FA6A5A969D31B_6039_UN""","""CC(C)(COCC(=O)NC1(CCCC1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""B0CCB2F878FBB13E_73A8B4C636855866_6039_UN""","""CC(C)(COCC1=NC=C(C(=C1C)OC)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""90FF93FE4CD4985D_47590CFEA69BF2B3_6039_UN""","""CC(C)(COCC1=CC(=C(C(OC)=O)O1)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8730C9DB8D787A6F_3D8BC29F0E504D56_6039_UN""","""CC(C)(COCCSC1=CC(=C(C)C=C1)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""C1CF41545E643732_4FB425278D793C33_6039_UN""","""CC(C)(COCC(=O)NC(=O)C1=CC=CO1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D6D7BD386A539387_B61B0120642B2EE3_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)OC(C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""03BB49597980D2FA_6C3366CBD531DC9C_6039_UN""","""CC(C)(COCC(NCC1=C(C)C=CS1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""A980A5B757782940_96BD9B14945D8E14_6039_UN""","""CC(C)(COCC(NCC1=CC=C(C)S1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""67270F791AF0ACBB_0F2FDC8300B61715_6039_UN""","""CC(C)(COCC(N(CC(C)C)C1CC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8762EBF21D85EFCC_386EEE9FD851730C_6039_UN""","""CC(C)(COCC(N(CC)CC(C)C#N)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""C1A86C900C81535B_625FE93144C8244F_6039_UN""","""CC(C)(COCC(=O)NCCC1=CSC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8990D1915CF3FE36_175160D74E229B3F_6039_UN""","""CC(C)(COCC(NC(C)C(=O)N(C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D07BDEB08AE79F36_FE4FA9D5895AECF0_6039_UN""","""CC(C)(COCCNC(OCC(F)(F)F)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""6C05F3EBACE35828_9FF017FF14F507A6_6039_UN""","""CC(C)(COCC1=C(C(OC)=O)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""3A55F5FBD15A1B9D_CB388421AEC0B633_6039_UN""","""CC(C)(COCC1=CSC(=N1)CCC(C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8F2C106B6736E597_54B6472F1505675E_6039_UN""","""CC(C)(COCC1=CSC(=N1)N(C)C(=O)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""92447654EDB34E32_9895F21E5E06D0FE_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)OCCO2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""75F50A967500FE5A_7694C215D57B09D6_6039_UN""","""CC(C)(COCC1=C(OC(C)C)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""FA18D6279056FF21_0D10F494ECDF102E_6039_UN""","""CC(C)(COCC1=NC2=C([N]1C)C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""5108E0828AF2E0BA_EAAA83ED4D6D0EEF_6039_UN""","""CC(C)(COCC1=CC=C(CC(C)C)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""2506DE7EE2C2925B_EAD301E1F21339AF_6039_UN""","""CC(C)(COCC1=CSC(=N1)C2=CSC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""BB70F307440E54E8_9258AE0DF7349296_6039_UN""","""CC(C)(COCC2=NC1=C(F)C=CC=C1[NH]2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""EFA85A043D6760CA_DB362C01B8AC1C2B_6039_UN""","""CC(C)(COCC(C1=CC(=CO1)C(O)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""5E3777BA495C3076_DB89EEBCADB9CCE4_6039_UN""","""CC(C)(COCC(C1=CC(=CO1)C(N)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""814476878E21F5A4_81F8ED6DF2EA1501_6039_UN""","""CC(C)(COCCCCC[N]1C=C(C)C=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""B11CE75DBCB2A944_165B0F77CF666986_6039_UN""","""CC(C)(COCCC(N(CC(OC)=O)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""786AF74AFCF3E409_F720A5C54242D27F_6039_UN""","""CC(C)(COCCC[N]1N=C([N](=O)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""40E9E613AE5C8B6F_A026FAA6B6591B36_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2=COC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""07982DCE4CD60534_0772DDCC9E44879B_6039_UN""","""CC(C)(COCC1=CSC(=N1)C2=COC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8C11D07DFDFF47A6_C86C1EB16865FC28_6039_UN""","""CC(C)(COCC2=C[N]1C(=CC=CC1=N2)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""9D4183E04A5D2EE8_171ADB2D202F6DE3_6039_UN""","""CC(C)(COCC(C1=CC(=CS1)C(C)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""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"""
+"""284922D08094D51A_2F728D0F3FFEB3C6_6039_UN""","""CC(C)(COCC(N(CC(OCC)=O)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""73449E269B45E88F_B39064AB630CFC36_6039_UN""","""CC(C)(COCC1=CC(=C(C=C1)SC)OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""797129EDC4632135_5FEDF10B6C023EBD_6039_UN""","""CC(C)(COCC1OCCC2=C1C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""7DE8193797AB3E88_E54BD76EDC8577CF_6039_UN""","""CC(C)(COCC1=CSC(=N1)C(OCC)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""CA638E31D7BC2116_3C1F85D81D358850_6039_UN""","""CC(C)(COCC1=N[N](C(CC)CC)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""612CE1B087B55595_DF0C96D413446D9C_6039_UN""","""CC(C)(COCCCC1=CC=CC(=C1)OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""DA4A016966955075_762B072334A934FB_6039_UN""","""CC(C)(COCCC1=CC2=C(C=C1)OCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""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"""
+"""44ED6B63271D5AB3_4FA511EBEA4E5EAE_6039_UN""","""CC(C)(COCCC1=CC=C(C(O)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""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"""
+"""EAC8A92D1C29836C_B137A9BEA4C70F18_6039_UN""","""CC(C)(COCC2=NC1=C(SC=C1)C(=O)N2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""7DFAD8018688A7AD_800B35792F1BDD59_6039_UN""","""CC(C)(COCC(=O)NCCC1=CC=CS1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""6C715101CAABC419_5CD4391953628B4F_6039_UN""","""CC(C)(COCCN1C(NC(C)(C)C1=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""9D0563EE03FEC293_C7FAE3C3CA67A69B_6039_UN""","""CC(C)(COCC(NC(C)(C#N)C1CC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""798D43C011821F4D_62D7609DC601EB71_6039_UN""","""CC(C)(COCC2=NC1=C(C=CC(=C1)F)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""508D741150D7F7C0_01714502FAFB8D76_6039_UN""","""CC(C)(COCC(NC(C(C)C)(C)C#N)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""457B230B3E4E0816_7CC4A806A4070969_6039_UN""","""CC(C)(COCC1=C([N](=O)=O)C=CC(=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""A3184DC6823D320E_FDB4BF4989E4B4B9_6039_UN""","""CC(C)(COCC1=CSC(=N1)CC(NC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""826681FA1A34E407_257D25EDB45CCF9C_6039_UN""","""CC(C)(COCC1=CC=C(N(CC)C)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D8638FF258CD7AA0_9E6460B535C3E136_6039_UN""","""CC(C)(COCC1=CSC(=N1)N(C)C2CC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""A4D593C558BAE0CA_D79A0888CEA959D8_6039_UN""","""CC(C)(COCC1=NC(=N[NH]1)C2=CC=CS2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""6F87BA9AAE2D5FE8_7D4FDCC9B572AD5F_6039_UN""","""CC(C)(COCC1=C(C)SC(=C1)C(OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D561683D732B93F4_C4FAFC4E9B972CD5_6039_UN""","""CC(C)(COCC(=O)NNC(=O)C1CCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""4AC50F1CFDBA630B_E2C17C4FC062EDC3_6039_UN""","""CC(C)(COCCCOCC1CCCCO1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""F78038739FF7DF70_FC39EB297D96DE7E_6039_UN""","""CC(C)(COCC1=C(C=C([N](=O)=O)C=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""83D8F3B72F2C30D2_EB15EC5057542F3C_6039_UN""","""CC(C)(COCC1=C(OC)C=C(C=C1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""BA58843E8B76E750_61E87560A5FC17A5_6039_UN""","""CC(C)(COCC1=CSC(=N1)C2CCCO2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""F56D7F20A45C2E28_3C08AD94FF583A20_6039_UN""","""CC(C)(COCC(=O)NCC1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""C3A06ABFEF61DBA9_980A971B35B94EE4_6039_UN""","""CC(C)(COCCCCCN1CCCCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""0C0142DDBA30CF60_253A453E96EE5483_6039_UN""","""CC(C)(COCC1OC(=C(C(OC)=O)C1)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""2F606BF07B9E3F19_E3D17F9A5B0BF82E_6039_UN""","""CC(C)(COCC1=C(ON=C1)C2=CC=CO2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""781080441B362236_B0CEB5FEBC1899CF_6039_UN""","""CC(C)(COCC1=C2C(=CN=C1)C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D87DA4A11961CB51_C5756DFF7CB4479C_6039_UN""","""CC(C)(COCC(N(C)C1=CC=CC=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""7BAF011783C1A64D_165D8A2E1D577E1C_6039_UN""","""CC(C)(COCC(NC1=CC=C(C)C=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D87D20DBB49948F2_E6E8CAD96161F13C_6039_UN""","""CC(C)(COCC(NC1=C(F)C=CC=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""CF19320CC4C73214_3ABA75689BD9B6DC_6039_UN""","""CC(C)(COCC(NC1=CC=C(F)C=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""BAA84E70574F8EFC_13B8F43CD1ACF41A_6039_UN""","""CC(C)(COCCC(C1=CC=C(C)C=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""A98F30E0DAED53D4_039EF775D701FC29_6039_UN""","""CC(C)(COCCCOCC1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""DCF955DC1F28F1CD_8FBC9223AB46F5CE_6039_UN""","""CC(C)(COCC(N1CC(C)OC(C1)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""111216CE2F283081_7B9059620017ED0D_6039_UN""","""CC(C)(COCC(NC1=CC=CC(=C1)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""0E47FF38BA910CA6_ED17A5253BC36FA1_6039_UN""","""CC(C)(COCC1=CC=C(SC(C)C)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D566E1CA880BED96_0006E06F1F689DEC_6039_UN""","""CC(C)(COCC(C1=C(C=CC(=C1)F)F)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""06E24EDA685E1C5F_2365D55169635DE0_6039_UN""","""CC(C)(COCC1=NN=C([N]1C)C2CCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""9DE94EFB6164A788_9C40F1D52382A482_6039_UN""","""CC(C)(COCC(NC1=C(C)C=CC=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""E9683C2B897546C5_6C86527870F8B7A4_6039_UN""","""CC(C)(COCC(NC(C(C)C)C(=O)O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""AA5448C7DE22ADF9_8E5FB986129C4A5C_6039_UN""","""CC(C)(COCC2=NC1=C(C)C=CN=C1[NH]2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""94760F685C335B8B_9507AB62DA4E377E_6039_UN""","""CC(C)(COCC1=C(N=C(C)S1)C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""BA0E957B2BAEF936_AB02CC161376CDB1_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)[NH]C(=N2)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""168EC05CC6BDFC0A_7C93345BBE6801C6_6039_UN""","""CC(C)(COCC[N]1C=C(C(OC)=O)N=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""A4FAF1F9777BF365_C42CD85E4EDF2B76_6039_UN""","""CC(C)(COCC(NC1=CC=CC(=C1)F)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""3FA222BCBD2648B0_A6BC0FB70554F887_6039_UN""","""CC(C)(COCC(C1=CC=CC(=C1)OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""4B3BD6741290B549_787DC2DB03435F5A_6039_UN""","""CC(C)(COCC(NC1CCCCC1C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8B3527240CEFD87F_16615F4246F278F8_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)N=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8C158A30105F8177_0EDF06E18B8374C7_6039_UN""","""CC(C)(COCC(N1C(CCCC1C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""45567977FD7D6F65_D5BF0CBC93013370_6039_UN""","""CC(C)(COCCC2COC1(CCCC1)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""3966D74CB447CB2F_EF80E37D2CFB9D79_6039_UN""","""CC(C)(COCC1=CC(=C([N](=O)=O)C=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""CDF2CBB8F25DDF7C_25BD4D3D4BF2F31C_6039_UN""","""CC(C)(COCC1=CC=C(C(NC)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""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"""
+"""E1FB1D8ADED217B5_5F65A6C8B97019BE_6039_UN""","""CC(C)(COCC1=N[N](CC(F)(F)F)N=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""62F1A45C5FFA511B_EDFE9E88E4307562_6039_UN""","""CC(C)(COCC1=CC=C(C=C1)C2CCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""AEDC48E790CFBB82_658769D9EADB23ED_6039_UN""","""CC(C)(COCC1=NN=C2[N]1CCCCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""7E952E1A75F2BF83_48F73DE7C63B7141_6039_UN""","""CC(C)(COCC1=CC=CC(=N1)C(OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""1C1E2A5B13EE1FDD_BB80CF06A030315A_6039_UN""","""CC(C)(COCC1=C([S](N)(=O)=O)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""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"""
+"""B680E74423A5D604_55E59BC5CC0D2DB0_6039_UN""","""CC(C)(COCCC(CC)(CC)C(=O)OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""375FF9DA6DC96A47_C592D8F42DF4015D_6039_UN""","""CC(C)(COCC(C1=C(OC)N=CC=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""FB1EC924C5584554_F58ACF515B6FA829_6039_UN""","""CC(C)(COCC(C1=C(C=C(C)C=C1)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""AE98CAE6DF0A652B_2AA7600565891B4A_6039_UN""","""CC(C)(COCC1=CC(=C(N(C)C)C=C1)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8BC000948D0B37A8_92DDE15BA71F82E4_6039_DP""","""CC(C)(COCC(NCC1CCCNC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""457FC8545F83936A_1CDDD2D4AC6D9A41_6039_UN""","""CC(C)(COCC1=CC(=N[N]1C)C(OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""61DA66C1E2BFCFF7_21D70D3771273275_6039_UN""","""CC(C)(COCCOCC(C(F)(F)F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""ED0FAE2AD7A868EE_379C75CC8666AA8A_6039_UN""","""CC(C)(COCCCC1=C(OC)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""9D3E0ACE271F4A6C_430A70DE0F7ED4DF_6039_UN""","""CC(C)(COCC1=C(C(OC)=O)C=CC=N1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""02816DAE83A055A2_DE0EA0CCDFDB6B3D_6039_UN""","""CC(C)(COCC1=NC(=CC(=N1)N(C)C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""A3C69C3665F84AB2_007954A85251A7A4_6039_UN""","""CC(C)(COCC(N(C)CC1=CC=CS1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""F98470C5AEF030E1_3B002F1C4C88E36E_6039_UN""","""CC(C)(COCC1=NC(=NO1)C(OCC)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""730D921F4CFE9D36_A5683A2AF6BFDFDD_6039_UN""","""CC(C)(COCC1=NC(=NO1)CC(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""55C7919D878F04F5_04E1A938266AFFC0_6039_UN""","""CC(C)(COCC(=O)C1=CC(=CC=C1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""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"""
+"""F57C8A435EBC2169_AA48AB4CEB21622F_6039_UN""","""CC(C)(COCCCCOC1CCCCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""CD6C1CF264F041AF_2654CB0B177C9968_6039_UN""","""CC(C)(COCC1=CC(=C(OC)C=C1)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""E1D736BB93DC57F6_1B6A5B4EFCA48127_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)NC(C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""AC333D7E46F3F60F_3306522E15FD8ED2_6039_UN""","""CC(C)(COCC1=CC=C(OC(F)F)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""B3169A9C7630BA10_06F5D120CB5995D5_6039_UN""","""CC(C)(COCC(C1=NC=C[N]1C(C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""09DFAA0F4BFF7485_B33323C916611AD2_6039_UN""","""CC(C)(COCC1=N[N](C)C(=C1)C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D98BDB551636060D_C7EB725C26081BE7_6039_UN""","""CC(C)(COCC1=CC(=N[N]1C)C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D4B5DD9418ECE5CF_4A928E4BBBDC4DC5_6039_UN""","""CC(C)(COCC(NC(CCCCC)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""B2A52454A3D7C228_7B067321DDF45E51_6039_UN""","""CC(C)(COCC1=C(C=CC=C1)OC2CC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""51122A163EEE9D8B_50E96E50118FA049_6039_UN""","""CC(C)(COCC(NC1=CC(=N[N]1C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""4FCAFBD6D0012761_3F4FCB33AFD24529_6039_UN""","""CC(C)(COCC(=O)CCC1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""65B9D130E5A48CDC_CCDA2453AA542539_6039_UN""","""CC(C)(COCC(C1=N[N](CC)N=C1C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""CB2DA5D6AA31126C_988EF9ACF9D224AD_6039_UN""","""CC(C)(COCC1=NC(=NO1)CC(NC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""A794AB2ED88CA511_E04A72338D9D16AE_6039_UN""","""CC(C)(COCC1CN1CC2=CC=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""F00537FD024E0AC1_2A8594C2323CAA18_6039_UN""","""CC(C)(COCCO[S](C[S](C)(=O)=O)(=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""7DA84E536AEE3A12_F6F37C786F117EA0_6039_DP""","""CC(C)(COCC2=CC1=C(CCNC1)C=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""BF1139F7B47108BF_1469010E7EEF5994_6039_DP""","""CC(C)(COCC(N[C@@H](C(C)C)C(=O)O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""13BED59CAEDE100B_9AB5368A1A65B3A5_6039_UN""","""CC(C)(COCC1=NC(=NO1)C(OCC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""67A469AAEE041EC8_3808EFF92798C80D_6039_DP""","""CC(C)(COCC(N[C@H](C(C)C)C(=O)O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""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"""
+"""E38AE3AD7BA1166C_36994A22BC48026A_6039_UN""","""CC(C)(COCC1=NC=CC(=C1)OC(C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""A78F94AF382E7098_93DC49E9FE56AF72_6039_UN""","""CC(C)(COCC1=C(C=C(C(O)=O)C=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""7125F84EDF4CC909_885F903726402202_6039_UN""","""CC(C)(COCCCN(C)C1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""3B3A95B8A30BBA5A_121094C9956842E8_6039_UN""","""CC(C)(COCC1=C(F)C=C(C(=C1)F)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""ACACD5BC54520C2C_5E3E7DAA64DFFCD4_6039_UN""","""CC(C)(COCCSC1=CC=CC(=C1)OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""FAE48F6E1B80ACB8_8D025532CB5FDBEE_6039_UN""","""CC(C)(COCCC1=NSC2=C1C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""7318E8F2B383CCF8_B0BB7D6011FE2A13_6039_UN""","""CC(C)(COCCC1=NOC2=C1C=CC=C2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""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"""
+"""2D6B3CBE74C0B7B7_5ADD79B5CC3116ED_6039_UN""","""CC(C)(COCC1=CC=CC(=N1)C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""69A8907ED1AAD5DC_6C34C095292159EA_6039_UN""","""CC(C)(COCCCN1CCC(F)(CC1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""FE4AED462F67B3CD_64C50485FF45C7AC_6039_UN""","""CC(C)(COCC1=C(C)C=CC(=C1)[N](=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""F1345186E77034B3_9B7B4F941B1C3CF9_6039_UN""","""CC(C)(COCC1=C(C=CC(=C1)C(O)=O)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8278D820AAE3C605_328CBC7044295918_6039_UN""","""CC(C)(COCCNC(=O)C1CCOCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""C1F6E6A56D58DB24_9DAF1309E36E67BE_6039_UN""","""CC(C)(COCC1=NC=CC(=C1)C(OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""612405142253ADF0_5B8DD8579D498E55_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)COCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""3453E510D656D8EF_C078B7718BCF9B87_6039_UN""","""CC(C)(COCCOC1CC[S](=O)(=O)CC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""12D55A5DC3605CC5_9A9785DEE4EA91AC_6039_UN""","""CC(C)(COCC1=NSC2=C1C=CC(=C2)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""C9126EBF49D44A7A_3657211E3BF60F53_6039_UN""","""CC(C)(COCCCNC(C(CC)CC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""069C31AED4DC7950_07EBA3D55382C650_6039_UN""","""CC(C)(COCC1=C(F)C=C(C=C1F)C#N)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""4230AC102483E133_E6961ED48B48646D_6039_UN""","""CC(C)(COCC1(F)OC(=O)CC12CCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""BAE92016FFA08BB0_CF0151935BCED9AB_6039_UN""","""CC(C)(COCC1=C([N](C)N=N1)C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""FC6A44635EC627B6_7107A8E28094A464_6039_UN""","""CC(C)(COCC1=C[N](C)N=C1C(F)(F)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8390D78D48F472BB_2755546549F5A4C7_6039_UN""","""CC(C)(COCC1=CC(=C(OCC)C=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""EF645159BCC9D4E6_C10AAA0A14F49516_6039_UN""","""CC(C)(COCC2=NC1=C(F)C=CC=C1O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D9512DD35E238205_3083F60A9ADD38AA_6039_DP""","""CC(C)(COCC1OCCC12CCNCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""A0AAB734605E0DD1_D893C0CF7619710A_6039_UN""","""CC(C)(COCC1=CC=C([S](N)(=O)=O)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""EC57603C1F1244DA_A00E8D6DE756E7A1_6039_UN""","""CC(C)(COCC(C1=CC=C([N](=O)=O)O1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""773D3BFCB30B1943_3BFF1C41D0986988_6039_UN""","""CC(C)(COCC1=C([S](C)(=O)=O)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""F852D38C2D6EE9CC_22D3E1B0A01CFCB3_6039_UN""","""CC(C)(COCC1=NC(=NO1)C(OC)(C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""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"""
+"""87BE307571A02C4E_CAA0CA5DEC5AB63B_6039_UN""","""CC(C)(COCC1=CC=C(SC(F)F)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""5C5B1E2DE8104E04_7279F8390EB7F334_6039_UN""","""CC(C)(COCCC(=O)NC1=NC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""6A8845456FF71F46_787F2EC41103A8E9_6039_UN""","""CC(C)(COCC1=C(C)OC(=C1)C(OC)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""915F01F479218276_C2C344D097E754A3_6039_UN""","""CC(C)(COCC1=CC=C(C=C1)[S](=O)(=O)Cl)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""AE1D36F4DD9354E8_39B7FDFD8AAAFFAF_6039_UN""","""CC(C)(COCC1=CC=CC(=C1[N](=O)=O)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""FBBE09DC5E63817F_CD4FF20701EA63F1_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)C=CC=N2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""DCC85B0CF5DBA5B4_ED315A8AA3136647_6039_UN""","""CC(C)(COCCCOC1=C(F)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8D99898FB81B21D9_B36E6DD38D708E14_6039_UN""","""CC(C)(COCC1=C(C=CC(=C1)[N](=O)=O)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""D9AD75BD57F5F458_D6104EE9DF59BBEE_6039_UN""","""CC(C)(COCCCNC(CC(C)(C)C)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""DDA11F68796828C9_216B40911EE8FB3A_6039_UN""","""CC(C)(COCCC(=O)N1CCCCCC1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""AFCFB7C32B68CD2D_C7B018C4727F8AB2_6039_UN""","""CC(C)(COCC2=NC1=C(CCCCC1)S2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""3D1C558ADA13053B_939AA50A40DF793E_6039_UN""","""CC(C)(COCC1=CN=CC(=C1)C(C)(C)C)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""2179C51760F4CC1C_516B5672264D882C_6039_UN""","""CC(C)(COCC2CCCC1(CCOC1)O2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""5F46AE8DC83804A0_C28C15BC646B336A_6039_UN""","""CC(C)(COCC(N(C)CC1=CSC=C1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""B9C5375D34EE2897_3C0A9884EA476204_6039_UN""","""CC(C)(COCC1CCCC(F)(F)C(N1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""E2FB9D5877922CA4_97C49A937541CFAC_6039_UN""","""CC(C)(COCC1=NOC(=N1)N2CCCC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""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"""
+"""0FD19904B8897E9E_C272E23F23FD1255_6039_UN""","""CC(C)(COCC[S](=O)(=O)C1=CC=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""C8191EA88DEB7069_C99EF98B156DD963_6039_UN""","""CC(C)(COCC1=CN=C(OC)C=C1OC)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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+"""70B785B8DBBBDCD3_E48857027D34FA7D_6039_UN""","""CC(C)(COCC1=C([S](F)(=O)=O)C=CC=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""8DC256B1F265B13A_3C788BD2609118F4_6039_UN""","""CC(C)(COCC1=NC=C(C(C)(F)F)C=C1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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+"""A58A692FEFD026D2_21A21F13E5945A95_6039_UN""","""CC(C)(COCCN1CCN(CC1)C2CC2)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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+"""CB925C6D13ED3D0E_86E03D69B10F93CC_6039_UN""","""CC(C)(COCCCCC(N[S](C)(=O)=O)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""CF30495E1B8F1414_73389CD990334D61_6039_UN""","""CC(C)(COCC(=O)NC(=O)C1=CC=C[NH]1)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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+"""6AA35FCD36D1E4C1_98DAE0FD54CDF39F_6039_UN""","""CC(C)(COCC(N1CC(CC)OCC1)=O)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
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+"""EE04EE7E73D62B3D_3C5FC4E3FBDD24C9_6039_UN""","""CC(C)(COCC1=C(C=C(C(N)=O)C=C1)F)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""5B74B43941F509B9_1FB5D218258F10DE_6039_UN""","""CC(C)(COCC1=C(C=N[N]1C)[S](=O)(=O)Cl)CC(F)(F)F""",21,"""4A252F1CFC3E9F04"""
+"""EAB54A02EBD198E2_1B93491AE905B50A_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC(NOC)=O)C2)F""",21,"""D66481E53AEBDD89"""
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+"""7DE98A9FE9E1C299_21119B8A559308DD_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC(OC)OC)C2)F""",21,"""D66481E53AEBDD89"""
+"""EB1EE929E45C0580_6BE3F7DADBCD8D72_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC(C(O)=O)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""5DCD08BC2D785694_2EA98F53C9B8A607_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCOC(C)C)C2)F""",21,"""D66481E53AEBDD89"""
+"""B6C18E83D63FFDE6_A89ED6B58441B61E_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2OCCO2)C3)F""",21,"""D66481E53AEBDD89"""
+"""DD0BE7C5BB9BB635_0009F71E3E78BBE9_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2CCCO2)C3)F""",21,"""D66481E53AEBDD89"""
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+"""76A158A50F9E322F_0FE503A1F551E0DF_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC(C(C)C)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""B7869F822D8C8963_1548CB4279E5FAB8_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCCCOC)C2)F""",21,"""D66481E53AEBDD89"""
+"""DF5353432E6BE302_CEB69B5C2AC87EF7_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCCN(C)C)C2)F""",21,"""D66481E53AEBDD89"""
+"""6DD62604C574508C_05074DF17586B548_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCCOCC)C2)F""",21,"""D66481E53AEBDD89"""
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+"""6A3300F6D92FA926_EC0C2C134B8AA98B_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=NOC=N2)C3)F""",21,"""D66481E53AEBDD89"""
+"""F41A160852B49F97_B60A3B63584B1682_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCC(C)(C)C)C2)F""",21,"""D66481E53AEBDD89"""
+"""29866B04EC91ED81_032715449256A956_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=CSC=N2)C3)F""",21,"""D66481E53AEBDD89"""
+"""F11B8CE5B8C2630C_9929D62CE17F2F1B_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=NN=N[NH]2)C3)F""",21,"""D66481E53AEBDD89"""
+"""B12D8D7747A64DCB_9EBE285A25D3DB1D_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COC[CH]=[C]2C[CH2]C2)C3)F""",21,"""D66481E53AEBDD89"""
+"""3FAE38D68A79B4C9_929B74706344C665_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC(N(C)C)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""A382BA3BFA641398_9C80DCF8F370CDD8_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC#CCOC)C2)F""",21,"""D66481E53AEBDD89"""
+"""2E1E58B5C51BED2A_2845C490E31EAF59_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCC(Cl)(Cl)Cl)C2)F""",21,"""D66481E53AEBDD89"""
+"""8CFC42913AAF060A_B73A24DF701C6E11_6039_DP""","""CC1=C(C=CC(=C1)N2CCC(COCCCC(O)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""F58FC5A6B23229A2_182EB67B4AF8BA59_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=C[NH]C=N2)C3)F""",21,"""D66481E53AEBDD89"""
+"""C25A65F82834E27E_BFEDBA1B79420F2D_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCC=CCC)C2)F""",21,"""D66481E53AEBDD89"""
+"""8FA32D1816614D51_D71C5DAA8408D81E_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCCC(C)C)C2)F""",21,"""D66481E53AEBDD89"""
+"""98FCBC7CF6A8E138_3791E06B63D4D530_6039_DP""","""CC1=C(C=CC(=C1)N2CCC(COCCOCCN)C2)F""",21,"""D66481E53AEBDD89"""
+"""5ACB03EB1D625640_9F4F3A36689DDCF3_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCC(NO)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""2CE33F830D2999E7_157B851DD4744C34_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=C[NH]N=C2)C3)F""",21,"""D66481E53AEBDD89"""
+"""77AA0F1C3E173827_0EA6EB246D3C8057_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC[S](C)(=O)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""4B3E87305D86532A_DDD9D56E1710EDB1_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC(COC)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""670EECB9A2E84136_4F0EA74C18F1A43B_6039_DP""","""CC1=C(C=CC(=C1)N3CCC(COCCC2CNC2)C3)F""",21,"""D66481E53AEBDD89"""
+"""2470ECCAC8EE441A_42F4660CD7B7DFDD_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCCCCF)C2)F""",21,"""D66481E53AEBDD89"""
+"""FC894751A7FC2D16_1CD383097A28C125_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCSC(C)C)C2)F""",21,"""D66481E53AEBDD89"""
+"""12C3083B5584C6FB_516B69A1A693A590_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=C[NH]N=N2)C3)F""",21,"""D66481E53AEBDD89"""
+"""A4453AC6189A656C_DAEA6B209B729704_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC(OCC)=N)C2)F""",21,"""D66481E53AEBDD89"""
+"""F43E4891EC765C87_00B62323AF40AD47_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=CC=N[NH]2)C3)F""",21,"""D66481E53AEBDD89"""
+"""CC690C2487C10B0E_4E66475BC1F9C695_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC(C(C)=O)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""9C1B7F865A6C5F11_56465F82ADCE157F_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=CN=NS2)C3)F""",21,"""D66481E53AEBDD89"""
+"""6CBF16C118DBCDA7_606C58A0CA91D03E_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC[S](F)(=O)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""F78EE870621A0C17_E817A8C508431B87_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COC[C@H]2CCCO2)C3)F""",21,"""D66481E53AEBDD89"""
+"""9678D9A679C1B1B2_3B466C534565B63F_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC[Si](C)(C)C)C2)F""",21,"""D66481E53AEBDD89"""
+"""21E775C3AA80BC68_86575C918D2FEAEA_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC(NCC)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""C6C3DB7466C2ABF0_21DD1AB6F9A95FF4_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCOCC=C)C2)F""",21,"""D66481E53AEBDD89"""
+"""ECD005E2C76B1F9A_A58D60D678B0D75D_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=CSC=C2)C3)F""",21,"""D66481E53AEBDD89"""
+"""43BFA12A0F1A2B10_B04B78DF016CEDBF_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=COC=C2)C3)F""",21,"""D66481E53AEBDD89"""
+"""75E5155048931536_CC228AAB9AC0344E_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC#CC(O)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""632CA89B57ACC704_277F116F059D85FE_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=NC=C[NH]2)C3)F""",21,"""D66481E53AEBDD89"""
+"""CC824FC4F6F01D2B_951DBFC1F4CFD2E6_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=CSN=N2)C3)F""",21,"""D66481E53AEBDD89"""
+"""631760C71E1FD7B8_E53AD4377A3B8109_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=NON=C2)C3)F""",21,"""D66481E53AEBDD89"""
+"""C5AD107F82625380_B510B2284050B5B2_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=NOC=C2)C3)F""",21,"""D66481E53AEBDD89"""
+"""C890DD83745EA96B_9ADA9217811EBC07_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCCCC=C)C2)F""",21,"""D66481E53AEBDD89"""
+"""76351C77F26F79B6_4BD6C4F89918049E_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=NSN=C2)C3)F""",21,"""D66481E53AEBDD89"""
+"""921A08CFD858DFF0_342AF75AAA8249DE_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=CC=NO2)C3)F""",21,"""D66481E53AEBDD89"""
+"""431C74776E251939_2777950585ED8B55_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=CON=C2)C3)F""",21,"""D66481E53AEBDD89"""
+"""ADFA5B69372B44F3_71FAA4703184CB95_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2COCO2)C3)F""",21,"""D66481E53AEBDD89"""
+"""BB44D5E7B7A89B02_E74CEDF46FE2ADEC_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCSC(C)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""6F9EB3B6D612C61E_1DDC6673228149D3_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC(CC)OC)C2)F""",21,"""D66481E53AEBDD89"""
+"""4ED496FD666D317E_4BD9986C57D8F5ED_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=NN=CO2)C3)F""",21,"""D66481E53AEBDD89"""
+"""E584FE4911FC005C_E78337B5EAB814C2_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCCC(F)(F)Cl)C2)F""",21,"""D66481E53AEBDD89"""
+"""AD6825FF4507A2BB_C02D0288BACA942A_6039_UN""","""CC1=C(C=CC(=C1)N2CCC(COCC[S](O)(=O)=O)C2)F""",21,"""D66481E53AEBDD89"""
+"""3CAB5FCF85AB6240_32C6C955735954AF_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCCOC2CC2)C3)F""",21,"""D66481E53AEBDD89"""
+"""39B8545C56D2EAD7_FB242E575F3CE26C_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=CN=CS2)C3)F""",21,"""D66481E53AEBDD89"""
+"""6D21280A7FC63954_0552CA2943376988_6039_UN""","""CC1=C(C=CC(=C1)N3CCC(COCC2=CC=NS2)C3)F""",21,"""D66481E53AEBDD89"""
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+"""5B13546BDCF378BB_F8209EAC6C3FF57C_6039_UN""","""COC(=O)C(OCC(NC(CCCC(C)C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
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+"""C7C507E2A8AF12F7_FA3A2B92149AC257_6039_UN""","""COC(=O)C(OCC1=COC(=N1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
+"""B15159699211040F_2BEB35DA5B537F29_6039_UN""","""COC(=O)C(OCC(NC1=CC(=NO1)C(C)C)=O)C(C)C""",21,"""39BFC05C18580BC7"""
+"""AEE7D180CC111873_BA1C19E4510FF686_6039_UN""","""COC(=O)C(OCC1=CSC(=N1)N(CC)C(=O)C)C(C)C""",21,"""39BFC05C18580BC7"""
+"""5C2D860380812A28_B718FACA884AB9E9_6039_UN""","""COC(=O)C(OCCC23CC1CC(CC(C1)C2)C3)C(C)C""",21,"""39BFC05C18580BC7"""
+"""E4BF265819999670_2B028A50782D1F00_6039_UN""","""COC(=O)C(OCC1=NC=C(O1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
+"""7B11B2F8684A9B3B_9DF524CBF8F505A6_6039_UN""","""COC(=O)C(OCC1=C(OC)C=CC(=C1)[N](=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
+"""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"""
+"""F81EE904D3377879_6D8675E488E769BF_6039_UN""","""COC(=O)C(OCC(N[C@@H](CC(C)C)C(=O)O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
+"""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"""
+"""0AADC4F6D5AF2514_DBEDC1B2F103EAD1_6039_UN""","""COC(=O)C(OCC1=CSC(=N1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
+"""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"""
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+"""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"""
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+"""8188B5CB9EB29918_50CA07A22E9F3FE8_6039_UN""","""COC(=O)C(OCC(=O)NCCC1CCCCC1)C(C)C""",21,"""39BFC05C18580BC7"""
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+"""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"""
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+"""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"""
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+"""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"""
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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"""
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+"""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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+"""E776A1640D96F33D_B5B32280E96D23BB_6039_UN""","""COC(=O)C(OCC(=O)NC1=CC(=CC=C1)C#C)C(C)C""",21,"""39BFC05C18580BC7"""
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+"""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"""
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+"""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"""
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+"""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"""
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+"""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"""
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+"""F11C9B65CB13A072_C8E3B977AC91F948_6039_UN""","""COC(=O)C(OCCCC(C1=CC=C(F)C=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
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+"""7DE396108F8AF8EA_CDA82FA6BC220657_6039_UN""","""COC(=O)C(OCC1=C(C=CC(=C1)C(OC)=O)F)C(C)C""",21,"""39BFC05C18580BC7"""
+"""23941C0B693433C5_3842E0F382CF5B5F_6039_UN""","""COC(=O)C(OCC(NC1=C(CC)C=CC=C1)=O)C(C)C""",21,"""39BFC05C18580BC7"""
+"""862638B5F9F60736_EE018C6AA63BE3DD_6039_DP""","""COC(=O)C(OCCOC1=C(C(O)=O)C=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
+"""BD85BAA1D9980CB2_5BFA5D4C2F2108FE_6039_UN""","""COC(=O)C(OCC2=NN=C(C1CC1)[N]2C3CC3)C(C)C""",21,"""39BFC05C18580BC7"""
+"""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"""
+"""0AD79981E3C2D638_98BE57466F63DD43_6039_UN""","""COC(=O)C(OCCC1=C(C(OC)=O)C=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
+"""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"""
+"""69A2025EFDFE5F1B_CF09D3B6929E1343_6039_UN""","""COC(=O)C(OCC(NC1=CC(=C(F)C=C1)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
+"""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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+"""12A6D968F1C1FCBF_FB2F99F623CC26FD_6039_UN""","""COC(=O)C(OCC1=C([N](=O)=O)C=C(C=C1)C#N)C(C)C""",21,"""39BFC05C18580BC7"""
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+"""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"""
+"""E3A8178D799DB2AE_B0BC9448AAB8A408_6039_UN""","""COC(=O)C(OCCOCCN1C(=O)CSC1=O)C(C)C""",21,"""39BFC05C18580BC7"""
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+"""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"""
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+"""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"""
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+"""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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+"""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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+"""CA3D4F1C2F380BE0_7A24A59631BF24CA_6039_DP""","""COC(=O)C(OC[C@@H]1C[C@](OC)(CN1)C(F)(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
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+"""E4742C03BC23CB09_A849208AC3BDCD60_6039_UN""","""COC(=O)C(OCC1=NN=C(O1)C2CCOCC2)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"""
+"""1B48DD5DDF19D5D6_2F1B7903992DFA34_6039_UN""","""COC(=O)C(OCC1=NC(=NS1)C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
+"""8E3B52B78231CF4F_F25D56BBEC447207_6039_UN""","""COC(=O)C(OCC1=CC(=CC(=C1)OC(C)=O)C)C(C)C""",21,"""39BFC05C18580BC7"""
+"""0424E9291F380621_45D5869E10BC5A4D_6039_UN""","""COC(=O)C(OCC1=CC(=CC=C1)OCC2CC2)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"""
+"""CD81882A612DB515_07BB7C97D33FFC10_6039_UN""","""COC(=O)C(OCC2=NC1=C(CC(C)(CC1)C)S2)C(C)C""",21,"""39BFC05C18580BC7"""
+"""4BB2A7ED2D7EF7D9_362947358A887A91_6039_UN""","""COC(=O)C(OCC(=O)C1=CN=C2N=CC=C[N]12)C(C)C""",21,"""39BFC05C18580BC7"""
+"""B0B7DAC7C63D2603_3F88205FADA43909_6039_UN""","""COC(=O)C(OCC(C1=C[N](C)N=C1C(F)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
+"""01F6D013FA9E7662_947C8298A784F715_6039_UN""","""COC(=O)C(OCC(=O)C2=CC1=C(C=CC=C1)S2)C(C)C""",21,"""39BFC05C18580BC7"""
+"""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"""
+"""11D179AB7F5EB23C_6C9FC6A8C44AB574_6039_UN""","""COC(=O)C(OCC1=CC(=C(C(OC)=O)N=C1)F)C(C)C""",21,"""39BFC05C18580BC7"""
+"""CF2B04CF7E0673E0_D22CD1F2DA21ECB9_6039_UN""","""COC(=O)C(OCC(C1=CSC(=C1)C(OC)=O)=O)C(C)C""",21,"""39BFC05C18580BC7"""
+"""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"""
+"""78A6361950B29F20_A131F4709C9BE9B3_6039_UN""","""COC(=O)C(OCCC(C)OCC1=CC=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
+"""7B194EE0DD360500_4DDBBE8F276277D5_6039_UN""","""COC(=O)C(OCC1=NN=C[N]1C2=CC=CC=C2)C(C)C""",21,"""39BFC05C18580BC7"""
+"""259D5DCAD3F95C96_0228B85874B27454_6039_UN""","""COC(=O)C(OCC1=C(OC(F)(F)F)C=CC=C1)C(C)C""",21,"""39BFC05C18580BC7"""
+"""8552F2495DD82C85_B1D56B03D45E6B28_6039_UN""","""COC(=O)C(OCC(C1=CC(=C(C=C1)C#N)F)=O)C(C)C""",21,"""39BFC05C18580BC7"""
+"""C17179CFEEC1B81F_C50B431D15884593_6039_UN""","""COC(=O)C(OCC1=CC=CC(=C1F)C(F)(F)F)C(C)C""",21,"""39BFC05C18580BC7"""
+"""D0B14F01D8BC3824_F62854975623DED4_6039_UN""","""COC(=O)C(OCC1=CC(=CC(=C1)C(F)(F)F)F)C(C)C""",21,"""39BFC05C18580BC7"""
+"""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"""
+"""5801B06271A364D6_A2F9BD6EFFB452E7_6039_UN""","""COC(=O)C(OCC(C1=C(C)OC(=C1)C(=O)N)=O)C(C)C""",21,"""39BFC05C18580BC7"""
+"""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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+"""732C770B4E1E631B_A94D77B776E27FFB_6039_UN""","""C[C@@H](OCC2=NC1=C(C(=C(C)S1)C)C(N2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
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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"""
+"""FA7E1081BFAFAED2_E4D58BB430A07192_6039_UN""","""C[C@@H](OCC(N(CC)CC(=O)NC(C)C)=O)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""2F3772AFF3835F9A_EA68E9033ECA4D44_6039_UN""","""C[C@@H](OCCC(NC1=CC=C(OC)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""AC976B428B966798_A52BB9EF5B6227EE_6039_UN""","""C[C@@H](OCCOC1=CC=C(C(C)(C)C)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""05B7769278940710_0E602020DE2484EA_6039_UN""","""C[C@@H](OCC(NCCC1=C(C)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A687AC9049BE1AF8_C3AFF20A45585C08_6039_UN""","""C[C@@H](OCC(NC1=CC=CC(=C1)C(O)=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""DA07631DC5A3A0EB_C19E7A9B53590E2E_6039_UN""","""C[C@@H](OCC(=O)NC(=O)NCC1=CC=CS1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""21B508E016B7A577_82A9A03E4CA78BE7_6039_UN""","""C[C@@H](OCC(NC(C)C1=CC=C(C=C1)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C6C0DCD910612D86_4F8E982FC80D4AE7_6039_UN""","""C[C@@H](OCC(NC1CCN(C(C)=O)CC1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""24F1BED2034C1AE5_608226A672A79A21_6039_UN""","""C[C@@H](OCC(C1=C(C(F)(F)F)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""6D326B87E59113D4_43D2A187088468AF_6039_UN""","""C[C@@H](OCC(C1=CC=CC(=C1)OC(F)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""B46A263A47B13F30_28F7B91DA5B1EA6A_6039_UN""","""C[C@@H](OCCOC1=CC(=C(C(C)C)C=C1)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""0E002AA56147648D_99660858EC131A69_6039_UN""","""C[C@@H](OCC(=O)NC1=CC=C(C=C1)CC#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""46B833823E61CD54_B9F8C9652F0EBBCE_6039_UN""","""C[C@@H](OCC(C1=C(C=CC(=C1)CC)CC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""35D3A6C75C1996E7_BE9F4036DA14B29E_6039_UN""","""C[C@@H](OCC(N(C)C1(CCCCC1)C#N)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""F6ECD441D3DC9D4C_BFC54E7158ECF33B_6039_UN""","""C[C@@H](OCC1=C(C)C=C(C=C1C)C(C)(C)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""DA56AF2F80131E58_AFF62B1AAC0F2814_6039_UN""","""C[C@@H](OCC(C1=C(C(=C(C)C=C1C)C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""EE9319FD53023CBC_F8815BF092F5849C_6039_UN""","""C[C@@H](OCC1=NC(=NO1)C2=CC=C(C)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""0C8B1D3BA90D1851_BFFEA9C3252AB360_6039_UN""","""C[C@@H](OCC1=CC=CC(=C1)[S](N(C)C)(=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""3B83688D98F35F5E_B6455DA549505D16_6039_UN""","""C[C@@H](OCC(C1=C(C)[N](C(=C1)C)C2CC2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""938513A8B92819AF_BED2752765244F37_6039_UN""","""C[C@@H](OCC1=NN=N[N]1CC2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""10302C0BD87C156B_0070226A69103118_6039_UN""","""C[C@@H](OCC(N(C)CC1=CC(=CC=C1)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""F75D1F0D7431CB47_3E30C972EE282628_6039_UN""","""C[C@@H](OCC1=C(C)OC(=N1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""064BD2C20C75007D_C52766DF5311C1A5_6039_UN""","""C[C@@H](OCC1=NC2=C([N]1C(F)F)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""4429F679A844DA46_C2704CBC6C670FBC_6039_UN""","""C[C@@H](OCC1=COC(=N1)C2=CC=C(C)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""B6B165EF815A9560_D86C621C41002534_6039_UN""","""C[C@@H](OCC(C1=CC=C(CC(OC)=O)S1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""31AFC7B1E4B8F0F3_13E2345DBD3366D1_6039_UN""","""C[C@@H](OCC1=COC(=N1)C2=CC=C(F)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""E07C15AAC42BC41B_2FC549A01FCE8BB5_6039_UN""","""C[C@@H](OCC1=NC=C[N]1CC2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""40650F51347F560A_8DC36F9A3C91EFA6_6039_UN""","""C[C@@H](OCC(=O)NCCSCC1=CC=CS1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""1F4244C744F41717_B071CFEB9D3E1104_6039_UN""","""C[C@@H](OCC(NC1=C(C(=C(C)O1)C)C#N)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""BB8D2E3E2A9EC402_7F01BDF97D33ADBA_6039_UN""","""C[C@@H](OCCC(=O)NC1=CC=C(C=C1)C#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""49B2E68A53A1522F_6BFA82EA1459FB71_6039_UN""","""C[C@@H](OCCC(=O)NC1=C(C=CC=C1)C#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""191FBBE58702AE7C_E84292FA195BED89_6039_UN""","""C[C@@H](OCCC(NC1=C(OC)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""E399F077A90A1DE8_04C4CD0C33E00117_6039_UN""","""C[C@@H](OCCC(=O)NC1=CC(=CC=C1)C#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""D450146B76DB19B8_F9BC4B25CA91E2A2_6039_UN""","""C[C@@H](OCC(=O)N1CCCC1C2=CC=CS2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""74F880DF1B20EF78_90240E49987DA7D2_6039_UN""","""C[C@@H](OCC(N(C)CC(=O)NC(C)(C)C)=O)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""A5753262F81A18A1_5CECEE6D82379BA9_6039_UN""","""C[C@@H](OCC(OC1=CC=C(OCC)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""815AF77C519D6EEA_E6E53C5701D6F575_6039_UN""","""C[C@@H](OCC(C1=CC=C([S](C)(=O)=O)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""FF216AA49AFFA57C_D7AB3710FA3D9837_6039_UN""","""C[C@@H](OCC(N(CC)C1CC[S](=O)(=O)C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""50EFAAD9D4863D54_2DCE89779BC1888B_6039_UN""","""C[C@@H](OCC2=NN=C(C1=C(C)OC(=C1)C)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D4DE18E7EA488C5D_65B8B8E37CC2B66B_6039_UN""","""C[C@@H](OCC(C1=CC=C(CNC(C)=O)S1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""CB953A6928DEBF97_E88BD75A46C1B085_6039_UN""","""C[C@@H](OCC2=NN=C(C1=C(F)C=CC=C1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""2F9F4F59A228F278_1D46A7B112554E3E_6039_UN""","""C[C@@H](OCC1=C(C=C(C(=C1C)C(C)=O)C)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""5699856308D74FA7_71C4FF225EE25BA1_6039_UN""","""C[C@@H](OCC(=O)NCCSC1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A6FCB7DC3B662328_812764447A173134_6039_UN""","""C[C@@H](OCC(N(CC)C1=CC=C(C=C1)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""2DE2484E90640BEF_F06028BCD4F00111_6039_UN""","""C[C@@H](OCCC(=O)N1CCC2=C1C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""88C3F4D928E93679_00379CECF2C2368B_6039_UN""","""C[C@@H](OCC2=NC=C(C1=CC=C(F)C=C1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""1F539C3CEFC18E85_D9695AD748367ED8_6039_UN""","""C[C@@H](OCCC(NC1=C(C(N)=O)C=CS1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""5ABF1AC7BECF0AA1_3860CE40592BBFC3_6039_UN""","""C[C@@H](OCC(C1=CC(=C(C(=C1C)C)C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""102DD74DE485504C_5D3C71C3EE84649A_6039_UN""","""C[C@@H](OCC(C1=CC=C(C(CC)C)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""9AE005A2578C4416_28301F79346ACF69_6039_UN""","""C[C@@H](OCC(C1=C(C)C2=C(S1)C=CC=C2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""B09280A1EFCDE3A2_74D1429B19566F4A_6039_UN""","""C[C@@H](OCC(=O)C1=CC2=C(C=C1)CCCC2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D2150DA08B5E41AD_53F486C4F32A1643_6039_UN""","""C[C@@H](OCC1=CC=C([S](C(F)F)(=O)=O)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""6F48D9ECA2DF01A8_F7DCE72D08A50BC3_6039_UN""","""C[C@@H](OCC(N(C)CC1=C(C=CC=C1)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""039A6104B47BF8C3_A969E77E41306FF9_6039_UN""","""C[C@@H](OCC(=O)N(CC#N)C1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""3ECC90CE4E97B2AA_EFA2FCD6B6460F7B_6039_UN""","""C[C@@H](OCC1=CC=C(OCC(F)(F)F)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""DBEA33BF566DB98E_81A53CB8F9888A56_6039_UN""","""C[C@@H](OCCSC1=CC=CC(=C1)C(F)(F)F)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""619FCAD75DE18E52_C4E97F1973FC9EF8_6039_UN""","""C[C@@H](OCC(=O)NCC1=CC(=CC=C1)C#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""1137B6762E309FCA_CEA229B118664C73_6039_UN""","""C[C@@H](OCC1=CC(=NO1)C2=CC=C(F)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""8656A9D85A76D25A_EF63080BC011AF4E_6039_UN""","""C[C@@H](OCC(N1CCCC(NC(C)=O)C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""E98D86FD025701D5_4B5C3A3A9C763F13_6039_UN""","""C[C@@H](OCC(N=C1C=CNN1CC(C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""0E5D72E4E4C9ACCA_245DFC534337C2C5_6039_UN""","""C[C@@H](OCC(N(CC(C)C)CC(F)(F)F)=O)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""CD130AA505B1057E_9212C71937A1F813_6039_UN""","""C[C@@H](OCC1=CC=CC(=C1)OCC(F)(F)F)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""EDAF614E29E87D60_DC4599D5DB9C122B_6039_UN""","""C[C@@H](OCC(N1CCCC(C(F)(F)F)C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""94C6EBC79A571AE7_CADC108636E08AE1_6039_UN""","""C[C@@H](OCC(N1CCC(C(NC)=O)CC1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""D680516EB76C1A7E_271BF116CC9B5D4C_6039_UN""","""C[C@@H](OCC(=O)N1CCC2(CC1)OCCO2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""CCBDC3412F8A9AC3_9EDDB7ABADEB9ADC_6039_UN""","""C[C@@H](OCC(=O)N1CCCC1C2=CSC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""B775FE7C625414AA_0DD98F26A92D1A8C_6039_UN""","""C[C@@H](OCC(=O)NC2=NC1=C(CCCC1)S2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""C2B8179FB87F29A4_972572D385D3E772_6039_UN""","""C[C@@H](OCCOC2=C1C=CC=CC1=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D4E5852B81DF49DF_AF3B9FC1793810FD_6039_UN""","""C[C@@H](OCC1=CSC(=N1)CC(OC(C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""33BBCF10AAC0961D_37F49EAE8F2F99EC_6039_UN""","""C[C@@H](OCCC[S](C1=CC=C(F)C=C1)(=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""3AB0DF6397E42535_CE86B28D98421ACF_6039_UN""","""C[C@@H](OCC(=O)NC1CCN(CC1)C2CC2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""CCA3075F7F4F2C72_F036A50EEF1F0C0F_6039_UN""","""C[C@@H](OCC(C1=C[NH]C2=CC=CC(=C12)C)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""BABAC41CB3521639_964793BBFA25634F_6039_UN""","""C[C@@H](OCCCOC1=CC2=C(C=C1)OCO2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""64D74C96D8F8F1A2_09A6A0DA58DEAC21_6039_UN""","""C[C@@H](OCC(=O)N(CC1=CSC=C1)C2CC2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""0CE2B315847C277D_02F9FA39C804DE9C_6039_UN""","""C[C@@H](OCCOC1=CC=CC(=C1)C(OC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""95692313B425B289_F54A2179527C2834_6039_UN""","""C[C@@H](OCC(C1=CC(=CS1)C(N(C)C)=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""92C4F4CD1306A0D9_7C9061BDD01825C3_6039_UN""","""C[C@@H](OCC2=NN=C(CC1=CC=CC=C1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D08FABD994DABBE3_E954892370F40B27_6039_UN""","""C[C@@H](OCCCC1=CC=C(C=C1)[S](=O)(=O)Cl)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""76A9A9EF382730B4_00A220674FB4128A_6039_UN""","""C[C@@H](OCC[S](C1=CC=CC(=C1)OC)(=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A998A70D7EA4E093_27A885740AFB6D9A_6039_UN""","""C[C@@H](OCC(=O)NCC(=O)C1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""9C205D3DE8E7EBED_7F4C79CECA95E154_6039_UN""","""C[C@@H](OCC2=NC1=C(C=CC=C1)[S](=O)(=O)N2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""70FC67EC354C0DB3_7FADDD03EDAAB996_6039_UN""","""C[C@@H](OCC1=CSC(=N1)C2=C(F)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""8919D2E773187A80_1C637AE7AAED83F9_6039_UN""","""C[C@@H](OCC1CN(C(=O)O1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D06DC36AA4485467_3CFF850560390A38_6039_UN""","""C[C@@H](OCCCC2=C1C=CC=CC1=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""0B5EAE16B2C2D6D8_E573A094025F807D_6039_UN""","""C[C@@H](OCC1=CC(=C(C=C1)[S](=O)(=O)C)OC)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""23429AB9907F49BE_3F9DCAB4D02E6E2D_6039_UN""","""C[C@@H](OCC(NC1CCN(C(C)C)CC1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""3476C8830028D57F_6C07F0F90BF2F06C_6039_UN""","""C[C@@H](OCC1=CC(=C(OC)C=C1)[S](=O)(=O)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""AAA60C0B934B7C08_0BFE7F97A7C44059_6039_UN""","""C[C@@H](OCC(C1=CC=C(NC(N)=O)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A2D6200994CF1E43_2E6DFF3462AC8DE4_6039_UN""","""C[C@@H](OCCOC1=C(OC)C=C(C=C1)C#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""D85A630E2203945F_A5125F5BAB0A154F_6039_UN""","""C[C@@H](OCCOC1=C2C(=CC=C1)C=CC=N2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""B42DA5C7D971F593_5590A41C45F704CC_6039_UN""","""C[C@@H](OCC2=NN=C(C1=CC=CC(=C1)F)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""A8ADCE192F7E6464_1CEBA4105AD46C4A_6039_UN""","""C[C@@H](OCCOC1=CC=CC(=C1)[S](C)(=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""DBB3D975F6C32FD6_99CD69DE67CE01D0_6039_UN""","""C[C@@H](OCC1=NC(=NO1)C(OCC(C)C)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A3FA6269FFD17DF7_4D2298FAF566F248_6039_UN""","""C[C@@H](OCC[S](=O)(=O)C1=CC=C(C=C1)C#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""261117A8260CB237_4C2F1E8D95F016A4_6039_UN""","""C[C@@H](OCCCC1=CC=C(C(F)(F)F)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""1B0A8CD70A4DA570_D58B745FC4C0C598_6039_UN""","""C[C@@H](OCC1=CC=CC(=C1)SC(N(C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""E01756EDC4C27A04_0EA70EFC54B06092_6039_UN""","""C[C@@H](OCC2=NC1=C(C=CC(=C1)[N](=O)=O)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""18F3E4EC93BF1DE0_E3D814B576DB5C73_6039_UN""","""C[C@@H](OCC1=CC=C(SC(N(C)C)=O)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""72F3C79C676EEA90_B12A4E7AC0E67D77_6039_UN""","""C[C@@H](OCC[N]1N=CC(=C1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""B9C63728D817CDB4_12D1BBDCDB2514ED_6039_UN""","""C[C@@H](OCC1=NC2=C(N(C)C1=O)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""84920BE0F3DDAB4A_0554FED901A021EE_6039_UN""","""C[C@@H](OCC1=NOC(=N1)C2=C(C)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""88FD7AFCD9AA3838_966D567CD7579856_6039_UN""","""C[C@@H](OCC1=CN=C(OCC(F)(F)F)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""AF07DA1D851EA0A3_18BABEB5A42867C1_6039_UN""","""C[C@@H](OCC(NC1=NN=C(C(C)(C)C)S1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""090C8C2A003B3693_A03AC36D9C738F5F_6039_UN""","""C[C@@H](OCC1=NN=C([N]1C)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""7A21D30A36EEC948_E023CB01EB0FE6AC_6039_UN""","""C[C@@H](OCCC1=CC=CC(=C1)OC(F)(F)F)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""5B00C5F4B8318A19_AF0867D07D7B7177_6039_UN""","""C[C@@H](OCC1=NC(=NO1)C2=CC=C(F)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""F4C63A91823CFA09_827E69C05FB94FDB_6039_UN""","""C[C@@H](OCC(C1=C(C(=C(C)[NH]1)C(C)=O)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""729030584AD2F552_5F1E4B80E38E5B9F_6039_UN""","""C[C@@H](OCC(=O)N1CCSC2=C1C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""1B5AEAFF78E9695F_F21E8CD0D60E8C0B_6039_UN""","""C[C@@H](OCC1=C(C=C(C(N)=O)C=C1)[N](=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C3A97E2F526D403A_F7C9CF658A2F9AB1_6039_UN""","""C[C@@H](OCCC(=O)NC(=O)NC1CCCC1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""3923CDCFCFB9672D_C769BBBDF42A395F_6039_UN""","""C[C@@H](OCC(=O)NC(=O)CC1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""6B9553F2A7E5907F_809350F022897D5F_6039_UN""","""C[C@@H](OCC(C1=CC(=C(C)C=C1)[N](=O)=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""8776F3DBF284BF72_0CD684E72D18CB68_6039_UN""","""C[C@@H](OCC(NC1=CC=CC(=C1)C(C)=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""B14108DE348BAA30_B0C060D75FD9474E_6039_UN""","""C[C@@H](OCC(NC(C(OC)=O)CC(C)C)=O)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""DE4F539E7590AEB8_C490C0490C268E24_6039_UN""","""C[C@@H](OCC(N=C1N=C(SCCC)NS1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""45836FD2D6743322_02394518321DC74D_6039_UN""","""C[C@@H](OCC(=O)NC1=CC2=C(C=C1)CCC2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""FC6D0EB5DBB555C5_E9CC65E932E6056E_6039_UN""","""C[C@@H](OCC2=NC1=C(C=C([N](=O)=O)C=C1)[NH]2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""86E7B2AADD5D02DE_AF4BE9E12A48F9E5_6039_UN""","""C[C@@H](OCCC(=O)N2CCC1=C(C=CS1)C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""C62D262DE30A0E90_AC34AF0E21E30A37_6039_UN""","""C[C@@H](OCC(=O)C1=CC2=C(C=C1)OCCO2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""2DB288A90851067D_3ED8F225AD850461_6039_UN""","""C[C@@H](OCCCN1C(=O)OC2=C1C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""9A8DA998518433E0_0EDBF412D6DA867C_6039_UN""","""C[C@@H](OCC(=O)NC(=O)NC1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""328C7EA51E351082_871FE1E76BD93D9D_6039_UN""","""C[C@@H](OCC(C1=CC=C(CC(C)C)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""276A43433DA334D1_F24255673BA1B9A0_6039_UN""","""C[C@@H](OCC(C1=CC=C([S](N)(=O)=O)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""F938CB05910D990F_33F22C937E6ACBAE_6039_UN""","""C[C@@H](OCC(NC1=C(C(O)=O)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""9F242E2B0D774B43_87E24DDBA77625D0_6039_UN""","""C[C@@H](OCC(=O)N(CC1=CC=CS1)C2CC2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""8010400369E2E409_CDADA8C353B46B27_6039_UN""","""C[C@@H](OCC2=C([N](=O)=O)[N]1C=CC=CC1=N2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""B2B25CAE49B80A6D_44A41E61E8BF2CAC_6039_UN""","""C[C@@H](OCC2=NC1=C(C)C=CC=C1C(N2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D727EAC335B4A21A_0F67D18AEE883945_6039_UN""","""C[C@@H](OCC(=O)NC1(CCCCCC1)C#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A79FACD3A56C734A_7119DF42325E934A_6039_UN""","""C[C@@H](OCC(NC1=CC(=NO1)C(C)(C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""11BD14A9797F5D97_D63CA38D7DF49EDE_6039_UN""","""C[C@@H](OCC(C1=C(C)C2=C(O1)C=CC=C2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""25EB4B24E2629F78_C25EAB06E1C41E62_6039_UN""","""C[C@@H](OCC(C1=C(C=CC(=C1)OC)OC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""63080F370E11C3EA_BB5B03D0CDCA47DB_6039_UN""","""C[C@@H](OCC1=NC(=NO1)C2=C(C)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""59BDFA54DDF09008_F58D91525B0CE12D_6039_UN""","""C[C@@H](OCCC[Si](OCC)(OCC)OCC)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""2BA9F48989206138_9A5986E46BD1A07D_6039_UN""","""C[C@@H](OCC(=O)N1CCCC2CCCCC12)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""7AA55AB2F915EF81_5295861128B6CA87_6039_UN""","""C[C@@H](OCCN2C=NC1=C(C=CC=C1)C2=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""1A44F3E022C7D720_CE7F6D196F128B4B_6039_UN""","""C[C@@H](OCC(NC(C)C1CC2CCC1C2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""50045B3902860F11_FFB3CF651B0CD892_6039_UN""","""C[C@@H](OCC1=CC=C(C=C1)C2CCCCC2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""47BE0FCD544CF0A7_76AA8B6EAF4BAB45_6039_UN""","""C[C@@H](OCC1=NC(=NO1)C2=CC=CC(=C2)C)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""C95347C1A2942CFA_F09FF26C35F0C53F_6039_UN""","""C[C@@H](OCC(NC1=CC=CC(=C1)C(C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""0979A61C0C6E02D0_DB30EC8022D87F6D_6039_UN""","""C[C@@H](OCCC(NC1=CC=CC(=C1)OC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""2BB25ED3960E7A61_45598FE558637C0C_6039_UN""","""C[C@@H](OCC1=NOC(=N1)C2=CC=C(F)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""7C0E8768BBA4B99D_FD96AEAE0827D790_6039_UN""","""C[C@@H](OCCN2C(=O)NC1(CCCC1)C2=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""DD701575DF742AF0_CF20D11CD167AD16_6039_UN""","""C[C@@H](OCC1=NC(=NO1)CC2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""80C3E1187BEADE49_EB1EF1E033BB0391_6039_UN""","""C[C@@H](OCC(=O)NCC1=CC=C(C=C1)C#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C1DCFC1D7168A0E5_688B92B1478F7612_6039_UN""","""C[C@@H](OCC(C1=CC=C(NC(C)=O)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""DCFA677549AE05AC_E49D87ACDB517C1D_6039_UN""","""C[C@@H](OCC2=NC=C(C1=C(F)C=CC=C1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""C0F05DCA36997807_88EAF942484D66E8_6039_UN""","""C[C@@H](OCC1=CC=C(C(OC(C)C)=O)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""42318B132C173B75_DEF28D459D577628_6039_UN""","""C[C@@H](OCC1=CSC(=N1)C(OCC(C)C)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""177E12558E520709_20EB8E8B286630CE_6039_UN""","""C[C@@H](OCC1=C(C=C(C(OC)=O)C=C1)OC)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""8E8326BE049A3DE5_6DCD28A6380DE3FD_6039_UN""","""C[C@@H](OCCOC1=CC=CC(=C1)C(C)(C)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""D14C7C278E704FD9_8D8244F2DC3B4CB4_6039_UN""","""C[C@@H](OCC(=O)C[S](=O)(=O)C1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A08348E4915B5FD7_1FD0286957A1FB2D_6039_UN""","""C[C@@H](OCC2=N[N](C1=CC=C(F)C=C1)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""338CE406DA7F4EDE_1DE5EE9641E61E1D_6039_UN""","""C[C@@H](OCC2=NN=C(C1=C(C)C=CC=C1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""3231A6964FF3DCDB_4D6EDBDE0D4A0334_6039_UN""","""C[C@@H](OCC2=NC=C(C1=CC=C(C)C=C1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""6969078D79742342_98AA930BAB62D825_6039_UN""","""C[C@@H](OCCC1=CC=C(OC(F)(F)F)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""BFD658F2778C02F6_C4BFE6B028629CD3_6039_UN""","""C[C@@H](OCCCN1CCC(C(OC)=O)CC1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""4CE3C522E2D3ED17_46079DC641979B22_6039_UN""","""C[C@@H](OCC1=CC(=C(C(OC)=O)C=C1)OC)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""9DBD76C2CE43BB59_5E2C4CD976139F53_6039_UN""","""C[C@@H](OCCN1C(=O)COC2=C1C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""E8E16F6C32C620FF_16211E596BDE7A41_6039_UN""","""C[C@@H](OCCC[S](C1=CC=C(C)C=C1)(=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""5C46846A864FB27D_E52610F0CD4C987A_6039_UN""","""C[C@@H](OCC1=C(C(O)=O)C=C(C=C1)[N](=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""8394261A85B9ABE2_FBE011CF21A14879_6039_UN""","""C[C@@H](OCC(C1=CC=CC(=C1)C(OC)=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C4FE9ED4254C3195_72DD28126F9D6F03_6039_UN""","""C[C@@H](OCC(NC1=CC=C(C(O)=O)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""1BACB5767E0762E3_4251EBC835338325_6039_UN""","""C[C@@H](OCC1=CC=CC(=C1C#N)C(OC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C7C8B0B359E74994_9C3ACBC41CD0EA72_6039_UN""","""C[C@@H](OCC(NC1=CC=C(C(C)C)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""341B0A79C0767E0B_A667F1E093DC662A_6039_UN""","""C[C@@H](OCC1=C[N](N=C1)CC2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""49601C3DF80C2CF3_DC91C6F228234F74_6039_UN""","""C[C@@H](OCC(NC1=C(OC)C=CC(=C1)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""282317C29EF55900_2D3CDFEAAD8F0CB8_6039_UN""","""C[C@@H](OCC(NC1=C(C=C(C)C=C1C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""1B0343504815092E_187973EBA9046892_6039_UN""","""C[C@@H](OCC(NC1=CC=C(OCC)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""29FC144D7CD8BFEF_3EB24290A3F84F59_6039_UN""","""C[C@@H](OCC(NC1=C(CC)C=CC=C1C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""DB7B2B339AD3A2B6_5FED03BD5BF8A356_6039_UN""","""C[C@@H](OCC(=O)C1=CC2=C(C=C1)NC(=O)N2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""F644E6A38F54264D_FA658A856E45732F_6039_UN""","""C[C@@H](OCC(NC1=C(C(=C(C)S1)C)C#N)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""F9C8830DF3A8C099_23A993A5729520E7_6039_UN""","""C[C@@H](OCC1=CC=C(C=C1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""836AF3298FD59538_D41D378D10F2F784_6039_UN""","""C[C@@H](OCC(NC1=C(C(N)=O)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C7193B71487AB455_F7004EB7EDBB34E3_6039_UN""","""C[C@@H](OCCN2C(=O)C1=C(C=CC=C1)C2=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""6AEEEBA7FFCB2C57_4A4BAA9A1FDE5A22_6039_UN""","""C[C@@H](OCC(NCC1=C(OC)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""15E1D1E4A92FAC94_1A981A96B52A76A7_6039_UN""","""C[C@@H](OCC(NC(CCC)(C)C(=O)OC)=O)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""624EEA59B2E48C15_5D54701AD3BD2359_6039_UN""","""C[C@@H](OCCOC1=C(C(OC)=O)C=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""0CAF6C3043EAA332_35E452958F0C4156_6039_UN""","""C[C@@H](OCC(NC1=C([N](=O)=O)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""43A69971DE14997A_B44220016BD31479_6039_UN""","""C[C@@H](OCC(=O)C1=CC2=C(C=C1)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""AA460C5EFA74EF78_9C84F0CB4EFE243E_6039_UN""","""C[C@@H](OCC(C1=CC=C(OC(F)F)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""E5E576867B83AE74_0ACEC34EF98EBE20_6039_UN""","""C[C@@H](OCC(NC1=CC=C(C(C)=O)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""E8F06D77D9765BCC_98940A5DB9287A9A_6039_UN""","""C[C@@H](OCC1=CC(=C(C=C1[N](=O)=O)F)OC)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""9596E831C35CEDCF_B1BB343E13C9C2B2_6039_UN""","""C[C@@H](OCCCCCCCCCCC(O)=O)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""5524F8978E79AE24_FEE3410583365A70_6039_UN""","""C[C@@H](OCC1=CC=C([S](N(C)C)(=O)=O)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A4F1B8C74483E2E5_9141B9A9B2C90769_6039_UN""","""C[C@@H](OCC(NC1=C(C(C)=O)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""15660FD41B03260C_D5BF4210327D5F02_6039_UN""","""C[C@@H](OCCC[S](C1=CC=CC(=C1)C)(=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""BD4404E08A99C574_4CAE484CEF34942E_6039_UN""","""C[C@@H](OCCCC1=C2C(=CN=C1)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""35BF11B2C9A9485F_87A7A26B22B16D76_6039_UN""","""C[C@@H](OCC1=CC(=NO1)C2=C(C)[N](N=C2)C)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""9057BB42278438F0_FE25CEF434F70062_6039_UN""","""C[C@@H](OCC(C1=CC=C(C(OC)=O)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""7FE42801B0FCB012_CA8FD4E5E1AFD7C4_6039_UN""","""C[C@@H](OCCCC1=NC2=C(C=C1)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""19AE58287D754148_43986B4EC9D4A735_6039_UN""","""C[C@@H](OCC2=N[N](C1=C(F)C=CC=C1)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""F2D456D591AADAC5_83035137069267F3_6039_UN""","""C[C@@H](OCC(=O)C2COC1=C(C=CC=C1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""CAA1BC83F731802A_E299788186F8979C_6039_UN""","""C[C@@H](OCC1=C(C)C=C(C=C1)[N]2C=NC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""210C96DD4BEF8C0D_70DDDC4CB7EFCE57_6039_UN""","""C[C@@H](OCC1=NN=N[N]1CC2CCOCC2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""51929A63153D86CC_FAAA01ABDFC7A487_6039_UN""","""C[C@@H](OCC1=CC(=C(C=C1)[N](=O)=O)OCC)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""3C1A726A9CADA6BC_1263C79D1A2671C5_6039_UN""","""C[C@@H](OCC2=CC1=C(N(C)C(=O)CC1)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""56DC99298B545EE5_0CCB8141E50FA664_6039_UN""","""C[C@@H](OCC1=C(C=C([N](=O)=O)C=C1)[N](=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""54CD84575C819614_E885EE146AF35230_6039_UN""","""C[C@@H](OCC1=NC(=CS1)C2=CC=C(C)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""2ECAFA6C24645112_F52C73BEEABCF95B_6039_UN""","""C[C@@H](OCCC2=C(C)N=C1SC=CN1C2=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""988228029B791E16_978A0D878AFBE321_6039_UN""","""C[C@@H](OCC(C1=NC=C(C(F)(F)F)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""DED0F09D1790B6B0_500D00FD3D654227_6039_UN""","""C[C@@H](OCC(=O)C2=C1C=CC=CC1=CC=N2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""EF4EB70A5C2EC61F_B686F8C4FF95E4A2_6039_UN""","""C[C@@H](OCC(C1=CN=C([S](C)(=O)=O)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""FE77F72A377F95E6_3CB67A327B6A14A2_6039_UN""","""C[C@@H](OCC(C1=CC(=NC=C1)C(F)(F)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""6626825B0952C602_DF9D3270ACBE96B7_6039_UN""","""C[C@@H](OCC1=C(F)C=C(C(=C1)F)C(F)(F)F)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""BA6EEFC4BD718327_ED026BFA1590970F_6039_UN""","""C[C@@H](OCC1=NN=N[N]1C2=CC=C(F)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D1DF90CCC7998A45_BD790014A7D4A60E_6039_UN""","""C[C@@H](OCC1=NOC(=C1)C2=CC=C(F)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""1FCB3ACF8FE68459_D790E121A14B5E32_6039_UN""","""C[C@@H](OCC1=NOC(=C1)C2=C(F)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""8F3228D4D5B252C7_E785765110E348EE_6039_UN""","""C[C@@H](OCC#CC1=CC=C(C(F)(F)F)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""39463A1DC55925E1_59EFC96219CC6C36_6039_UN""","""C[C@@H](OCC1=NN=N[N]1C2=CC=C(C)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""0E51B675C56A99B9_43E22A20F39B4820_6039_UN""","""C[C@@H](OCC(N1CCN([S](C)(=O)=O)CC1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""1CF763786B0DA249_6C065AF6CC949345_6039_UN""","""C[C@@H](OCC1=CC=C(C(C)C(F)(F)F)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""B6F367EACF24EEEB_33C3E2074EA975E0_6039_UN""","""C[C@@H](OCC1CN(CCO1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""62EE09AC6201DCCE_C2124EAF49E68314_6039_UN""","""C[C@@H](OCC2=CC1=C([N](C(C)C)N=C1)N=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""CD8D3E5E2B9F1521_9ED7B01FA963DEF8_6039_UN""","""C[C@@H](OCC(=O)NC(=O)NCC1=CC=CO1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""4FC3C3A6A5F2ABEA_AD485B2C353D0B13_6039_UN""","""C[C@@H](OCC(C1=C([N](C(C)C)C(=C1)C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""E3061DE35633B609_A33F30447BBD0952_6039_UN""","""C[C@@H](OCCC(NC(NCC(F)(F)F)=O)=O)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""D933D29A70E6B0DF_D4F6993FD7223C39_6039_UN""","""C[C@@H](OCC(N(C(C)C)C1CCCCC1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C7D767BE52BE1F9B_3B595021E5363EA3_6039_UN""","""C[C@@H](OCC(=O)C1CCCC2=C1C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""23333959389AD4C0_84646F6AAC0183BF_6039_UN""","""C[C@@H](OCC1=NC(=NO1)C2=NC=CC(=C2)C)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""FC8BF6A6FE08363D_FE7DC6A1CC4D6D2F_6039_UN""","""C[C@@H](OCC(=O)N(CC=C)CC1=CC=CS1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C231A320478C19F0_C67E7931838FB7ED_6039_UN""","""C[C@@H](OCC2ON=C(C1=CC=C(F)C=C1)C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""DB2967C16310363E_A6EB76AE82DAD8A0_6039_UN""","""C[C@@H](OCC1=NC(=NO1)C2=C(F)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""01A57EE49A732BB9_1023933C397773D7_6039_UN""","""C[C@@H](OCC(N(C)CC1=CC=C(C=C1)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""CD6D439FB18401B9_34A8FBF744832851_6039_UN""","""C[C@@H](OCC1=CSC(=N1)C2=CC=C(F)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""77D5C8DE93FDA320_E7CB35159A39D59A_6039_UN""","""C[C@@H](OCCOC1=CC=C([S](N)(=O)=O)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""85DC48B1C95C8BE2_988ECCF8D82886FE_6039_UN""","""C[C@@H](OCCOC1=CC=C([S](Cl)(=O)=O)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A9095D478256D745_873ADDF2DBBFC172_6039_UN""","""C[C@@H](OCCC1=NC=C(O1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""E5177568B7C77811_906EA27890189CD1_6039_UN""","""C[C@@H](OCC2=NC=C(C1=C(C)C=CC=C1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""0749788E7B7351E4_FFFD1466AEBE2A61_6039_UN""","""C[C@@H](OCCC(=O)NCCC1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""28F0CE1BD22641E9_EA4FB62C31DA0EE2_6039_UN""","""C[C@@H](OCC2=N[N](C1=CC=CC(=C1)F)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""244C90708E8965FE_39CA4A1F4544C6C4_6039_UN""","""C[C@@H](OCC(C1=CC=C(OC(C)C)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""E253BBA38119F24A_A8B38336B022F567_6039_UN""","""C[C@@H](OCC1=C(OCC)C=CC(=C1)[N](=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""1B4D913396BA4203_6479FD2C10CB6B3D_6039_UN""","""C[C@@H](OCC(N(CC)C1=C(C=CC=C1)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""958F8D89651FAF30_507090A4A9B2D079_6039_UN""","""C[C@@H](OCC1=COC(=N1)C2=CC=CC(=C2)F)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""B3A652692DFC462F_F59EFEACAB2B979D_6039_UN""","""C[C@@H](OCC(NC1=NC(=CC(=O)N1)OC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""9CD58C63C0998A84_D1DB04431AA2BEB3_6039_UN""","""C[C@@H](OCC(=O)NCCCC1CCCCC1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""F84CE1D9F9589D9A_B82002DF554A05F8_6039_UN""","""C[C@@H](OCC(NCCCN(C)[S](=O)(=O)C)=O)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""61631815BAB4A61F_E11432A85AC22CDC_6039_UN""","""C[C@@H](OCC1=C(C=C(C(C)C)C=C1)C(C)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""2C403EBE2A68F004_419C798A2321FFB8_6039_UN""","""C[C@@H](OCC2=NC=C(C1=CC=CC(=C1)F)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""CF246AA990131BCD_93627D60DD3056FA_6039_UN""","""C[C@@H](OCC1=CC=CC(=C1)C(C(F)(F)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""7645E1E7440FD68E_3DBE0D2BE5068407_6039_UN""","""C[C@@H](OCC1=CN=C(C=C1)C2=NC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D4AA5F3D416FFE34_AC8A3C8DD1A69987_6039_UN""","""C[C@@H](OCC1=C(F)C=C(C=C1)C2=NC=CO2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""4744CA52823FFEF9_25D9B01096A503FD_6039_UN""","""C[C@@H](OCCC2SC1=C(C=CC=C1)NC2=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""1C2BC36E85D52F6C_D9BF394A29C7CE2E_6039_UN""","""C[C@@H](OCC2CN(C1CCCCC1)C(=O)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""33D3D771B8EDE0C3_A5829AB8691C740C_6039_UN""","""C[C@@H](OCCC(C(OC)=O)C1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""5D21E0B4136F43C3_7A3E4384D4BACA0E_6039_UN""","""C[C@@H](OCC1=NN=C(OCC(F)(F)F)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""0AD05FAB63607D36_14AA953E9AB0F915_6039_UN""","""C[C@@H](OCC1=C(C=C(C(O)=O)C=C1)[N](=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""2C4BA539BAB2073A_A9C9263302D496BB_6039_UN""","""C[C@@H](OCC2=NC1=C(C=CC(=C1)C(O)=O)[NH]2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""C998050D13DFF7BB_F55E0EE7D4FE3F7B_6039_UN""","""C[C@@H](OCC1=CN=C(N=C1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""E537A0848B1E762E_143E18A1522E6DAE_6039_UN""","""C[C@@H](OCC2=NN=C(C1(OC)CCOC1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D6525D49860C42E8_EC7792F4B8ED1ED3_6039_UN""","""C[C@@H](OCCC2=CC1=C(OC(F)(F)O1)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""EDD453D550E2F32A_6F92EF85BD743368_6039_UN""","""C[C@@H](OCC(C1=C[NH]C2=C1C=C(F)C=C2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""27CAF8235571D528_CD4A80B069985E0D_6039_UN""","""C[C@@H](OCC1=C(C(OC)=O)C=CC=C1OC)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""9E9430E000F552FE_AC4564E931545C88_6039_UN""","""C[C@@H](OCC(C1=C(C=C([N](=O)=O)C=C1)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""7BB2CD5A1B079A6B_90570FA892046893_6039_UN""","""C[C@@H](OCC2=C1C=CC=CC1=C(OC)N=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""8AB4C52AD26159F8_226556EA015048CD_6039_UN""","""C[C@@H](OCC1=COC(=N1)C2=C(F)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""013EB3D7C5AED2D5_975949D5EF92C12F_6039_UN""","""C[C@@H](OCC(C1CCCC(C(F)(F)F)C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""319A2D88CB704755_C3B646F0ECEA4465_6039_UN""","""C[C@@H](OCC(C1=C(C)[NH]C(=C1)C(OC)=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""5AC1E8CE056FE3FC_14D376B4F609D7D7_6039_UN""","""C[C@@H](OCCC1=CC=CC2=C1OC(F)(F)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""4761E6F4B94C41A4_DFC2FB4D64A99B83_6039_UN""","""C[C@@H](OCC1=C(C(OCC)=O)C(=CC=N1)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""1EBADEFCB12B93FF_6A7C697E4D20B511_6039_UN""","""C[C@@H](OCCCOC1=CC=C([N](=O)=O)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A4E7448F979EE0A0_D8B8C02271270D34_6039_UN""","""C[C@@H](OCC1=C(C)C=CC2=C1C=CC(=C2)C)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""226D4AFF3D9D3F01_E268A1118128F566_6039_UN""","""C[C@@H](OCC1=NC2=C(O1)CC(C)(C)CC2=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""9F460BB4CCBAF3FD_C9748F399C7CBA3D_6039_UN""","""C[C@@H](OCC1=C(C)N=C(O1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D5C90634DA27F792_FA4F19C31BCBC3AA_6039_UN""","""C[C@@H](OCC1CCCC(O1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""950FD32F0E3C9482_7D477E002B0BC767_6039_UN""","""C[C@@H](OCC1=C(C=CC(=C1)C(OC)=O)OC)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""163BC6C5D26EB0B1_BA927EB7A9951E8B_6039_UN""","""C[C@@H](OCC(NC1=C(OCC)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""5BB28C92D79428BD_F8FAAD371AEBEC7A_6039_UN""","""C[C@@H](OCC(NC1=CC=C(C(N)=O)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""45A7762B4E36F977_7975D8F38531B907_6039_UN""","""C[C@@H](OCC1=C(CC)C=CC2=C1C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""E621E430E86736CD_008643AE0120296F_6039_UN""","""C[C@@H](OCC(NC1=CC=CC(=C1)[N](=O)=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""E38831FEAEDEEC48_4523520E353C9689_6039_UN""","""C[C@@H](OCC(=O)C1=CC2=C(C=C1)NC(=O)C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""F8D4D8E41B04981F_38DAE6D0ED29262F_6039_UN""","""C[C@@H](OCC(NCCC1=CC=C(F)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""9BAA0E587A7191EF_CD834FC146952AA0_6039_UN""","""C[C@@H](OCC(NC1=CC=C([N](=O)=O)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C44E8270E8A10159_8720F9890AB66295_6039_UN""","""C[C@@H](OCC(=O)NC1=CC2=C(C=C1)OCO2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""BC27DD878B210B04_D4EBB5037B1C3FC5_6039_UN""","""C[C@@H](OCC(N1C2=C(CC1C)C=CC=C2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""95D56B67D8D9D03E_E2703769DF713CC4_6039_UN""","""C[C@@H](OCC(=O)N1CCCC2=C1C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""86F914B80EBC19FB_48D2E45D387309D9_6039_UN""","""C[C@@H](OCC(NC1=C(C(C)C)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""50F5D28C89825257_61AAA5366278EB1B_6039_UN""","""C[C@@H](OCC(NC1=C(C(=C(F)C=C1)F)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""AB3FFB223E3084E3_98D4D05A507AEAFF_6039_UN""","""C[C@@H](OCC1=CC=C(C=C1)N2CCOCC2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""0E0B4DDD1444D1DF_6F8B553036176C69_6039_UN""","""C[C@@H](OCC(C2=CC1=C(C=CC(=C1)C)O2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""8F5157F835365270_A92A5170B2F4872B_6039_UN""","""C[C@@H](OCCC1=NN=N[N]1C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""366393E2F842CC83_C503AC9B9DB55BD2_6039_UN""","""C[C@@H](OCC(C1=CC=CC(=N1)C(OC)=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C4F8731D8CF9ADAF_23D3CF22756FB0EB_6039_UN""","""C[C@@H](OCC3CC1(CC2(C1)OCCO2)CO3)C4CCCC4""",21,"""B570B1CB70EF998E"""
+"""D31EBB505E885E50_FFBBCC00B31A5E89_6039_UN""","""C[C@@H](OCC1=NOC(=N1)C(OCC)OCC)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""4E322653F31683B9_A48AB4131F6B2501_6039_UN""","""C[C@@H](OCC(=O)N1CCO[C@@H]2CCCC[C@H]12)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""8E7D2AF50C6B8C11_B0FC58E790986931_6039_UN""","""C[C@@H](OCC2OC(=O)C1(CCC1)C23CCC3)C4CCCC4""",21,"""B570B1CB70EF998E"""
+"""FF3AEF86F1CD02E5_C15E528CA18B3FD3_6039_UN""","""C[C@@H](OCCOCCOCC1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""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"""
+"""3989C3663E85F8A5_0CB65CC1B22C3A85_6039_UN""","""C[C@@H](OCC(=O)NCC=CC1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""686761A64BC6FCAD_193805EEA60D027C_6039_UN""","""C[C@@H](OCC(=O)C23CC1CC(CC(C1)C2)C3)C4CCCC4""",21,"""B570B1CB70EF998E"""
+"""23E0AA0607A13035_881FAB5AD4EB8B67_6039_UN""","""C[C@@H](OCC(C1=C([N](CCC)C(=C1)C)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""8008E9EE8DAA3247_12A0CCA95E7E1FAA_6039_UN""","""C[C@@H](OCC(NCC1=CC=C(OC)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C6B6D1766EAEF85A_5AAD3B8C0F1DF888_6039_UN""","""C[C@@H](OCC(=O)C1=CC2=C(C=C1)NC(=O)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""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"""
+"""979988D86C707F1E_B9C426062163E8BD_6039_UN""","""C[C@@H](OCC(NC1=C(C(OC)=O)SC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""7997F532B1B41D25_E2F2C7125C06ACCF_6039_UN""","""C[C@@H](OCC(NC(C(CC)C)C(=O)OC)=O)C1CCCC1""",21,"""B570B1CB70EF998E"""
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+"""526F35A7925679CC_CC1ED9905656A827_6039_UN""","""C[C@@H](OCC1=NOC(=N1)CCCC(OC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
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+"""BD034369450AAC49_D91F3811DF15EC10_6039_UN""","""C[C@@H](OCCCC1=NC(=NO1)C2=CC=CS2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""0CD2E30023E9A8FA_2C9C0071A52701C0_6039_UN""","""C[C@@H](OCC(C1(NC(C(F)(F)F)=O)CC1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""3EFF930B0269B283_FA38A6E77AC72AD2_6039_UN""","""C[C@@H](OCCC(C(F)(F)F)N1CCOCC1)C2CCCC2""",21,"""B570B1CB70EF998E"""
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+"""77CB47681CEF666E_7A4B6BD82382989C_6039_UN""","""C[C@@H](OCC(NC1=CC=CC(=C1)C(N)=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""BFEAD5F96412DACE_C2820031C9D4769B_6039_UN""","""C[C@@H](OCC(C(C1=C(C)C=CC=C1)=O)(F)F)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""2C20083BC2A888C1_66DC641A20CF49B0_6039_UN""","""C[C@@H](OCC(C1=N[N](C)C2=C1C=CC=C2)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""D03B70E9B495FC74_13CA8EC4ACBC4CA2_6039_UN""","""C[C@@H](OCCCN1C(=O)NC2=C1C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""5D7B9585EA1EF09D_1705458E0D954589_6039_UN""","""C[C@@H](OCC(=O)N2CCC1=C(C=CC=C1)C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""6DEBBB9039025D42_F48AE7D89863B0AF_6039_UN""","""C[C@@H](OCC1=C(C=CC=C1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""27DF10FDF0003E78_972032FAF79FFBBE_6039_UN""","""C[C@@H](OCC2=C1C=CC=CC1=C(C=C2)C#N)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""8762BBA388B21660_963F267717FE7190_6039_UN""","""C[C@@H](OCCC1=C(OC(F)(F)F)C=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C33EB630440EB900_1BF00A23073E0FEF_6039_UN""","""C[C@@H](OCCCC1=CC(=C(OC)C=C1)OC)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""36CBBA1178054136_EBDFEE4988456E42_6039_UN""","""C[C@@H](OCC2=C(OC)N=C1C=CC=CC1=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""EE765475BF55443D_FBE5DFE099816565_6039_UN""","""C[C@@H](OCC1=NC(=CS1)C2=CC=C(F)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""99C39AB8D4C220DD_6D77A299AB8CF217_6039_UN""","""C[C@@H](OCC2=CC(=C1OCOC1=C2)C3CC3)C4CCCC4""",21,"""B570B1CB70EF998E"""
+"""75CEF5E66B807A01_9A45B1E89ADB6BBC_6039_UN""","""C[C@@H](OCC1=CC(=CC(=C1)[N](=O)=O)[N](=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""53987BA675793164_1149C7BBC29F8142_6039_UN""","""C[C@@H](OCC1=C(C=CC(=C1)C(OCC)=O)F)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""1D4D758B498F3D29_BFB3DD161E340AD3_6039_UN""","""C[C@@H](OCC2=N[N]1CCCC1=C2C(OC)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""1707B22856EB885C_C6D0CE0A52ED1BE3_6039_UN""","""C[C@@H](OCCC1(C(OCC)=O)CCCC1=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""B09CE07E4F44FBB7_61B4A1BCA2E7F31A_6039_UN""","""C[C@@H](OCC(N(C)CC1=C(C=CC=C1)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""8B6F0A8CF90BD297_AB9657E6AFE69E45_6039_UN""","""C[C@@H](OCC1=NC2=C([N]1CC)C=CC=C2F)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""1C70F705136F7805_E5E250B4E1C76701_6039_UN""","""C[C@@H](OCCCCCCOCCOCCC)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""83B88065A9BF62CE_BAAE269C4EB9E01D_6039_UN""","""C[C@@H](OCC1=NOC(=C1)CC2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""30D9FD5953FC3EB3_AF221E3DF236BDE6_6039_UN""","""C[C@@H](OCC1=COC(=N1)OC2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""3DD5AAC8AD908929_AD8914421A019861_6039_UN""","""C[C@@H](OCC1=CN=C(N=C1)C2=CN=CN=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""B724572C7E291AFF_06A6B97EC939FB6F_6039_UN""","""C[C@@H](OCC1=CC(=C(C=C1)C#N)C(OC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""F47D3FFA061BAEED_B1D00B1BA1A4765C_6039_UN""","""C[C@@H](OCC(=O)N(C1CC1)C2=CCCCC2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""6B01E9BC2A38BE7E_7858D043465B7DF1_6039_UN""","""C[C@@H](OCC2CCC1(CCCCCCC1)O2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""2000644585EF2597_6170790581E8A055_6039_UN""","""C[C@@H](OCC1=N[N](C=C1)CC2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""5DA231D7CD51F219_BA42DDF90C9F443E_6039_UN""","""C[C@@H](OCC1=COC(=N1)CC2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""CD1470196F682BF1_B3E216F84AF7286E_6039_UN""","""C[C@@H](OCC1=CC=CC(=C1)OCC(OC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""7D1718D6BF3707CB_5A76EFBAF4F42A42_6039_UN""","""C[C@@H](OCC1=CC=CC(=C1)[S](CCC)(=N)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""B183502B00EF0C54_E3389897EABA1481_6039_UN""","""C[C@@H](OCC1=C(C(OCC)=O)C=NC(=N1)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""099BB6F39C724AF4_9D2EDCCB74F09DDE_6039_UN""","""C[C@@H](OCC1=N[NH]C(=C1C)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""143646D0F830336F_2BA6EAC3ACA9B461_6039_UN""","""C[C@@H](OCC(C1=C(C)[N](C(=C1)C)CC#C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""8E5332ABE5EEA3D0_CF7ED57DB88D282E_6039_UN""","""C[C@@H](OCC1(O)CSC(=N1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""84ABAAB0E5A1CED9_78801D50AFEB17F3_6039_UN""","""C[C@@H](OCC1=CC=C(CCC(OC)=O)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""B088890E3C08103F_257E5453F65E0F89_6039_UN""","""C[C@@H](OCC(N(C(C)C)C1=CC=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""310EE094C43676EB_336D7C0025BA0A82_6039_UN""","""C[C@@H](OCCOCCO[Si](C(C)(C)C)(C)C)C1CCCC1""",21,"""B570B1CB70EF998E"""
+"""00DCC11242293334_66F3D62EAF7C6197_6039_UN""","""C[C@@H](OCC1=C(C=CC(=C1)OC)[S](=O)(=O)N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""EBC688E1B56D3C1A_EB605A507E92565E_6039_UN""","""C[C@@H](OCC2=N[N](C1=CC=C(C)C=C1)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""08CD11736EA8365A_3791EDFB311D0D98_6039_UN""","""C[C@@H](OCC1=C(C=CC(=C1)OC)[S](=O)(=O)F)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""D8BB0E315D31E642_8435D4626F7FC1DD_6039_UN""","""C[C@@H](OCC1=C(C)N=C(S1)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""6D54EA3D5C8C6A6E_84268E3D84E474EA_6039_UN""","""C[C@@H](OCC1=C(C=CC(=C1)OC)[S](=O)(=O)Cl)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""323FE9FEEA90B087_A9A9C71017BF2F5D_6039_UN""","""C[C@@H](OCC1=C(F)C=C(C=C1F)C(F)(F)F)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""AB957D697E17BDEF_E5F08600D4E4710C_6039_UN""","""C[C@@H](OCC1=CC=CC(=C1[N](=O)=O)C(O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""83B1425DD91CD576_D9D06589C211E6AF_6039_UN""","""C[C@@H](OCC1=NC2=C([N]1CC)C=CC(=C2)F)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""FF6494A69806965E_DDC7F7C5D7BED000_6039_UN""","""C[C@@H](OCC1=NOC(=N1)C2=CC=CC(=C2)F)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""ED0B5650E55A4C4F_43CFF1A2B1B28247_6039_UN""","""C[C@@H](OCC1=NOC(=N1)C2=C(F)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""2626DEC692419282_E25FC4206F7DFE58_6039_UN""","""C[C@@H](OCC([C@@H]1CC[C@H](C(F)(F)F)CC1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""15214C1EB0D76042_0E5D6BA0F0B0783D_6039_UN""","""C[C@@H](OCCOC1=CC=C(C(F)(F)F)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""171ED04739463BA3_E1C2B8A4D35C919B_6039_UN""","""C[C@@H](OCC(C1=CC=C(C(F)(F)F)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""E4D0BB4DDA75C14B_8796EB912A998049_6039_UN""","""C[C@@H](OCC1=NC(=CC(=N1)C(OCC)=O)C)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C63288F75A0F13F6_0AF9A41EFD6B080D_6039_UN""","""C[C@@H](OCC1=CC(=NO1)C2=CC=C(C)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""8F30881BCF1BA112_28AAE9304C4FA993_6039_UN""","""C[C@@H](OCC1=CSC(=N1)CC2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""909DF23C37C98DB5_43A89F67D3791E1A_6039_UN""","""C[C@@H](OCCCC1=CC2=C(C=C1)C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""9DABF4A6E21556E8_D044984BCCEFB338_6039_UN""","""C[C@@H](OCC2=NC1=C(C=CC=C1)C(N2C)=O)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""08EBF84B4B0B2106_1333EB8090B40ECF_6039_UN""","""C[C@@H](OCC(NCC1=CC(=C(C)C=C1)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""DFC5D47945AA342E_D42C27DEBF16B359_6039_UN""","""C[C@@H](OCCC(NC(C)C1=CC=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""E547CA5682B5AC62_D17F25C777EB3C4B_6039_UN""","""C[C@@H](OCCC(NC1=CC(=C(F)C=C1)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A2E1352E3DBC6DC2_B06ED21E106D408C_6039_UN""","""C[C@@H](OCC(NC1=NN=C(CCCC)S1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""A0FC152E0E74159E_ECB22CC60B17630E_6039_UN""","""C[C@@H](OCC(=O)NCC#CC1=CC=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""3B055C9F83F38D4E_23FD6502F80CCDD7_6039_UN""","""C[C@@H](OCC1=NOC(=N1)C2=CN=CC(=C2)C)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""387E2671C107702D_35350D5B2D8F5483_6039_UN""","""C[C@@H](OCC(C1=C(OC(F)F)C=CC=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""87C273F87A404980_BB1A312D9F674ED1_6039_UN""","""C[C@@H](OCC1=C(OCC(F)(F)F)C=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""D70EAC94A99A572B_87DCC600456F97BA_6039_UN""","""C[C@@H](OCC(N1CCC(C(OC)=O)CC1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""9835889DC700C739_1433295430650630_6039_UN""","""C[C@@H](OCC1=C(OC(F)F)C=C(C=C1)C#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""B9EA2775AE373985_78BD3FC44F19410B_6039_UN""","""C[C@@H](OCC1=CN=C[N]1CC2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""214DDD8371DB0CA9_1633590B6687460C_6039_UN""","""C[C@@H](OCC1=N[N](C(=C1)C)C2=CC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""A57E0BDAF8AB327E_BD31A876B077F67C_6039_UN""","""C[C@@H](OCC1=CSC(=N1)C2=CC=C(C)C=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""7EC66008076327C2_DF7F74AC396EF3F3_6039_UN""","""C[C@@H](OCC(C1=CN=C(C(F)(F)F)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""50C755EED32C5579_EFF7ED0A65DD3713_6039_UN""","""C[C@@H](OCCOC1=CC=C([S](C)(=O)=O)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""6F56B02B26A9D283_AA4939A8BD8E3D63_6039_UN""","""C[C@@H](OCC1=C(C(F)(F)F)C=C(C=C1)C#N)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""949D6EDCEABFB7EE_184087FC072E86C6_6039_UN""","""C[C@@H](OCC(N=C1C=CNN1CCCC)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""2A9C744B9FF4E397_3E9BC956C05C4515_6039_UN""","""C[C@@H](OCC(NCC1=CC(=CC(=C1)F)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""941014A6111AEBDD_29A594A6126B8B4D_6039_UN""","""C[C@@H](OCC(N(C(C)C1=CC=CC=C1)C)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""DDE0231EC4C2BB4C_D4CFD51D08F5CEA7_6039_UN""","""C[C@@H](OCCOC1=C(C(F)(F)F)C=CC=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""C4D67314DE7790A2_41541DC2D963388D_6039_UN""","""C[C@@H](OCC(C1=CC=CC(=C1)[S](C)(=O)=O)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""1D18546AFB928003_CDC0619730471BF1_6039_UN""","""C[C@@H](OCC1=CSC(=N1)CC2=NC=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""3A61DA8BAD7405AE_7BE796ABFE10854B_6039_UN""","""C[C@@H](OCC1=CC=C([S](C(C)C)(=O)=O)C=C1)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""9D183F0F27773304_A9D1710DF85E7A82_6039_UN""","""C[C@@H](OCC(C1=CN=C(OC(F)F)C=C1)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""3E272B1C23989742_0807C1A73CFCE350_6039_UN""","""C[C@@H](OCC(=O)C1CCOC2=C1C=CC=C2)C3CCCC3""",21,"""B570B1CB70EF998E"""
+"""3900EF2BCD75AEFD_FF3BF4B76646FBC2_6039_UN""","""C[C@@H](OCC(N[C@H](C)C1=CC=C(C=C1)F)=O)C2CCCC2""",21,"""B570B1CB70EF998E"""
+"""97B5AD6360B7DD1D_E1F5B0C2F43F0BD3_6039_UN""","""CC1=CC(=CC=C1)CCOCC2=NOC(=N2)C3=CSC=C3""",21,"""5BB684EF631783D5"""
+"""F33701CA2CFDBDA0_20DA983EB7142951_6039_UN""","""CC1=CC(=CC=C1)CCOCC2=CSC(=N2)C3=CC=CO3""",21,"""5BB684EF631783D5"""
+"""09EB0C28BDA06D0F_D54FCA44E6F4A53F_6039_UN""","""CC1=CC(=CC=C1)CCOCC2=CSC(=N2)C3=CC=CS3""",21,"""5BB684EF631783D5"""
+"""FD38D03240C415DD_9A5CB6EB1A8008E9_6039_UN""","""CC1=CC(=CC=C1)CCOCCOC2=CC=CC(=C2)CC""",21,"""5BB684EF631783D5"""
+"""2F43EF3BCD4C8553_72A14DE850504211_6039_UN""","""CC1=CC(=CC=C1)CCOCCC(C2=CC=C(F)C=C2)=O""",21,"""5BB684EF631783D5"""
+"""221C81FDDBFF3789_5073C7155B4D5472_6039_UN""","""CC1=CC(=CC=C1)CCOCCCOC2=C(C)C=CC=C2""",21,"""5BB684EF631783D5"""
+"""45DA03ECC5D65F48_1EFD4B958983FCC9_6039_UN""","""CC1=CC(=CC=C1)CCOCCOC2=CC(=CC=C2)C#N""",21,"""5BB684EF631783D5"""
+"""9957DC399B58C76E_3465A8945293A368_6039_UN""","""CC1=CC(=CC=C1)CCOCC(C2=CC(=C(C)C=C2)C)=O""",21,"""5BB684EF631783D5"""
+"""FB0FDE6DE14248C9_E6A041246A985956_6039_UN""","""CC1=CC(=CC=C1)CCOCC(C2=CC(=C(F)C=C2)F)=O""",21,"""5BB684EF631783D5"""
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+"""14977F2878A93EBA_7377EA3527577F8D_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C(C(O)=O)C=CC(=C2)F)=O""",21,"""5EF32745EFF65DC8"""
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+"""D6249A42575AA3E7_838DE18628C1C9D9_6039_UN""","""O(C[C@H]1CCCO1)CC3=NC2=C(N(C(N(C)C2=O)=O)C)[NH]3""",21,"""5EF32745EFF65DC8"""
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+"""1602E1C0730B5B77_08463F1114D5AC45_6039_UN""","""O(C[C@H]1CCCO1)CC3=C(OCC)C=C2CC(OC2=C3)C""",21,"""5EF32745EFF65DC8"""
+"""253F60E68FFF5581_D2D2DBE1C6829E4A_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC(=NO2)C3=C(OC)C=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""6963D4DAB51C47CD_F08108B1EE7A32AF_6039_UN""","""O(C[C@H]1CCCO1)CC(NCC2=CC=C(N(C)C)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""DDAA7B63D66E3970_938DBE104FD9E6E7_6039_UN""","""O(C[C@H]1CCCO1)CC(NC(C)C2=C(C=C(C=C2)F)F)=O""",21,"""5EF32745EFF65DC8"""
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+"""C6C3C136CA004563_21CA8548531C0BA3_6039_UN""","""O(C[C@H]1CCCO1)CCCC(NC2=C(C)C=CC=C2C)=O""",21,"""5EF32745EFF65DC8"""
+"""50EA617B76D27B9E_83DA6EB41A06DEBC_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)N(CC2=CC=CC=C2)C3CC3""",21,"""5EF32745EFF65DC8"""
+"""D8DC40CAEC656E28_E27DA753437D618F_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC=C(O2)[S](=O)(=O)N3CCCC3""",21,"""5EF32745EFF65DC8"""
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+"""999459AF8CC8B7C2_EE139C255519A5C1_6039_UN""","""O(C[C@H]1CCCO1)CC(NCCOC2=CC=CC(=C2)F)=O""",21,"""5EF32745EFF65DC8"""
+"""F6A35790A9B218DF_3A314870F2A1FAF8_6039_UN""","""O(C[C@H]1CCCO1)CC(NCCOC2=CC=C(F)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""236EBE5ACAC87EA1_F1050B6775188213_6039_UN""","""O(C[C@H]1CCCO1)CC(NCC2=CC=CC(=C2)OCC)=O""",21,"""5EF32745EFF65DC8"""
+"""4DF4F2B260BA41BD_8CA0AF036D97335E_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC(=N[N]2C)C(C)(C)C)=O""",21,"""5EF32745EFF65DC8"""
+"""76B23586115ACDD6_8C9B447736077DA5_6039_UN""","""O(C[C@H]1CCCO1)CC(N(CC2=CC=C(C)O2)C3CC3)=O""",21,"""5EF32745EFF65DC8"""
+"""70DF7C7DBD5C37E9_7D7443FFDB6466DF_6039_UN""","""O(C[C@H]1CCCO1)CC(N(C)C3=NC2=C(C=CC=C2)S3)=O""",21,"""5EF32745EFF65DC8"""
+"""C6322080F5C23D9A_9D40720C3E67839F_6039_UN""","""O(C[C@H]1CCCO1)CC(NCC2=CC=CC(=C2)COC)=O""",21,"""5EF32745EFF65DC8"""
+"""9E9729617D88250B_5B5B578031F60DE9_6039_UN""","""O(C[C@H]1CCCO1)CC(NCCOC2CCCCC2C)=O""",21,"""5EF32745EFF65DC8"""
+"""3BF25195A561539C_7A62682B71B9247F_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NCC3CC2=C(C=CC=C2)O3""",21,"""5EF32745EFF65DC8"""
+"""F7020A21C0A59BA9_CE63FAB5F88CD037_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NC2(CCC2)C3=CC=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""D21BE40873A23BDD_061A0659F72706DC_6039_UN""","""O(C[C@H]1CCCO1)CC(N2CCC(C)C3CCCCC23)=O""",21,"""5EF32745EFF65DC8"""
+"""6232DEA8B6977FAB_C411ECA520527F22_6039_UN""","""O(C[C@H]1CCCO1)CC(NC(C)C(=O)N2CCCCC2)=O""",21,"""5EF32745EFF65DC8"""
+"""A835FB66FCA5412D_295366DD7E3913C8_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)N2CCN(CC2)C(=O)C3CC3""",21,"""5EF32745EFF65DC8"""
+"""BF50411B35A8475C_AB4614B149741FA4_6039_UN""","""O(C[C@H]1CCCO1)CCCOC3=C2C=CC=CC2=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""BB6D08EFF771473A_7CC65E1691098671_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C[N](CC(NC)=O)N=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""CDFE2BAB7625A393_7B97A44FBD95CC79_6039_UN""","""O(C[C@H]1CCCO1)CCCC2=NN=N[N]2C3=CC=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""5D5C9F5212371364_87A55EBCA80065C1_6039_UN""","""O(C[C@H]1CCCO1)CC2=COC(=N2)C3=CC=C(C=C3)C#N""",21,"""5EF32745EFF65DC8"""
+"""81A977B9F554CDDB_A3B3506FA64CB9D4_6039_UN""","""O(C[C@H]1CCCO1)CC3=NC=C(C2=CC=C(OC)C=C2)O3""",21,"""5EF32745EFF65DC8"""
+"""D2CD85DF02290FD1_3CDE846D2852BA60_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)C2=CC3=C(C=C2)OCC(=O)N3""",21,"""5EF32745EFF65DC8"""
+"""1B1D347C48BC5382_D9C469C859ECFC51_6039_UN""","""O(C[C@H]1CCCO1)CC2=C(C=CC=C2)OC3=CN=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""D69E5BAED544DFBD_04ECFFEF16970595_6039_UN""","""O(C[C@H]1CCCO1)CC2=NN=N[N]2C3=C(C=CC(=C3)C)F""",21,"""5EF32745EFF65DC8"""
+"""4F88E47A06E707BC_72ADD38A9258EFF0_6039_UN""","""O(C[C@H]1CCCO1)CC(C2=CC=C(N[S](C)(=O)=O)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""97BD8D7BD3606B9F_47567F02398BDCB4_6039_UN""","""O(C[C@H]1CCCO1)CC2=NC3=C(N(C)C2=O)C=CC(=C3)F""",21,"""5EF32745EFF65DC8"""
+"""79AAFB7406A80768_C0408D5679559853_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C([S](N)(=O)=O)C=CC=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""DA00F9D2804B1C95_FEAD89ED217DDB8B_6039_UN""","""O(C[C@H]1CCCO1)CC3=C[N]2C=CC=C(C(OC)=O)C2=N3""",21,"""5EF32745EFF65DC8"""
+"""D3F13A98E4942CF7_79A7303413E90A15_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC=CC(=C2)C(NCC(C)C)=O""",21,"""5EF32745EFF65DC8"""
+"""367C6769B237F7D7_88E2821274CEE7F2_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=NN=C(CC(F)(F)F)O2)=O""",21,"""5EF32745EFF65DC8"""
+"""0959910A8C070202_1D83AA6ADC87B7FE_6039_UN""","""O(C[C@H]1CCCO1)CCCOC2=CC3=C(C=C2)C=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""E5EFCB3470823B76_2B7788382B076D11_6039_UN""","""O(C[C@H]1CCCO1)CCCOC2=CC=CC(=C2)C(C)(C)C""",21,"""5EF32745EFF65DC8"""
+"""493435D1003E56D7_FB341774C83DA533_6039_UN""","""O(C[C@H]1CCCO1)CC2=CSC(=N2)N(CCOC)C(=O)C""",21,"""5EF32745EFF65DC8"""
+"""9FDC1FD1479F383E_6E0FD1B2155392BC_6039_UN""","""O(C[C@H]1CCCO1)CC3ON=C(C2=C(F)C=CC=C2F)C3""",21,"""5EF32745EFF65DC8"""
+"""24F07CF2FD8F7A21_FDAF31E7A1CC6EB3_6039_UN""","""O(C[C@H]1CCCO1)CC(C2=CC=C(OCC(N)=O)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""6A72515A7ECE88C9_1D8675952A2A0A7C_6039_UN""","""O(C[C@H]1CCCO1)CCC(=O)NCC(=O)C2=CC=CC=C2""",21,"""5EF32745EFF65DC8"""
+"""BC26DF26AC47355A_27C482751356765E_6039_UN""","""O(C[C@H]1CCCO1)CC(C[S](C2=CC=C(C)C=C2)(=O)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""75EA3252E595A23A_DFDEB90D74975AB9_6039_UN""","""O(C[C@H]1CCCO1)CC(C2=CC=C(CCC(N)=O)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""46DEDABE511801DB_A9C3A114C982F99D_6039_UN""","""O(C[C@H]1CCCO1)CCOC2=C(C=C(OC)C=C2)[N](=O)=O""",21,"""5EF32745EFF65DC8"""
+"""DBD9218BF15472C9_BB1CAEF099B284F7_6039_UN""","""O(C[C@H]1CCCO1)CC2=NN=C(O2)C3=CC=C(C=C3)C#N""",21,"""5EF32745EFF65DC8"""
+"""13E7509423A33802_F4D8633E233D1941_6039_UN""","""O(C[C@H]1CCCO1)CC2=NN=C(O2)C3=CC(=CC=C3)C#N""",21,"""5EF32745EFF65DC8"""
+"""8D30E9943D7D9B78_A9F2F2F5060C8F41_6039_UN""","""O(C[C@H]1CCCO1)CC3=NC=C(C2=CC=CC(=C2)OC)O3""",21,"""5EF32745EFF65DC8"""
+"""7DD2A3D97EBEC488_87AA5A183223B9B5_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)C2=C[N](N=C2)C3=CC=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""7825BEC0C2FB7045_266C91D7476D9C79_6039_UN""","""O(C[C@H]1CCCO1)CC3=NC=C(C2=C(OC)C=CC=C2)O3""",21,"""5EF32745EFF65DC8"""
+"""38602FFAA4C04888_034A4584E5B4154A_6039_UN""","""O(C[C@H]1CCCO1)CC2CC(=NO2)CCC3=CC=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""00DA3B5561BC6777_0BF22A22BBF1E0DD_6039_UN""","""O(C[C@H]1CCCO1)CC2=NC(=NO2)CC3=C(C)C=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""5C8A334EBE714181_CAA3307E1645159E_6039_UN""","""O(C[C@H]1CCCO1)CC2=NOC(=N2)CC3=C(C)C=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""C832672A1C94B76F_69FABDEEA6936FBA_6039_UN""","""O(C[C@H]1CCCO1)CC(NCC2=C(COC)C=CC=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""66ADE36872EFAFCD_6058AA0EEE2932EA_6039_UN""","""O(C[C@H]1CCCO1)CC(C2=C(CC)C(=C([NH]2)C)C(=O)C)=O""",21,"""5EF32745EFF65DC8"""
+"""A21051D77CB7AD90_C3A9B245BAF6EE10_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NCCCOC2CCCCC2""",21,"""5EF32745EFF65DC8"""
+"""343FD341E086F71A_2EF2857C19C3CCCA_6039_UN""","""O(C[C@H]1CCCO1)CCCN2C(CSC2=CC(OC)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""9067EC12219BF7AB_78F85FBF486B490A_6039_UN""","""O(C[C@H]1CCCO1)CC3=NN=C(CC2=C(C)C=CC=C2)O3""",21,"""5EF32745EFF65DC8"""
+"""596E057C5FB4E95A_42BB90CF9CBDE5D6_6039_UN""","""O(C[C@H]1CCCO1)CC2=NC(=NO2)C3=CC(=C(F)C=C3)F""",21,"""5EF32745EFF65DC8"""
+"""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"""
+"""13B411E4F8949079_FAF1F711CD0A3876_6039_UN""","""O(C[C@H]1CCCO1)CC(N(C(C)C2=CC=C(C=C2)F)C)=O""",21,"""5EF32745EFF65DC8"""
+"""CB0B8EB03EB5D165_B28776C6C8E0554E_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NC(=O)OCC2=CC=CC=C2""",21,"""5EF32745EFF65DC8"""
+"""2AF5F3CCC17DDE0C_CC83A6E580A94DA5_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)N2CC(=O)NC3=C2C=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""5EF56F824C768D94_AED488D213563063_6039_UN""","""O(C[C@H]1CCCO1)CC(N2CCCCC2C(OCC)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""D34678A863C2A44A_731858D1F8AD1C4B_6039_UN""","""O(C[C@H]1CCCO1)CC2=C(C=CC=C2)OC3=CC=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""C2CB87F179D2A6CB_9A444073C5719292_6039_UN""","""O(C[C@H]1CCCO1)CC(NC(C)C2=CC(=C(C=C2)C)C)=O""",21,"""5EF32745EFF65DC8"""
+"""DE7473ADBD43E8B9_BFA9E9CDFD94BC9F_6039_UN""","""O(C[C@H]1CCCO1)CC3=NN=C(C2=CC=C(OC)C=C2)O3""",21,"""5EF32745EFF65DC8"""
+"""FF3A93E27265BA6E_FCFDE17A0AF85E3B_6039_UN""","""O(C[C@H]1CCCO1)CC(N(C(C)C2CC2)CC(F)(F)F)=O""",21,"""5EF32745EFF65DC8"""
+"""A0E39E9A199DF298_75370BCA17276F44_6039_UN""","""O(C[C@H]1CCCO1)CC(N(CCC)C2CC[S](=O)(=O)C2)=O""",21,"""5EF32745EFF65DC8"""
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+"""D6EB14147B11E717_822A40DDA3B6554E_6039_UN""","""O(C[C@H]1CCCO1)CC#CC2=CC=C(OC(F)(F)F)C=C2""",21,"""5EF32745EFF65DC8"""
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+"""73FF9FD022F41EE5_B5132D1870C33A7C_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NC3=C2C=CC=CC2=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""F4A66FF8174401CD_F733A16AB65A3CEC_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC=C(C(CC)C)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""15C726470288B855_ACEDAB25A106DD51_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C(OC(F)F)C=CC=C2)=O""",21,"""5EF32745EFF65DC8"""
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+"""DEDD3D155EE73F09_FC01807C1221EA2E_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC(=C(C=C2)F)[N](=O)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""CE4DF7C660872E67_95CB9EAD3D66F8F8_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C(C=CC(=C2)OC)OC)=O""",21,"""5EF32745EFF65DC8"""
+"""A8BFF35A7B65CD88_89F0A15524B9FE85_6039_UN""","""O(C[C@H]1CCCO1)CC[S](C2=CC=C([N](=O)=O)C=C2)(=O)=O""",21,"""5EF32745EFF65DC8"""
+"""194A64A4612205E7_7F1125176B09A8FF_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C(C(C)C)C=CC=C2C)=O""",21,"""5EF32745EFF65DC8"""
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+"""8C47B653BA270892_0D2D13D77873F23E_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC=C(C(C)(C)C)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""758ED27470E1FAD4_0344F2797B0E5CF0_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NCC2=CC3=C(C=C2)OCO3""",21,"""5EF32745EFF65DC8"""
+"""C3A5E39EF6FC2641_BEDD228049326A27_6039_UN""","""O(C[C@H]1CCCO1)CC2=NC(=CS2)C3=C(F)C=CC=C3F""",21,"""5EF32745EFF65DC8"""
+"""7C1309D5BAACA0F7_92B4AE3C4E011B81_6039_UN""","""O(C[C@H]1CCCO1)CC3=NC2=CC(=C(C=C2[NH]3)OC)OC""",21,"""5EF32745EFF65DC8"""
+"""D783BC371D581753_80A60220206FA831_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC=C(NC(C)=O)C=C2)=O""",21,"""5EF32745EFF65DC8"""
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+"""0F77A95810D71506_7398872BC170FDAD_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC=CC(=C2)[S](N)(=O)=O)=O""",21,"""5EF32745EFF65DC8"""
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+"""098321D0029A4C7F_46BC7E64B16460FE_6039_UN""","""O(C[C@H]1CCCO1)CCC[S](C2=C(OC)C=CC=C2)(=O)=O""",21,"""5EF32745EFF65DC8"""
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+"""D7DD4AF76CB581ED_8030678A4E3429E0_6039_UN""","""O(C[C@H]1CCCO1)CC3=N[N](C2=C(C=C(F)C=C2)F)C=C3""",21,"""5EF32745EFF65DC8"""
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+"""98995F12253855E3_6362324EFB0ABDDA_6039_UN""","""O(C[C@H]1CCCO1)CC(N[S](C2=CC=C(C)C=C2)(=O)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""09C87759EE967CFF_8B85C172F4F524FB_6039_UN""","""O(C[C@H]1CCCO1)CCC(=O)C2=CC3=C(C=C2)OCCO3""",21,"""5EF32745EFF65DC8"""
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+"""54EFDA615F986B45_CD43F5DBA7857962_6039_UN""","""O(C[C@H]1CCCO1)CC(C2=CC=C(OCCCC)C=C2)=O""",21,"""5EF32745EFF65DC8"""
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+"""D014D7B1607989DE_891EF05655627C74_6039_UN""","""O(C[C@H]1CCCO1)CC2=NOC(=C2)C3=CC=CC(=C3)OC""",21,"""5EF32745EFF65DC8"""
+"""CA784CC0B7AF4E06_16BD24453CE370D6_6039_UN""","""O(C[C@H]1CCCO1)CC2=C(C=CC(=C2)[N](=O)=O)C(F)(F)F""",21,"""5EF32745EFF65DC8"""
+"""8975C6003DDDDFAF_213395FE89C4D1EE_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NC2=CC3=C(C=C2)OCCO3""",21,"""5EF32745EFF65DC8"""
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+"""7E5459EA5D5DBFDD_B7F11D6F7D658C4E_6039_UN""","""O(C[C@H]1CCCO1)CC2=NC(=NO2)C3=CC(=NC=N3)OC""",21,"""5EF32745EFF65DC8"""
+"""95C03828E5108FA7_A0F8C2B18045E2D5_6039_UN""","""O(C[C@H]1CCCO1)CC(NC3=NC2=C(C=C(F)C=C2)S3)=O""",21,"""5EF32745EFF65DC8"""
+"""14879EA896D45996_19A91DEB74BE62CE_6039_UN""","""O(C[C@H]1CCCO1)CC(NCCC2=C(OC)C=CC=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""C20A601873C6AB8D_B754F7C2CCC6C1A3_6039_UN""","""O(C[C@H]1CCCO1)CCC(NC2=C(OCC)C=CC=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""58C47536F79768FA_5DFBEF0FE5505551_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC(=C(C=C2)N3CCCCC3)C""",21,"""5EF32745EFF65DC8"""
+"""5B5ECC1D0D2A4170_89BD9CF804110E16_6039_UN""","""O(C[C@H]1CCCO1)CC2=C(C=CC(=C2)OC)OC(F)(F)F""",21,"""5EF32745EFF65DC8"""
+"""5E1D018A8B5A8794_E51B5603290CAB73_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC=C(C=C2)C(=O)N3CCCC3""",21,"""5EF32745EFF65DC8"""
+"""09D5998A3620767C_F78C9F10D066A692_6039_UN""","""O(C[C@H]1CCCO1)CCNC(=O)NC2=CC(=CC=C2)C#N""",21,"""5EF32745EFF65DC8"""
+"""00F7544DEF64D1E5_EB766312F0E22F0A_6039_UN""","""O(C[C@H]1CCCO1)CC2=NC(=NO2)CC3=CC=CC(=C3)F""",21,"""5EF32745EFF65DC8"""
+"""38FA44308EE321BB_6986B69CDE4BC560_6039_UN""","""O(C[C@H]1CCCO1)CCC(=O)N3CCC2=C(C=CC=C2)C3""",21,"""5EF32745EFF65DC8"""
+"""C97D0DB69A05032F_A73AE8ECABCDF56F_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C(C)C=CC(=C2)[N](=O)=O)=O""",21,"""5EF32745EFF65DC8"""
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+"""E89344E3D4A176C5_F0D2A1254E711370_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC(=CC=C2)CN3CCCCC3""",21,"""5EF32745EFF65DC8"""
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+"""293DAB6597A4C26B_6A60F47C0FE74E02_6039_UN""","""O(C[C@H]1CCCO1)CC3=C2C=CC=CC2=C(C(O)=O)C=C3""",21,"""5EF32745EFF65DC8"""
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+"""EE2A19F1412BA8F2_3C9D83893F7E8909_6039_DP""","""O(C[C@H]1CCCO1)CC(N[C@H](C(O)=O)C2=CC=CC=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""B030D974FBC673D1_0F8E39E59C0413E8_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC(=CC=C2)CN3CCOCC3""",21,"""5EF32745EFF65DC8"""
+"""E3BE458B83F6B39C_1758376CE2131A25_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC=C(C=C2)CN3CCOCC3""",21,"""5EF32745EFF65DC8"""
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+"""2369C79686E59958_6CE62E6F34B484E7_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)C2=CSC(=N2)N3CCCCC3""",21,"""5EF32745EFF65DC8"""
+"""E7E13974ACD3AE89_9F2808A5297F909C_6039_UN""","""O(C[C@H]1CCCO1)CC3=NC2=C(C=CC(=C2)C(OC)=O)[NH]3""",21,"""5EF32745EFF65DC8"""
+"""F5599D8EF57D276F_6EB53248C0FD05FF_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC=C(C=C2)[S](=O)(=O)NC3CC3""",21,"""5EF32745EFF65DC8"""
+"""A547568C04993A2B_C3F42B44C1BB3A49_6039_UN""","""O(C[C@H]1CCCO1)CC3=CC=C(C2(C(F)(F)F)N=N2)C=C3""",21,"""5EF32745EFF65DC8"""
+"""08D3FCBD55CDAFF0_B95215EFCA325CD4_6039_UN""","""O(C[C@H]1CCCO1)CC#CC2=CC=CC(=C2)OC(F)(F)F""",21,"""5EF32745EFF65DC8"""
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+"""460C2AB4437F49FB_80CAAF1200803736_6039_UN""","""O(C[C@H]1CCCO1)CC2=C3C(=C(N(C)C)N=C2)C=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""8A7808B40276AAA6_493086A665580975_6039_UN""","""O(C[C@H]1CCCO1)CC2=COC(=N2)C3=CC(=CC=C3)C#N""",21,"""5EF32745EFF65DC8"""
+"""7D1B59DB6582C623_80B50776C32E5476_6039_UN""","""O(C[C@H]1CCCO1)CCC(C(C)=O)(C#N)C2=CC=CC=C2""",21,"""5EF32745EFF65DC8"""
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+"""CA62EB8D7796DECB_6F0A6BD92E8A8C16_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C(C=C(C)C=C2)[N](=O)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""BD263FF18FF62E1A_D6F6ABB47E48CD4C_6039_UN""","""O(C[C@H]1CCCO1)CC3CN=C(C2=CC=C(OC)C=C2)S3""",21,"""5EF32745EFF65DC8"""
+"""47F8F3F4EF7FD855_115720D3B247A824_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)C2=CC3=C(C=C2)OCCCO3""",21,"""5EF32745EFF65DC8"""
+"""3C14B8E75562BB31_250F972D091DDD4E_6039_UN""","""O(C[C@H]1CCCO1)CC2=C(C=C([N](=O)=O)C=C2)C(F)(F)F""",21,"""5EF32745EFF65DC8"""
+"""739FB548C121DB59_5DD5BC7EEBCF5C99_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC(=C(C)C=C2)[N](=O)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""CD43BB79950598AA_E13820B3C1F2A69A_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)N(CCC#N)C2=CC=CC=C2""",21,"""5EF32745EFF65DC8"""
+"""291EFD3BF9F019CF_D4DBF3DB29F5589E_6039_UN""","""O(C[C@H]1CCCO1)CC(NCCC2=CC=C(OC)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""4D6D6C513D38DDCF_7DB920D5948E0778_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NC2CCCC3=C2C=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""AB9FB144C150EC1E_72D2258DAE245349_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C([N](=O)=O)C=C(C=C2)F)=O""",21,"""5EF32745EFF65DC8"""
+"""6715EC706291CEE1_5703EA6B42462CAE_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC=C(OC(F)F)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""EF9BC99185AD7987_72B9172A91B637FF_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC=CC(=C2C)[N](=O)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""1BB93517D0E7E602_FAF94B36ED94229D_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C(C(C)(C)C)C=CC=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""CCE525128039D46B_197DEBE7EEA2206B_6039_UN""","""O(C[C@H]1CCCO1)CC(N(C(C)C)CC2=CC=CC=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""DA4BB75C4B0B9168_22B7EB59D11BF0F7_6039_UN""","""O(C[C@H]1CCCO1)CC2=NC3=C(S2)C(C)(C)CC(C)(C)C3""",21,"""5EF32745EFF65DC8"""
+"""542CF06BF0847257_2E7B5E033356D2FF_6039_UN""","""O(C[C@H]1CCCO1)CC3=NC2=CC=CC(=C2[S](N3)(=O)=O)F""",21,"""5EF32745EFF65DC8"""
+"""2FEF4525F1D6E154_5D4D6541E8875CBD_6039_UN""","""O(C[C@H]1CCCO1)CC3=NC2=C(C(O)=O)C=C(C=C2[NH]3)F""",21,"""5EF32745EFF65DC8"""
+"""C9C9591B01B165D8_A27D2A830467BCED_6039_UN""","""O(C[C@H]1CCCO1)CC2=NC=CC(=C2C)OCC(F)(F)F""",21,"""5EF32745EFF65DC8"""
+"""29693E5F48BAD134_A519FAE58C86ABC7_6039_UN""","""O(C[C@H]1CCCO1)CC#CCOC2=CC=C(C(C)=O)C=C2""",21,"""5EF32745EFF65DC8"""
+"""0A70F1F68FD5642E_286AFADF5855F43D_6039_UN""","""O(C[C@H]1CCCO1)CC2=NC=C(O2)C3=CC=C(C=C3)C#N""",21,"""5EF32745EFF65DC8"""
+"""C20BC7A568C5B970_598FAF193C08C617_6039_UN""","""O(C[C@H]1CCCO1)CC#CC2=CC=CC(=C2)OCCOC""",21,"""5EF32745EFF65DC8"""
+"""2C890399CCAFEAB5_4E0CFD40FE65F202_6039_UN""","""O(C[C@H]1CCCO1)CC(NNC(C2=C(F)C=CC=C2)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""2E40FBE6DE043091_4276F32C106A6ACF_6039_UN""","""O(C[C@H]1CCCO1)CC(C2=CC=C(CNC(C)=O)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""6F3351659D915DE9_EAD5AEABECCA6AA8_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C(C(F)(F)F)C=CC=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""6DF79158D95E0B6F_A9BD6E4D3744D994_6039_UN""","""O(C[C@H]1CCCO1)CCC(NC2=CC=C(C(C)=O)C=C2)=O""",21,"""5EF32745EFF65DC8"""
+"""2ABC749C1A1F1A16_B921ED198C2CCF38_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC=CC(=C2)C(OC)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""9AF4D9875D64E8F0_5544EF357F24ABDD_6039_UN""","""O(C[C@H]1CCCO1)CC3=NN=C(C2=CC(=C(CC)S2)C)O3""",21,"""5EF32745EFF65DC8"""
+"""FD7631999FDE8C58_ACB490D256CF432B_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)N2CCC(=N2)C3=CC=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""BC18A25347414C86_31DFB18C24E13DA9_6039_UN""","""O(C[C@H]1CCCO1)CC(NC(C2=C(OC)C=CC=C2)C)=O""",21,"""5EF32745EFF65DC8"""
+"""60BB1234048D8AD9_2B3982367D2A0ACA_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NC2=C(C3=C(S2)CCC3)C#N""",21,"""5EF32745EFF65DC8"""
+"""236822BF5A657B04_BBD61A9B52665DFA_6039_UN""","""O(C[C@H]1CCCO1)CC2=COC(=N2)C3=CC(=C(F)C=C3)F""",21,"""5EF32745EFF65DC8"""
+"""7A392A32FE9C6556_EB4BBC952C79707E_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C(C)C=C(C=C2)SC#N)=O""",21,"""5EF32745EFF65DC8"""
+"""F214A5FE8068D91B_AB8306C2A1A27282_6039_UN""","""O(C[C@H]1CCCO1)CC#CC2=C[N](N=C2)C3=CC=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""0E3EDCC01338B8A5_0825F5A97EE5E0B1_6039_UN""","""O(C[C@H]1CCCO1)CC(N2CCN(C(OCC)=O)CC2)=O""",21,"""5EF32745EFF65DC8"""
+"""0223B6FA4DBA6E2D_C2277F46FB3CC394_6039_UN""","""O(C[C@H]1CCCO1)CCOC2=CC=C(OC(F)(F)F)C=C2""",21,"""5EF32745EFF65DC8"""
+"""D0D0F2AF13051C81_CC4007950F5AC36D_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC=CC(=C2)[S](C(F)(F)F)(=O)=O""",21,"""5EF32745EFF65DC8"""
+"""654DCDD4552409CB_763F049F2572063B_6039_UN""","""O(C[C@H]1CCCO1)CC2=NC(=NO2)C3=NN=C(OC)C=C3""",21,"""5EF32745EFF65DC8"""
+"""C9E8FB356AF19710_A2AFFD29AE28A90F_6039_UN""","""O(C[C@H]1CCCO1)CCC(NC(NCCC(F)(F)F)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""34E3AA0C317D3FB1_B9E391982E833B2E_6039_UN""","""O(C[C@H]1CCCO1)CCCNC(=O)OCC2=CC=CC=C2""",21,"""5EF32745EFF65DC8"""
+"""1AF1F5DF4CAC2D6A_C57651373E023571_6039_UN""","""O(C[C@H]1CCCO1)CCCC2=CC=CC(=C2)OC(F)(F)F""",21,"""5EF32745EFF65DC8"""
+"""5627EDF14D35F98E_5F919CFC6A6477B4_6039_UN""","""O(C[C@H]1CCCO1)CC2=C(C(OC)=O)C=CC=C2[N](=O)=O""",21,"""5EF32745EFF65DC8"""
+"""C958B053685144E9_49A53D8CA0DB5D31_6039_UN""","""O(C[C@H]1CCCO1)CC3=CC=C(C2(C(OC)=O)CC2)C=C3""",21,"""5EF32745EFF65DC8"""
+"""667B577CD3BC457B_FD6F75609A0804EC_6039_UN""","""O(C[C@H]1CCCO1)CC2=C3C(=C(C)N=C2)OC(OC3)(C)C""",21,"""5EF32745EFF65DC8"""
+"""A1B0D391361BFBB1_FFEC196C23EE9CFA_6039_UN""","""O(C[C@H]1CCCO1)CC3=N[N]2CCCCC2=C3C(OC)=O""",21,"""5EF32745EFF65DC8"""
+"""88343784DE94E1A9_AD8D1653EDAF6DEF_6039_UN""","""O(C[C@H]1CCCO1)CC(C(C2=CC=CC(=C2)OC)=O)(F)F""",21,"""5EF32745EFF65DC8"""
+"""769E0A66FCADD49A_99B893EFEC30F9A2_6039_UN""","""O(C[C@H]1CCCO1)CC(C(C2=CC=C(OC)C=C2)=O)(F)F""",21,"""5EF32745EFF65DC8"""
+"""63D0AF7CC07242DB_0A991E2E19AB14BE_6039_UN""","""O(C[C@H]1CCCO1)CC2=COC(=N2)C3=CC=CC(=C3)OC""",21,"""5EF32745EFF65DC8"""
+"""75F13C1D4BA110E6_F2899FF69A461965_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=C(C=C(OC)C=C2)OC)=O""",21,"""5EF32745EFF65DC8"""
+"""D8CB8AA0B0FAC7DC_291CC7B5C883EB7E_6039_UN""","""O(C[C@H]1CCCO1)CCC2=CC=C([S](N(C)C)(=O)=O)C=C2""",21,"""5EF32745EFF65DC8"""
+"""381CCAB5CE80944D_597C00E499258B7A_6039_UN""","""O(C[C@H]1CCCO1)CC(NC2=CC3=C(C=C2)[NH]C(=N3)C)=O""",21,"""5EF32745EFF65DC8"""
+"""A7CD7CC9F0DC7CFC_8FFC212DE4E750F0_6039_UN""","""O(C[C@H]1CCCO1)CC(C2=CC=C(C(F)(F)F)C=C2)(F)F""",21,"""5EF32745EFF65DC8"""
+"""0E209E069B87B564_7A20741129F0A6AF_6039_UN""","""O(C[C@H]1CCCO1)CC3=NC=C(C2=CC=C(CC)C=C2)O3""",21,"""5EF32745EFF65DC8"""
+"""F150DF7D7AA7AE12_D98ADBD891E09017_6039_UN""","""O(C[C@H]1CCCO1)CC(NCC(C2=C(F)C=CC=C2)=O)=O""",21,"""5EF32745EFF65DC8"""
+"""07D60E960594F799_4CF56D47D2C7F346_6039_UN""","""O(C[C@H]1CCCO1)CC2=C[N]3C(=N2)C=C(C(F)(F)F)C=C3""",21,"""5EF32745EFF65DC8"""
+"""69A02F49B315218C_C310E36C2D1DDCC4_6039_UN""","""O(C[C@H]1CCCO1)CC(=O)NNC(=O)CC2=CC=CC=C2""",21,"""5EF32745EFF65DC8"""
+"""0C571D913349D987_3C4CF63A6AA505A5_6039_UN""","""O(C[C@H]1CCCO1)CC3=CC2=C(C=C(C(OCC)=O)S2)S3""",21,"""5EF32745EFF65DC8"""
+"""BAEAF3D776B27CD8_483BCD1972E87F81_6039_UN""","""O(C[C@H]1CCCO1)CC2=CC=C(C=C2)CC3=CC=CC=C3""",21,"""5EF32745EFF65DC8"""
+"""CEF9F3EE77F74810_872CF708F4ED3FFC_6039_UN""","""O(C[C@H]1CCCO1)CC(F)(F)C(=O)C2=CC=C(C=C2)C#N""",21,"""5EF32745EFF65DC8"""
+"""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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+"""7942F747413A259B_568E37E946124387_6039_UN""","""O(CC2=N[N]1C=CC=NC1=N2)CC3=C(C(OC)=O)SC=C3""",21,"""9B783606A98552BA"""
+"""9B2A2567F3B2D22D_36D40566FB07F70D_6039_UN""","""O(CC2=N[N]1C=CC=NC1=N2)CC[N]3N=C([N](=O)=O)C=C3""",21,"""9B783606A98552BA"""
+"""F98D4E6C98674B98_E1AA761966A77C43_6039_UN""","""O(CC2=N[N]1C=CC=NC1=N2)CCCCC[N]3N=CC=C3""",21,"""9B783606A98552BA"""
+"""CE78A11E14E94733_5C30DD66C42FEFC9_6039_UN""","""O(CC2=N[N]1C=CC=NC1=N2)CC(C(OC)=O)NC(=O)C""",21,"""9B783606A98552BA"""
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+"""55F930F13E978B09_ED02E7D58A231858_6039_UN""","""CCOC3CCC(OCC1=CSC(=N1)C2=COC=C2)CC3""",21,"""A0551505E85900C7"""
+"""CC07BA652BF709AC_221C24A87C0263EB_6039_UN""","""CCOC3CCC(OCC2=C[N]1C(=CC=CC1=N2)C)CC3""",21,"""A0551505E85900C7"""
+"""B38AD3D1B6D575DB_FD6AE1343448F220_6039_UN""","""CCOC2CCC(OCC(C1=CC(=CS1)C(C)=O)=O)CC2""",21,"""A0551505E85900C7"""
+"""92419742B92534DF_415C5E20E78B20C8_6039_UN""","""CCOC2CCC(OCC1=NC=C[N]1CC(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""23A77C31A545592D_C096EFECF12EB1BC_6039_UN""","""CCOC2CCC(OCCC1=NC=C(C(C)(C)C)O1)CC2""",21,"""A0551505E85900C7"""
+"""D3854F18DBFC076C_C502B7162B992C05_6039_UN""","""CCOC1CCC(OCC(N(CC(OCC)=O)C)=O)CC1""",21,"""A0551505E85900C7"""
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+"""F28D075BB963AF86_B17EC7AC59215FD7_6039_UN""","""CCOC1CCC(OCC(NCCOCCCC)=O)CC1""",21,"""A0551505E85900C7"""
+"""327B37976C961B31_4998578E09C65BC9_6039_UN""","""CCOC2CCC(OCC1=CSC(=N1)C(OCC)=O)CC2""",21,"""A0551505E85900C7"""
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+"""A73AE41C3E8556B1_6A7B0F603B7C429A_6039_UN""","""CCOC2CCC(OCC(=O)NCCC1=CC=CS1)CC2""",21,"""A0551505E85900C7"""
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+"""0E71997A8B645971_08B14656D4057200_6039_UN""","""CCOC2CCC(OCCCOCC1CCCCO1)CC2""",21,"""A0551505E85900C7"""
+"""6682E56F18AB441A_1649D13069F141BD_6039_UN""","""CCOC2CCC(OCC1=C(C=C([N](=O)=O)C=C1)F)CC2""",21,"""A0551505E85900C7"""
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+"""530838803893E697_D678978DEB3FA5E3_6039_UN""","""CCOC2CCC(OCC(=O)NCC1=CC=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""FE052D0BA1D94D5B_727AAD0221DED127_6039_UN""","""CCOC2CCC(OCCCCCN1CCCCC1)CC2""",21,"""A0551505E85900C7"""
+"""53743E9199DAC6C9_CF4A7F278289CB40_6039_UN""","""CCOC2CCC(OCC1OC(=C(C(OC)=O)C1)C)CC2""",21,"""A0551505E85900C7"""
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+"""A8CD3AA3619EDCF2_2F0557E668D3D85F_6039_UN""","""CCOC2CCC(OCC(N(C)C1=CC=CC=C1)=O)CC2""",21,"""A0551505E85900C7"""
+"""861159DBD376444F_FC2DB0370930E1DF_6039_UN""","""CCOC2CCC(OCC(NC1=CC=C(C)C=C1)=O)CC2""",21,"""A0551505E85900C7"""
+"""79C8BB82E748A83F_0C98F0C075066EFF_6039_UN""","""CCOC2CCC(OCC(NC1=C(F)C=CC=C1)=O)CC2""",21,"""A0551505E85900C7"""
+"""C67C1C059576C116_D0CA4F718FBE291F_6039_UN""","""CCOC2CCC(OCC(NC1=CC=C(F)C=C1)=O)CC2""",21,"""A0551505E85900C7"""
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+"""840796A16CE0F231_E9EECD6CC36663EA_6039_UN""","""CCOC2CCC(OCCCOCC1=CC=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""73D6E856C069CFC2_65CCA83ABF216A0D_6039_UN""","""CCOC2CCC(OCC(N1CC(C)OC(C1)C)=O)CC2""",21,"""A0551505E85900C7"""
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+"""917D198B0D015997_EA76DA760B0F022F_6039_UN""","""CCOC2CCC(OCC(C1=C(C=CC(=C1)F)F)=O)CC2""",21,"""A0551505E85900C7"""
+"""7705152B59CE3B1C_C915EF487D04C223_6039_UN""","""CCOC3CCC(OCC1=NN=C([N]1C)C2CCC2)CC3""",21,"""A0551505E85900C7"""
+"""880587D53A66253F_7630CBCC37E53B41_6039_UN""","""CCOC2CCC(OCC(NC1=C(C)C=CC=C1)=O)CC2""",21,"""A0551505E85900C7"""
+"""0B5BD72C58B73B0B_86F66861649F2867_6039_UN""","""CCOC1CCC(OCC(NC(C(C)C)C(=O)O)=O)CC1""",21,"""A0551505E85900C7"""
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+"""5AB85D33991D3BE5_7F77917BCE29A8BD_6039_UN""","""CCOC2CCC(OCC1=C(N=C(C)S1)C(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""60A8D4D886B9B153_4172F60F07115272_6039_UN""","""CCOC3CCC(OCC1=CC2=C(C=C1)[NH]C(=N2)C)CC3""",21,"""A0551505E85900C7"""
+"""D29C91DE699C7684_96E30E42AA0F9E05_6039_UN""","""CCOC2CCC(OCC[N]1C=C(C(OC)=O)N=N1)CC2""",21,"""A0551505E85900C7"""
+"""7035E838DD1DD34F_2E5CE2475AB8B4B5_6039_UN""","""CCOC2CCC(OCC(NC1=CC=CC(=C1)F)=O)CC2""",21,"""A0551505E85900C7"""
+"""B300707C7D5878C1_4CCC35AE11336744_6039_UN""","""CCOC2CCC(OCC(C1=CC=CC(=C1)OC)=O)CC2""",21,"""A0551505E85900C7"""
+"""2092C10D2C69EB86_920DF8C21724C099_6039_UN""","""CCOC2CCC(OCC(NC1CCCCC1C)=O)CC2""",21,"""A0551505E85900C7"""
+"""8EFAEDC489CD9079_FC11655B5295E73B_6039_UN""","""CCOC3CCC(OCC1=CC2=C(C=C1)N=CC=C2)CC3""",21,"""A0551505E85900C7"""
+"""76DBFCC1D1DE7CBC_E4AF3CF89FE4EB04_6039_UN""","""CCOC2CCC(OCC(N1C(CCCC1C)C)=O)CC2""",21,"""A0551505E85900C7"""
+"""DDCE134627023E8D_3FCF36A58766ACB3_6039_UN""","""CCOC3CCC(OCCC2COC1(CCCC1)O2)CC3""",21,"""A0551505E85900C7"""
+"""08F03FB41FC64D6D_05F0D964389C02BA_6039_UN""","""CCOC2CCC(OCC1=CC(=C([N](=O)=O)C=C1)F)CC2""",21,"""A0551505E85900C7"""
+"""357B00D346578949_CFCD77245F956CDF_6039_UN""","""CCOC2CCC(OCC1=CC=C(C(NC)=O)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""45C2D7FF9FF49745_BD096CD0FBE98689_6039_UN""","""CCOC2CCC(OCC[N]1C(=CN=C1C)[N](=O)=O)CC2""",21,"""A0551505E85900C7"""
+"""4E39218991ACCA91_31825E9A60CAB89E_6039_UN""","""CCOC2CCC(OCC1=NC=CC(=C1OC)OC)CC2""",21,"""A0551505E85900C7"""
+"""90DBF4A3B95819B8_18E90CCF24426D82_6039_UN""","""CCOC2CCC(OCC1=CC(=C(OC)C(=C1)F)F)CC2""",21,"""A0551505E85900C7"""
+"""258C8E672711751C_8137C3F989DD8772_6039_UN""","""CCOC3CCC(OCC2CCC1(CCCCC1)O2)CC3""",21,"""A0551505E85900C7"""
+"""2A98B8BFCE243E0C_935B9C7D8187DC3F_6039_UN""","""CCOC2CCC(OCC(C1CCC(F)(F)CC1)=O)CC2""",21,"""A0551505E85900C7"""
+"""C7F4641FDD361F35_20520770E5AABF4F_6039_UN""","""CCOC2CCC(OCC1=NC=C(C(F)(F)F)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""3CC60BE63B9E79FA_F90B7159336E17EE_6039_UN""","""CCOC2CCC(OCC1=CC=C([Si](C)(C)C)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""AEDEAEB30822C1B4_FE9AD9A50D81BF4D_6039_UN""","""CCOC2CCC(OCC1=NN=N[N]1CC(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""0F0C446123164323_B5159CD1AD17867D_6039_UN""","""CCOC2CCC(OCC1=N[N](CC(F)(F)F)N=N1)CC2""",21,"""A0551505E85900C7"""
+"""EA98A84136162DE4_078EA491F057EAA1_6039_UN""","""CCOC3CCC(OCC1=CC=C(C=C1)C2CCC2)CC3""",21,"""A0551505E85900C7"""
+"""D958FF18594A6985_8FF753C0FEBCBC2E_6039_UN""","""CCOC3CCC(OCC1=NN=C2[N]1CCCCC2)CC3""",21,"""A0551505E85900C7"""
+"""3810E499E3474F06_A28707FED25CEE82_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=N1)C(OC)=O)CC2""",21,"""A0551505E85900C7"""
+"""3EBD57DA103C8333_51F0F51FB457AE99_6039_UN""","""CCOC2CCC(OCC1=C([S](N)(=O)=O)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""08FD31D3757A6179_9BFF40E44CC9CDCA_6039_UN""","""CCOC1CCC(OCC(C(C(OCC)=O)(C)C)=O)CC1""",21,"""A0551505E85900C7"""
+"""49AC062A0342BEFD_EC3457A8A71038F0_6039_UN""","""CCOC2CCC(OCC1=CC=C([S](Cl)(=O)=O)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""8A863B444F9FC80B_107F2CE67CA6D99E_6039_UN""","""CCOC3CCC(OCC1=CC2=C(N=C1)C=CC=C2)CC3""",21,"""A0551505E85900C7"""
+"""EAF3D0CB20BC74D3_845878EFF1A08452_6039_UN""","""CCOC2CCC(OCC1=CC=C([S](C)(=O)=O)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""B69C17939038D9F1_3C965A1AF4DB27A5_6039_UN""","""CCOC2CCC(OCC1=C(C=CC=C1)[S](=O)(=O)Cl)CC2""",21,"""A0551505E85900C7"""
+"""AC79E3B7D93499C5_0C9D7D4832365BCF_6039_UN""","""CCOC2CCC(OCCCC1(CCOCC1)C#N)CC2""",21,"""A0551505E85900C7"""
+"""425BC393C857A9D0_45F8B9EA3B3C2CEB_6039_UN""","""CCOC2CCC(OCC1=C(OC)N=C(C=C1C)C)CC2""",21,"""A0551505E85900C7"""
+"""3BAA4E95FB6750DC_57EBDCE13E3410D0_6039_UN""","""CCOC2CCC(OCC1=CC(=CC=C1)[S](=O)(=O)Cl)CC2""",21,"""A0551505E85900C7"""
+"""96D1BA40D65FF3D2_D87800D673802C5F_6039_UN""","""CCOC2CCC(OCC1=C(C(F)(F)F)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""210287010CFC4283_10BD04FE172846C9_6039_UN""","""CCOC2CCC(OCC(=O)COC1=CC=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""500F6C8F24383370_04AB16889FCAB111_6039_UN""","""CCOC1CCC(OCCC(CC(OCC)=O)(C)C)CC1""",21,"""A0551505E85900C7"""
+"""6E075BB341C832BF_34A0BF64AE103AC6_6039_UN""","""CCOC2CCC(OCC1=CC=C(NC(C)=O)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""5F3E61B32E5F5984_4C415DB233CBAC36_6039_UN""","""CCOC2CCC(OCC(C1=CC(=NC=C1)OC)=O)CC2""",21,"""A0551505E85900C7"""
+"""3BAA4E95FB6750DC_7E1441443BA274B9_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1)[S](Cl)(=O)=O)CC2""",21,"""A0551505E85900C7"""
+"""358B7A554EFE069B_0490D6B51B15A1C9_6039_UN""","""CCOC2CCC(OCC1=CC=C([S](F)(=O)=O)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""02CB015FA1C37521_85CF00A034DD1A07_6039_UN""","""CCOC2CCC(OCC(C1=CC=CC(=N1)OC)=O)CC2""",21,"""A0551505E85900C7"""
+"""6E8E2C5AEE3146A8_814D4C080CCC14C2_6039_UN""","""CCOC3CCC(OCCN1C2=C(CC1)C=CC=C2)CC3""",21,"""A0551505E85900C7"""
+"""1B2A6B173F8C9949_5291BE3314988079_6039_UN""","""CCOC2CCC(OCC1=C(N=C(C(C)C)C=C1)C)CC2""",21,"""A0551505E85900C7"""
+"""4B70F8AB84072B8F_570E1EADC2D65091_6039_UN""","""CCOC2CCC(OCC1=NC(=CS1)C(OCC)=O)CC2""",21,"""A0551505E85900C7"""
+"""405A2EFD552C01F0_C9E726D8B1C0A272_6039_UN""","""CCOC2CCC(OCC1=N[N](CC(F)(F)F)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""40E74E87A83ADD3D_F3F5CFC4475F6B24_6039_UN""","""CCOC2CCC(OCCN(C)CC1=CC=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""21A3C0F172327D33_4EC73648C5D81E6A_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1)[S](C)(=O)=O)CC2""",21,"""A0551505E85900C7"""
+"""C180DB78488ECD92_0A96D9D1A8B7E378_6039_UN""","""CCOC2CCC(OCC1=C[N](CC(OC)=O)N=N1)CC2""",21,"""A0551505E85900C7"""
+"""3BCBB7B7A0EC670E_06D7C9FC4AD5C353_6039_UN""","""CCOC2CCC(OCC(N1CC(CC(C)C1)C)=O)CC2""",21,"""A0551505E85900C7"""
+"""4F8892FFFD6DCDE2_223B2BEDEFC91BB1_6039_UN""","""CCOC2CCC(OCC(N1CCCCC1CC)=O)CC2""",21,"""A0551505E85900C7"""
+"""BF822F76A5915D9B_19C59E1435D5F421_6039_UN""","""CCOC3CCC(OCC1=CC=N[N]1C2CCCC2)CC3""",21,"""A0551505E85900C7"""
+"""34C9430F0EAD3D92_5C3903CBFCFFFF2D_6039_UN""","""CCOC2CCC(OCC1=CC=N[N]1CC(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""A74DE7838324BF10_ABFF98571161098E_6039_UN""","""CCOC3CCC(OCC2COC1=C(C=CC=C1)O2)CC3""",21,"""A0551505E85900C7"""
+"""34E0B8A11FA4E845_C38AAA27A82A634C_6039_UN""","""CCOC2CCC(OCC(N(C)CC1=CC=CO1)=O)CC2""",21,"""A0551505E85900C7"""
+"""8B38866A3BBE70DC_F5741ED7092F8F62_6039_UN""","""CCOC2CCC(OCC(=O)CCC1CCCCO1)CC2""",21,"""A0551505E85900C7"""
+"""128C06F81F40A673_3BD4E98CA96A36B5_6039_UN""","""CCOC2CCC(OCCC(NC1=NOC(=C1)C)=O)CC2""",21,"""A0551505E85900C7"""
+"""43CD415165DE9475_28294CA45CF5885F_6039_UN""","""CCOC2CCC(OCC(=O)NC1=C(C=CS1)C#N)CC2""",21,"""A0551505E85900C7"""
+"""9ACDAA2EA8F2A019_B7303C2023E37BFD_6039_UN""","""CCOC3CCC(OCC1=NOC(=C1)C2=CC=CS2)CC3""",21,"""A0551505E85900C7"""
+"""AA47AC74882C076A_4228C9759C708689_6039_UN""","""CCOC2CCC(OCC(OC)CC1=CC=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""A221052EFC18A369_36B18B2AC2E4F740_6039_UN""","""CCOC2CCC(OCCOC1=C(C=CC=C1)C#N)CC2""",21,"""A0551505E85900C7"""
+"""D4AE2E1927F4EA65_CE91663F86221FA4_6039_UN""","""CCOC1CCC(OCC(NC(NCCCC)=O)=O)CC1""",21,"""A0551505E85900C7"""
+"""F6CF0220935C4148_E384709EE4E6E4BE_6039_UN""","""CCOC3CCC(OCC2=NC1=C(C=C(F)C=C1)O2)CC3""",21,"""A0551505E85900C7"""
+"""0C5AF9A8C1BB90BA_90B5CE201C2C147E_6039_UN""","""CCOC3CCC(OCC1=C(ON=C1)C2=CC=CS2)CC3""",21,"""A0551505E85900C7"""
+"""53CF147E9CE13A2E_A068AE436E1D550B_6039_UN""","""CCOC2CCC(OCC1=CSC(=N1)C[S](C)(=O)=O)CC2""",21,"""A0551505E85900C7"""
+"""E408D5D36F84C97A_BF95A1DCD86AB273_6039_UN""","""CCOC1CCC(OCCC(CC)(CC)C(=O)OC)CC1""",21,"""A0551505E85900C7"""
+"""74176F85DE95D8CB_2FE2E2ED39939E9E_6039_UN""","""CCOC2CCC(OCC(C1=C(OC)N=CC=C1)=O)CC2""",21,"""A0551505E85900C7"""
+"""18019C51DCDA8FCB_1FFAF5484F0837EA_6039_UN""","""CCOC2CCC(OCC(C1=C(C=C(C)C=C1)C)=O)CC2""",21,"""A0551505E85900C7"""
+"""3DBDCE157B870A46_C0D75A1C71EE8489_6039_UN""","""CCOC2CCC(OCC1=CC(=C(N(C)C)C=C1)C)CC2""",21,"""A0551505E85900C7"""
+"""A12DB0F4FA9533E4_78ADDB42B3781D27_6039_DP""","""CCOC2CCC(OCC(NCC1CCCNC1)=O)CC2""",21,"""A0551505E85900C7"""
+"""A412E0E7B05F0D19_F6ADE8CDB80A0582_6039_UN""","""CCOC2CCC(OCC1=CC(=N[N]1C)C(OC)=O)CC2""",21,"""A0551505E85900C7"""
+"""4EEC6E9E3371D3EB_CBA7372E6540ADB6_6039_UN""","""CCOC1CCC(OCCOCC(C(F)(F)F)(F)F)CC1""",21,"""A0551505E85900C7"""
+"""8AB07BB0057F11A6_DDEC4FD592013549_6039_UN""","""CCOC2CCC(OCCCC1=C(OC)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""2823E9912FA37889_A97A4AC71B194B1C_6039_UN""","""CCOC2CCC(OCC1=C(C(OC)=O)C=CC=N1)CC2""",21,"""A0551505E85900C7"""
+"""27C94D294714B986_347E9AD5CBBCF4FE_6039_UN""","""CCOC2CCC(OCC1=NC(=CC(=N1)N(C)C)C)CC2""",21,"""A0551505E85900C7"""
+"""4DEB73606D765FFC_EA096EB146363867_6039_UN""","""CCOC2CCC(OCC(N(C)CC1=CC=CS1)=O)CC2""",21,"""A0551505E85900C7"""
+"""260B7BE34A774236_D170150558EF7CAD_6039_UN""","""CCOC2CCC(OCC1=NC(=NO1)C(OCC)C)CC2""",21,"""A0551505E85900C7"""
+"""6F5DE5BD705FF501_4F180033E2D8401E_6039_UN""","""CCOC2CCC(OCC1=NC(=NO1)CC(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""7B0C2A7AB5F3B90B_EE919321320D6003_6039_UN""","""CCOC2CCC(OCC(=O)C1=CC(=CC=C1)C#N)CC2""",21,"""A0551505E85900C7"""
+"""DBEC6A82C9F88A7B_D8C156A6BFF54206_6039_UN""","""CCOC3CCC(OCC1=N[N](C=C1)C2CCCC2)CC3""",21,"""A0551505E85900C7"""
+"""880566A945DBB706_8481DE6F9052FCF4_6039_UN""","""CCOC2CCC(OCCCSCC1=CC=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""F8DA35B7D23194AB_7507818E2210D0E0_6039_UN""","""CCOC2CCC(OCC1=C(OC(F)F)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""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"""
+"""F27D47D42D611444_F11A6157E8C31EE4_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1)NC(C)=O)CC2""",21,"""A0551505E85900C7"""
+"""76E6FBF096553E58_D9766837019A1111_6039_UN""","""CCOC2CCC(OCC1=CC=C(OC(F)F)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""3A22A1992961C4CE_EC85EB39DF3E0A16_6039_UN""","""CCOC2CCC(OCC(C1=NC=C[N]1C(C)C)=O)CC2""",21,"""A0551505E85900C7"""
+"""CAA6858F8C01BE4E_594319D002068511_6039_UN""","""CCOC2CCC(OCC1=N[N](C)C(=C1)C(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""E4F4164313CD0D6C_2D9B4845326F8424_6039_UN""","""CCOC2CCC(OCC1=CC(=N[N]1C)C(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""210A1F40AF9A4111_A0E2B452AFBBD206_6039_UN""","""CCOC1CCC(OCC(NC(CCCCC)C)=O)CC1""",21,"""A0551505E85900C7"""
+"""047A1CA1600F5C27_91764938C993C192_6039_UN""","""CCOC3CCC(OCC1=C(C=CC=C1)OC2CC2)CC3""",21,"""A0551505E85900C7"""
+"""39EAD3956596D310_BA99544905E83F8A_6039_UN""","""CCOC2CCC(OCC(NC1=CC(=N[N]1C)C)=O)CC2""",21,"""A0551505E85900C7"""
+"""427AF34A37C35696_D53FF12ABBB5DAEA_6039_UN""","""CCOC2CCC(OCC(=O)CCC1=CC=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""C2DFEF444FC207C2_26AA1E4ABE33BAFA_6039_UN""","""CCOC2CCC(OCC(C1=N[N](CC)N=C1C)=O)CC2""",21,"""A0551505E85900C7"""
+"""1718E3E744CAA05C_72FEC3B5EDB5BB6E_6039_UN""","""CCOC2CCC(OCC1=NC(=NO1)CC(NC)=O)CC2""",21,"""A0551505E85900C7"""
+"""40C336CCD8CF7D47_0A3A482A99FA896D_6039_UN""","""CCOC3CCC(OCC1CN1CC2=CC=CC=C2)CC3""",21,"""A0551505E85900C7"""
+"""88EF8596B54CDB8E_C0F5AEDB265B35DB_6039_UN""","""CCOC1CCC(OCCO[S](C[S](C)(=O)=O)(=O)=O)CC1""",21,"""A0551505E85900C7"""
+"""852A1786F622666C_1C8346617B76E163_6039_DP""","""CCOC3CCC(OCC2=CC1=C(CCNC1)C=C2)CC3""",21,"""A0551505E85900C7"""
+"""5D237723ED5C4DEE_FE193B176A88C657_6039_DP""","""CCOC1CCC(OCC(N[C@@H](C(C)C)C(=O)O)=O)CC1""",21,"""A0551505E85900C7"""
+"""7197B1C03829463C_70C50C930E022C66_6039_UN""","""CCOC2CCC(OCC1=NC(=NO1)C(OCC)=O)CC2""",21,"""A0551505E85900C7"""
+"""BB17B7AE0A82F637_D278D5E033FF57CE_6039_DP""","""CCOC1CCC(OCC(N[C@H](C(C)C)C(=O)O)=O)CC1""",21,"""A0551505E85900C7"""
+"""868D2ABAF027F68A_FD2DEFA51C56948A_6039_UN""","""CCOC2CCC(OCC1=CN=C(C(F)(F)F)N=C1)CC2""",21,"""A0551505E85900C7"""
+"""97F1A505D8847B84_FA7C1C3F60ED3396_6039_UN""","""CCOC3CCC(OCCC2=NC1=C(C=CC=C1)[NH]2)CC3""",21,"""A0551505E85900C7"""
+"""AE527FF5982BBDAB_3F24577FBE76EC37_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1)C(C)(C)C)CC2""",21,"""A0551505E85900C7"""
+"""FDDC1BAE11716B0E_DCE9703BA82F9DA9_6039_UN""","""CCOC2CCC(OCC1=NC=CC(=C1)OC(C)C)CC2""",21,"""A0551505E85900C7"""
+"""C26B9A33C5929141_79AC73F0EA3130B1_6039_UN""","""CCOC2CCC(OCC1=C(C=C(C(O)=O)C=C1)F)CC2""",21,"""A0551505E85900C7"""
+"""BAB52FCBADDDA852_622FAA2E3227BDC1_6039_UN""","""CCOC2CCC(OCCCN(C)C1=CC=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""EEB0D227D9206A53_F860AED0810FDD2B_6039_UN""","""CCOC2CCC(OCC1=C(F)C=C(C(=C1)F)C#N)CC2""",21,"""A0551505E85900C7"""
+"""05694085CB6679D6_B44E47B370B86317_6039_UN""","""CCOC2CCC(OCCSC1=CC=CC(=C1)OC)CC2""",21,"""A0551505E85900C7"""
+"""A33A1B9C19FC4824_67726F2BDF38442D_6039_UN""","""CCOC3CCC(OCCC1=NSC2=C1C=CC=C2)CC3""",21,"""A0551505E85900C7"""
+"""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"""
+"""ADE0BB0F4EAA3B27_A97E8E4AE70400AB_6039_UN""","""CCOC1CCC(OCCO[P](OCC)(=O)OCC)CC1""",21,"""A0551505E85900C7"""
+"""974C9036447BC842_DA840F512936A9B1_6039_UN""","""CCOC2CCC(OCCSC1=C(C=C(F)C=C1)F)CC2""",21,"""A0551505E85900C7"""
+"""95C1BEE4B5A008E9_0568020DFF6BAC47_6039_UN""","""CCOC1CCC(OCCCOCCOCCOC)CC1""",21,"""A0551505E85900C7"""
+"""B24C8B6C0DDC76C9_802005D397B38D25_6039_UN""","""CCOC2CCC(OCC1=C([N](=O)=O)C=C(C=C1)F)CC2""",21,"""A0551505E85900C7"""
+"""FED65ABBEE8C8DE7_5E947E383385C540_6039_UN""","""CCOC2CCC(OCCC1=N[N](C(C)(C)C)N=N1)CC2""",21,"""A0551505E85900C7"""
+"""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"""
+"""9D772CD56A60D757_6D98CE9892B37D6E_6039_DP""","""CCOC3CCC(OCC1=CC=CC2=C1CCNC2)CC3""",21,"""A0551505E85900C7"""
+"""4B402C1F5B2A19AC_CD3958BA15A77B69_6039_UN""","""CCOC2CCC(OCC(OC)C1=CC=C(C=C1)F)CC2""",21,"""A0551505E85900C7"""
+"""24EEACF8CC490D3F_DD8AC3782BA6EFF0_6039_UN""","""CCOC3CCC(OCC2=NC1=C(C=CC(=C1)C)S2)CC3""",21,"""A0551505E85900C7"""
+"""8EA615380C1D86E6_837A790B7D63ECBC_6039_UN""","""CCOC2CCC(OCC1=C(C(F)(F)F)N=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""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"""
+"""3E2102FF12510B07_BB4EDB1BC599A902_6039_UN""","""CCOC2CCC(OCC(C1=CC=C(OC)C=C1)=O)CC2""",21,"""A0551505E85900C7"""
+"""EABDB1EF47B70F97_8A7DA12B6A214865_6039_UN""","""CCOC3CCC(OCC(=O)N1CC2CCC(C1)O2)CC3""",21,"""A0551505E85900C7"""
+"""F21A5B88D6F52F30_91EE9F8011B4C471_6039_UN""","""CCOC2CCC(OCC(C1=CC=C(F)C=C1)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""823CAF598169A37F_BFD880D7182732E4_6039_UN""","""CCOC2CCC(OCC(=O)NC1CCCCCC1)CC2""",21,"""A0551505E85900C7"""
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+"""1E887FB50CD6E79F_152E5387F3D6FA49_6039_UN""","""CCOC2CCC(OCCOC(=O)C1=CC=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""5DA207C77FFB0641_588F52BAFFD08D35_6039_UN""","""CCOC1CCC(OCCC[S](NC(C)(C)C)(=O)=O)CC1""",21,"""A0551505E85900C7"""
+"""2332622A4257D5CB_FEC5BA882E376DFB_6039_UN""","""CCOC2CCC(OCC(C1=C(OC)C=CC=C1)=O)CC2""",21,"""A0551505E85900C7"""
+"""ED70CA8F84FDA266_92A09468C6436174_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1)C(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""AB8F826D3377FC46_32C646DE608D85C5_6039_UN""","""CCOC2CCC(OCC1=C(F)C=C(C(=C1)C#N)F)CC2""",21,"""A0551505E85900C7"""
+"""DA6B762291A58795_74E4CEC25A8F7B36_6039_UN""","""CCOC2CCC(OCC1=C(CC(C)C)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""F50E6A7FB6FD53BC_88B5E72FD6DCEC53_6039_UN""","""CCOC2CCC(OCC(=O)NCC1CCCCC1)CC2""",21,"""A0551505E85900C7"""
+"""C5815AC1D72D7A52_D8AC19EACABF805C_6039_UN""","""CCOC2CCC(OCC(N(C)C1CCCCC1)=O)CC2""",21,"""A0551505E85900C7"""
+"""34D1CE59F367B58C_BD712F5E9343E9FF_6039_UN""","""CCOC2CCC(OCC1=NC(=NO1)COC(C)C)CC2""",21,"""A0551505E85900C7"""
+"""4594425D96FDB717_E13B010FB781DE9A_6039_UN""","""CCOC3CCC(OCC2COC1(CCOCC1)O2)CC3""",21,"""A0551505E85900C7"""
+"""30F45E5000F9EA88_859CF9263B3B7B1B_6039_UN""","""CCOC2CCC(OCC1CCCC(C(F)(F)F)O1)CC2""",21,"""A0551505E85900C7"""
+"""B3904D929BEA7131_718BE15AD08EDFE0_6039_UN""","""CCOC2CCC(OCC1=NSC(=N1)C(OCC)=O)CC2""",21,"""A0551505E85900C7"""
+"""5A09A7FA9E26C015_15E3DF2BDFFD2B93_6039_UN""","""CCOC1CCC(OCCCCCCCCCCC)CC1""",21,"""A0551505E85900C7"""
+"""FD50DB90C17CAADF_2FB67C1BF5BF8972_6039_UN""","""CCOC3CCC(OCC1=NN=C2C(=O)NC=C[N]12)CC3""",21,"""A0551505E85900C7"""
+"""15D7BC8920CB701D_A23268B478FE5C03_6039_UN""","""CCOC2CCC(OCC1=NC(=C(S1)C(C)(C)C)C)CC2""",21,"""A0551505E85900C7"""
+"""287A5121C6543DBD_500BB2B78A23EBF2_6039_UN""","""CCOC3CCC(OCC1=CC2=C(C=C1)C=NC=C2)CC3""",21,"""A0551505E85900C7"""
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+"""2F7722A82B13C2A2_4D5D7CC003C52735_6039_UN""","""CCOC2CCC(OCC1=CN=CC(=C1)C(OC)=O)CC2""",21,"""A0551505E85900C7"""
+"""FF1EAEBA00358778_345C499B40491061_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1)[S](F)(=O)=O)CC2""",21,"""A0551505E85900C7"""
+"""46D78BFDBF16EBE9_C9066A5C67EECA51_6039_UN""","""CCOC2CCC(OCC1=C(CC(C)=O)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""24A861A6C79E87A4_AF32AE31050AF9EC_6039_UN""","""CCOC3CCC(OCC1=CC(=NN=C1C2CC2)C)CC3""",21,"""A0551505E85900C7"""
+"""9E7CB7ABB89F8F9F_B0AD43ACD856892E_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=N1)C(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""33BC28B380765649_8644FA8C3D46C629_6039_UN""","""CCOC2CCC(OCCCN1CCC(F)(CC1)F)CC2""",21,"""A0551505E85900C7"""
+"""D45E529E9AC0D106_8EB53E9CEB22586F_6039_UN""","""CCOC2CCC(OCC1=C(C)C=CC(=C1)[N](=O)=O)CC2""",21,"""A0551505E85900C7"""
+"""09D4277903EC2BC0_710B758D0F7BA33A_6039_UN""","""CCOC2CCC(OCC1=C(C=CC(=C1)C(O)=O)F)CC2""",21,"""A0551505E85900C7"""
+"""946BD7E7AEC9F4D4_D8FC8669504EC6DB_6039_UN""","""CCOC2CCC(OCCNC(=O)C1CCOCC1)CC2""",21,"""A0551505E85900C7"""
+"""6AFE8105C2793B97_77DF2910F709F87D_6039_UN""","""CCOC2CCC(OCC1=NC=CC(=C1)C(OC)=O)CC2""",21,"""A0551505E85900C7"""
+"""446277498FF9EFEF_B1FDE24E892E1196_6039_UN""","""CCOC3CCC(OCC1=CC2=C(C=C1)COCC2)CC3""",21,"""A0551505E85900C7"""
+"""DE00EC5736566A28_2A088D689FA80444_6039_UN""","""CCOC2CCC(OCCOC1CC[S](=O)(=O)CC1)CC2""",21,"""A0551505E85900C7"""
+"""3522A853CE90A603_70E7BFC7F08D0E6F_6039_UN""","""CCOC3CCC(OCC1=NSC2=C1C=CC(=C2)F)CC3""",21,"""A0551505E85900C7"""
+"""9E37F1CEAC696E46_DC271B072F919090_6039_UN""","""CCOC1CCC(OCCCNC(C(CC)CC)=O)CC1""",21,"""A0551505E85900C7"""
+"""1C8B3B0C7D8EFDFA_ED9B99CC47E55993_6039_UN""","""CCOC2CCC(OCC1=C(F)C=C(C=C1F)C#N)CC2""",21,"""A0551505E85900C7"""
+"""236790F420A7B9C9_0CE624CD9F2FFBAE_6039_UN""","""CCOC3CCC(OCC1(F)OC(=O)CC12CCC2)CC3""",21,"""A0551505E85900C7"""
+"""095C4CB31920CF40_25716B8A4FA94668_6039_UN""","""CCOC2CCC(OCC1=C([N](C)N=N1)C(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""9758C07CEB7D5A0D_9B7792FB94F33BA7_6039_UN""","""CCOC2CCC(OCC1=C[N](C)N=C1C(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""56ACE55500E4DE55_CD256E7C5D923B04_6039_UN""","""CCOC2CCC(OCC1=CC(=C(OCC)C=C1)F)CC2""",21,"""A0551505E85900C7"""
+"""E080F6B49A4937CB_2B7A901300930AD5_6039_UN""","""CCOC3CCC(OCC2=NC1=C(F)C=CC=C1O2)CC3""",21,"""A0551505E85900C7"""
+"""2F134C99859EFC2F_DAF3CC138EBAA769_6039_DP""","""CCOC3CCC(OCC1OCCC12CCNCC2)CC3""",21,"""A0551505E85900C7"""
+"""66CA7FA1E9EAE10D_32E3FAD6627EEEC9_6039_UN""","""CCOC2CCC(OCC1=CC=C([S](N)(=O)=O)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""C0D86F1E6DF9B9FB_4A7EB774F3317862_6039_UN""","""CCOC2CCC(OCC(C1=CC=C([N](=O)=O)O1)=O)CC2""",21,"""A0551505E85900C7"""
+"""FE6DD8B3E1EB6CBF_D18F2658C4FFF64B_6039_UN""","""CCOC2CCC(OCC1=C([S](C)(=O)=O)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""2879C82443E16C07_C8A3DBA9B47B6370_6039_UN""","""CCOC2CCC(OCC1=NC(=NO1)C(OC)(C)C)CC2""",21,"""A0551505E85900C7"""
+"""20855F629E48A8EA_6E97E790AD1F94B4_6039_UN""","""CCOC1CCC(OCC(NCCCOC(C)C)=O)CC1""",21,"""A0551505E85900C7"""
+"""80FFFE4F9E22F473_D48E51591D1607C5_6039_UN""","""CCOC3CCC(OCC1=NCCC2=C1C=CC=C2)CC3""",21,"""A0551505E85900C7"""
+"""03E4B4462B736F59_20D0F044F83D29F8_6039_UN""","""CCOC2CCC(OCC1=CC=C(SC(F)F)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""2E160A2D14F5210B_9809C2201AD06CF7_6039_UN""","""CCOC2CCC(OCCC(=O)NC1=NC=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""D92D33BB4B35ACFB_920F14DD0564372A_6039_UN""","""CCOC2CCC(OCC1=C(C)OC(=C1)C(OC)=O)CC2""",21,"""A0551505E85900C7"""
+"""49AC062A0342BEFD_28B37EC98380CB60_6039_UN""","""CCOC2CCC(OCC1=CC=C(C=C1)[S](=O)(=O)Cl)CC2""",21,"""A0551505E85900C7"""
+"""18AE57AC67D2F370_D3C7C7E49ECD606C_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1[N](=O)=O)C)CC2""",21,"""A0551505E85900C7"""
+"""708F59975A61EC90_273FC81E158DFC32_6039_UN""","""CCOC3CCC(OCC1=CC2=C(C=C1)C=CC=N2)CC3""",21,"""A0551505E85900C7"""
+"""891B3DE8E850069F_07416093B774F984_6039_UN""","""CCOC2CCC(OCCCOC1=C(F)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""6BEF8657B4A8835D_591E57CA991711D7_6039_UN""","""CCOC2CCC(OCC1=C(C=CC(=C1)[N](=O)=O)F)CC2""",21,"""A0551505E85900C7"""
+"""3C6E71E0EB20F808_3C6074F0CB3E242D_6039_UN""","""CCOC1CCC(OCCCNC(CC(C)(C)C)=O)CC1""",21,"""A0551505E85900C7"""
+"""ABB1119742AE48DE_CB1B7A880A8F64F9_6039_UN""","""CCOC2CCC(OCCC(=O)N1CCCCCC1)CC2""",21,"""A0551505E85900C7"""
+"""5B20DFCE6F6A205F_2DC022DD66181571_6039_UN""","""CCOC3CCC(OCC2=NC1=C(CCCCC1)S2)CC3""",21,"""A0551505E85900C7"""
+"""25B1DD19059792B4_79EA9F1354B8E6FD_6039_UN""","""CCOC2CCC(OCC1=CN=CC(=C1)C(C)(C)C)CC2""",21,"""A0551505E85900C7"""
+"""5D2E017607794FD8_BB1B6C6B322A17EF_6039_UN""","""CCOC3CCC(OCC2CCCC1(CCOC1)O2)CC3""",21,"""A0551505E85900C7"""
+"""DDF3AAEAD9FBECE0_28FC2FA5700CACA9_6039_UN""","""CCOC2CCC(OCC(N(C)CC1=CSC=C1)=O)CC2""",21,"""A0551505E85900C7"""
+"""D438F9D6FF6F30C7_D67AA29DFE20FDC7_6039_UN""","""CCOC2CCC(OCC1CCCC(F)(F)C(N1)=O)CC2""",21,"""A0551505E85900C7"""
+"""8B7BF9C7F75776E2_7DB4A08A6126506F_6039_UN""","""CCOC3CCC(OCC1=NOC(=N1)N2CCCC2)CC3""",21,"""A0551505E85900C7"""
+"""CB10DDFBC5207CD8_C659F19F3BBB4829_6039_UN""","""CCOC2CCC(OCC1=C(C)OC=C1C(F)(F)F)CC2""",21,"""A0551505E85900C7"""
+"""E65874B6B00D09D0_4B14DF893A6D705B_6039_UN""","""CCOC3CCC(OCC2=CC1=C(CN(C)C1)C=C2)CC3""",21,"""A0551505E85900C7"""
+"""5A548393C25D608C_894EDB6EEF1BE408_6039_UN""","""CCOC2CCC(OCC1=C(C(OCC)=O)[NH]N=C1)CC2""",21,"""A0551505E85900C7"""
+"""3BC8111AD397FB52_168E4E8EB781D079_6039_UN""","""CCOC2CCC(OCC1=CC(=C(C)O1)[S](=O)(=O)C)CC2""",21,"""A0551505E85900C7"""
+"""9EB65EC1441F1F53_F205299039215A8C_6039_UN""","""CCOC3CCC(OCC1=CC=CC2=C1N=C(C)O2)CC3""",21,"""A0551505E85900C7"""
+"""B052F000F859BAFE_6FA4DE70F4980868_6039_UN""","""CCOC2CCC(OCC(C1=CC=CC(=C1)OC)F)CC2""",21,"""A0551505E85900C7"""
+"""C30CBF3267454DB0_FB207E012511F991_6039_UN""","""CCOC3CCC(OCC1=NN=C2[N]1CCOCC2)CC3""",21,"""A0551505E85900C7"""
+"""6E5EACA6B5F5EEFC_742B9069C0F09163_6039_UN""","""CCOC3CCC(OCC1=CC2=C(C=C1)CCOC2)CC3""",21,"""A0551505E85900C7"""
+"""F8EB76DE2A9F150F_20BF588A693EEFEA_6039_DP""","""CCOC3CCC(OCC1(OC(CC12CNC2)=O)F)CC3""",21,"""A0551505E85900C7"""
+"""AB3BDF5C3C9DD7EA_D84B932D20442417_6039_UN""","""CCOC3CCC(OCC2=NC1=C(CC(C)CC1)S2)CC3""",21,"""A0551505E85900C7"""
+"""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"""
+"""9253D6E7F9D798D2_499DA8B786138057_6039_UN""","""CCOC2CCC(OCCC(N1CCN(C)CC1)=O)CC2""",21,"""A0551505E85900C7"""
+"""1F4BC6AD54C3CF42_977DC53069189C4A_6039_UN""","""CCOC2CCC(OCC1=C(C(F)(F)F)C=CC=N1)CC2""",21,"""A0551505E85900C7"""
+"""FD38E2FACE70E4D7_CD02E8683FD9DC37_6039_UN""","""CCOC2CCC(OCC1=C(C(OCC)=O)SN=N1)CC2""",21,"""A0551505E85900C7"""
+"""FFEAEF107240DDF6_D3D7DE553178C658_6039_UN""","""CCOC3CCC(OCC1=CN=C2[N]1C=C(F)C=C2)CC3""",21,"""A0551505E85900C7"""
+"""BC2EBC8F731AE1D0_B428810BC376114C_6039_UN""","""CCOC2CCC(OCCCC(=O)N1CCCCC1)CC2""",21,"""A0551505E85900C7"""
+"""95DBC1FD0F0A7D95_FA0178246EAF9859_6039_UN""","""CCOC2CCC(OCC1=C(C(C)(C)C)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""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"""
+"""6AB697C779E08CBB_5DECBB60D5083FAA_6039_UN""","""CCOC2CCC(OCC1=NOC=C1C(OCC)=O)CC2""",21,"""A0551505E85900C7"""
+"""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"""
+"""8BDEB17C92C8426A_D34CD7FF810D8F6F_6039_UN""","""CCOC2CCC(OCC1=NOC(=N1)C(OCC)=O)CC2""",21,"""A0551505E85900C7"""
+"""901B69C021F15675_C272D1335F0DD59B_6039_UN""","""CCOC2CCC(OCC1=N[N](C)C=C1[S](=O)(=O)Cl)CC2""",21,"""A0551505E85900C7"""
+"""1E2737FBF0D4D0C0_FD12DDD932D315C5_6039_UN""","""CCOC2CCC(OCC1=CC(=N[NH]1)C(OCC)=O)CC2""",21,"""A0551505E85900C7"""
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+"""EC7FC9632C200B45_FC4311D96E593851_6039_UN""","""CCOC2CCC(OCC(OC1CN(C)CCC1)=O)CC2""",21,"""A0551505E85900C7"""
+"""A7526B20E056BF8D_C3CC45926E5DE79C_6039_UN""","""CCOC2CCC(OCC1=CC(=NC(=C1)OC)OC)CC2""",21,"""A0551505E85900C7"""
+"""2738B95E48CE5830_0EFFA7162C52D5BA_6039_UN""","""CCOC2CCC(OCCC1(C(O)=O)CCOCC1)CC2""",21,"""A0551505E85900C7"""
+"""792C8785876C9237_54E41179FBE484C8_6039_UN""","""CCOC2CCC(OCC1=C(C(OCC)=O)C=NO1)CC2""",21,"""A0551505E85900C7"""
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+"""9B3A7D338F5E116A_9794F61D1E968354_6039_UN""","""CCOC2CCC(OCC1=CC(=NC(=N1)OC)OC)CC2""",21,"""A0551505E85900C7"""
+"""1A43BE48DB43E530_F9008D6DAE5DADA5_6039_UN""","""CCOC2CCC(OCC1=C(C(C)(C)F)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""05EF0EDCDDF04A00_F5E45259E4A99866_6039_UN""","""CCOC2CCC(OCC1=C(C(OCC)=O)C=N[NH]1)CC2""",21,"""A0551505E85900C7"""
+"""1B7F367EE461B72C_418CB275A6E9ACA9_6039_UN""","""CCOC2CCC(OCCOC1(CCOCC1)C#N)CC2""",21,"""A0551505E85900C7"""
+"""AD754C9419EA28F3_D3B97ED5CDCE4084_6039_UN""","""CCOC2CCC(OCC#CC1=CC=CC(=C1)OC)CC2""",21,"""A0551505E85900C7"""
+"""09C033080FDB6B63_B93C2FEEC772B933_6039_UN""","""CCOC1CCC(OCCCO[S](C(F)(F)F)(=O)=O)CC1""",21,"""A0551505E85900C7"""
+"""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"""
+"""011E5FD24E891B84_A8772EBFB9AC1080_6039_UN""","""CCOC2CCC(OCC1=CN=C(C(OC)=O)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""7DBD187EEDEECC24_0EF86D1B695365BE_6039_UN""","""CCOC2CCC(OCC1=C([S](F)(=O)=O)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""85305A78413D0E42_D608B1CB74F68737_6039_UN""","""CCOC2CCC(OCC1=NC=C(C(C)(F)F)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""D8071917B907F84F_735D2B5FFB3F6574_6039_UN""","""CCOC3CCC(OCC1CN1CC2=C[N](C)N=C2)CC3""",21,"""A0551505E85900C7"""
+"""96021408D29FD0E2_E71F267B7F64037F_6039_UN""","""CCOC2CCC(OCC1=NC(=C(C=C1)[N](=O)=O)C)CC2""",21,"""A0551505E85900C7"""
+"""ECAA91F1CE5C98EF_99A379FD2B103BC2_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=N1)OC(F)F)CC2""",21,"""A0551505E85900C7"""
+"""2FB80BFEE7AE39D6_DEB6B2FAD37006FD_6039_UN""","""CCOC3CCC(OCC2=C[N]1C=CC=C(F)C1=N2)CC3""",21,"""A0551505E85900C7"""
+"""58274E237A23474D_8BA6FE34950E151C_6039_UN""","""CCOC3CCC(OCC1=NN=C(O1)C2=CC=CO2)CC3""",21,"""A0551505E85900C7"""
+"""E15B35DB2BAE3761_E300F073EAC0AC9B_6039_UN""","""CCOC3CCC(OCC(=O)C1CC2=C1C=CC=C2)CC3""",21,"""A0551505E85900C7"""
+"""E8A22CA46585E18F_CBD2250AF1F3C556_6039_UN""","""CCOC3CCC(OCCN1CCN(CC1)C2CC2)CC3""",21,"""A0551505E85900C7"""
+"""66A6E4E0506A8B33_ED1D66DD1C86ED54_6039_UN""","""CCOC2CCC(OCC(=O)N1CCCCCCC1)CC2""",21,"""A0551505E85900C7"""
+"""E603C6CA9DEA1C80_A631F31F549AF64E_6039_UN""","""CCOC1CCC(OCC(NNC(C(C)(C)C)=O)=O)CC1""",21,"""A0551505E85900C7"""
+"""1261E7A58084742F_004E904D56A28235_6039_UN""","""CCOC2CCC(OCC(C1=C(C)[N](C(=C1)C)C)=O)CC2""",21,"""A0551505E85900C7"""
+"""875724E3A06F7F38_CDFBE2B384D97B59_6039_UN""","""CCOC2CCC(OCC1=C(SC(F)F)C=CC=C1)CC2""",21,"""A0551505E85900C7"""
+"""3E85FFADB723D78C_A5291D428506D51D_6039_UN""","""CCOC2CCC(OCC1=CC(=C(O1)C)C(OC)=O)CC2""",21,"""A0551505E85900C7"""
+"""36B7AD6188AC3C28_0E3EE425450AC547_6039_UN""","""CCOC2CCC(OCCC1=CC=C([N](=O)=O)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""286BAAFA2498EFE1_6C900770A5680C0F_6039_UN""","""CCOC1CCC(OCCCCC(N[S](C)(=O)=O)=O)CC1""",21,"""A0551505E85900C7"""
+"""7A8AE285EB260759_9948A6C08454D2A2_6039_UN""","""CCOC2CCC(OCC(=O)NC(=O)C1=CC=C[NH]1)CC2""",21,"""A0551505E85900C7"""
+"""A6A3FB2F1AA1EAFC_848B187AE5CD7DFA_6039_UN""","""CCOC2CCC(OCCOC1=C(C=CC(=C1)C)C)CC2""",21,"""A0551505E85900C7"""
+"""BCDE5A04D13CC4AA_EA517A394091E339_6039_UN""","""CCOC2CCC(OCC1=CC=CC(=C1)OCCC)CC2""",21,"""A0551505E85900C7"""
+"""B746BC3A74656D62_D94C58B1669F61EA_6039_UN""","""CCOC2CCC(OCC1=C([N](=O)=O)C=CC=C1F)CC2""",21,"""A0551505E85900C7"""
+"""BBF4F8825F1D52B8_9B5CAB58D5F8F701_6039_UN""","""CCOC1CCC(OCCCN(CC)CC(F)(F)F)CC1""",21,"""A0551505E85900C7"""
+"""65D783BB8CDAEBAC_EB12CE6D1BF06B94_6039_UN""","""CCOC2CCC(OCC1=CN=C(C(C)(C)C)N=C1)CC2""",21,"""A0551505E85900C7"""
+"""DD748F58B9FFE0EB_E34C57287C4FD4D6_6039_UN""","""CCOC2CCC(OCC1=NC=C(C(OC)=O)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""805653E00D594CCD_81863660D0985677_6039_UN""","""CCOC1CCC(OCC(N(C(CC(C)C)C)C)=O)CC1""",21,"""A0551505E85900C7"""
+"""898D792FC8516F8A_72AADAE440AA6C5C_6039_UN""","""CCOC2CCC(OCC(N1CC(CC)OCC1)=O)CC2""",21,"""A0551505E85900C7"""
+"""20E0544771691239_9CC288E5424B129C_6039_UN""","""CCOC2CCC(OCCC1=CC=C(C(N)=O)C=C1)CC2""",21,"""A0551505E85900C7"""
+"""492D218A6C2B7148_3FDE30CD574A210A_6039_UN""","""CCOC3CCC(OCC(C12CC(C)(C1)OCC2)=O)CC3""",21,"""A0551505E85900C7"""
+"""EFF49D1DC3052E00_F1E6E77DE1102D77_6039_UN""","""CCOC3CCC(OCC1=C2C(=CC=C1)N=CC=C2)CC3""",21,"""A0551505E85900C7"""
+"""3DA55E5094C8D11E_1B6C364045EC44A4_6039_UN""","""CCOC2CCC(OCC(C1CCC(C)(C)CC1)=O)CC2""",21,"""A0551505E85900C7"""
+"""A1948B3B8D5CA139_D62FFEFAEFBABB0A_6039_UN""","""CCOC2CCC(OCC1=C(C=C(C(N)=O)C=C1)F)CC2""",21,"""A0551505E85900C7"""
+"""FF74BE08B2047D2C_F5C5E80131E88F1D_6039_UN""","""CCOC2CCC(OCC1=C(C=N[N]1C)[S](=O)(=O)Cl)CC2""",21,"""A0551505E85900C7"""
+"""B2CEEDD99E8F4EE5_CE2C55B0939F72A6_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(NOC)=O""",21,"""03DB9D4F40711A25"""
+"""35434704859C8F1C_71A9DC0861B2E9C0_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC(OC)=O""",21,"""03DB9D4F40711A25"""
+"""280D7A3639EA17B0_F4AE87202F09CF71_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(OC)OC""",21,"""03DB9D4F40711A25"""
+"""F53A242EC4008FFA_BE5CEB70A1574ADE_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(C(O)=O)=O""",21,"""03DB9D4F40711A25"""
+"""4553DD3A4FBA80E3_FB1693F9B32261AB_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCOC(C)C""",21,"""03DB9D4F40711A25"""
+"""094179751A0197E1_7D21CA1FFEDB71B2_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2OCCO2""",21,"""03DB9D4F40711A25"""
+"""24B48C22EE506663_D5B6EBB444E27C45_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2CCCO2""",21,"""03DB9D4F40711A25"""
+"""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"""
+"""73A6881F6729CE4D_4CD50E95EAF01795_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=NC=NO2""",21,"""03DB9D4F40711A25"""
+"""03760D21844D9EB1_61A3C143D93CC017_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(=O)C2CC2""",21,"""03DB9D4F40711A25"""
+"""5B13A6FD8EFD5540_522E59A4120C8AE7_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(CCC)=O""",21,"""03DB9D4F40711A25"""
+"""11BD4FF3A81EC622_DA5A1F0B8FCB2773_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(C(C)C)=O""",21,"""03DB9D4F40711A25"""
+"""72288EF612B55CB5_C0F7D7E8037F3D14_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCCOC""",21,"""03DB9D4F40711A25"""
+"""F1B501D0272210D1_1B0987F65052B95B_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCN(C)C""",21,"""03DB9D4F40711A25"""
+"""A3EA6992B13E5B10_D0B8515B0F1C72E4_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCOCC""",21,"""03DB9D4F40711A25"""
+"""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"""
+"""865C94B546D2FEDE_628538750A86A9BD_6039_DP""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCCC(O)=O""",21,"""03DB9D4F40711A25"""
+"""06F7BA6049B029FC_CD91AAD130627DF5_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=C[NH]C=N2""",21,"""03DB9D4F40711A25"""
+"""FCE3BBEB62E22B24_6A52A6B103D8C881_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CCC=CCC""",21,"""03DB9D4F40711A25"""
+"""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"""
+"""80EDE72EEEC82A59_C0C499B7AEEE8B98_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC2=C[NH]N=C2""",21,"""03DB9D4F40711A25"""
+"""3479142713F91AA5_DB19F78E17A647FB_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC[S](C)(=O)=O""",21,"""03DB9D4F40711A25"""
+"""792980A9E4DEBBA0_0866C9C46D8A2A1D_6039_UN""","""O(C1=CC(=CC(=C1)C(F)(F)F)[S](=O)(=O)Cl)CC(COC)=O""",21,"""03DB9D4F40711A25"""
+"""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"""
+"""147AA56ECD0A808F_638C69EA8F77907B_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)CC2=CC=C(C(F)(F)F)S2""",21,"""5B3D336A683DE175"""
+"""F997B5EE79744188_43D19AB02E10A59A_6039_UN""","""O(CC1=C(N=C[NH]1)C(F)(F)F)C[C@H]2CC[C@@H](C(OC)=O)O2""",21,"""5B3D336A683DE175"""
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+"""4C25CC27D401D27E_080336CF103410DA_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(F)C=CC(=C1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
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+"""97285FC7B3A80800_D620122CF775E88B_6039_UN""","""CC(C)(C)[N]2C=C(COCC(NC1=CC(=NO1)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
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+"""744E0FC81BD80CB6_44FC59A7F2EE9B63_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(OCC)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""FE2DFD6616916772_B3008A052834684D_6039_UN""","""CC(C)(C)[N]1C=C(COCCCCCCCCCC)N=N1""",21,"""071C4F5F52D57B8B"""
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+"""B16BB0A3EE87BDC1_916E47787EC970FE_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(OC)C=CC(=C1)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8BBCB104CCE75637_C6CC3BEBE20727CC_6039_UN""","""CC(C)(C)[N]1C=C(COCC(=O)NC(=O)NCC=C)N=N1""",21,"""071C4F5F52D57B8B"""
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+"""311D1942A4B1ABE2_4A2B601657F416C3_6039_UN""","""CC(C)(C)[N]2C=C(COCC(NC1=NOC(=C1)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""5EFBAB13FAEFFE8B_96C0A7E76FED63D3_6039_UN""","""CC(C)(C)[N]2C=C(COCCC(=O)NC1CCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""BC2BB7058872B138_1957AD377F6C9AB6_6039_UN""","""CC(C)(C)[N]1C=C(COCC(N(CCC)CCC)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""53BDF1670D1F0D93_77AB0BB543E9CF77_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(C(O)=O)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""3F24CD9B5297E990_957A4DAF10BB5BF5_6039_UN""","""CC(C)(C)[N]1C=C(COCC(N(C(C)C)C(C)C)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""758F39E42DB5685A_A47F669F3B1E66A9_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=C[N]2C(=N1)C=CC=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""9FE8A79FD1A41DF9_B7AF0C052C753A3B_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=C(C)[NH]C(=C1)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C1D17E8D7923EC86_F1BB74CFBD1A77F8_6039_UN""","""CC(C)(C)[N]2C=C(COCCSC1=CC=C(C)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D05DFA5F74F4D95C_84B010FF4452D2DF_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC(=O)NC1CC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""0871404D1C4F545E_22E37B1D70330DD0_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(C=CC=C1)O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""FE2A27743B96310C_4A0F9549F12F68CE_6039_UN""","""CC(C)(C)[N]1C=C(COCC[S](CCC(N)=O)(=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""C02A888FB7D4ED5C_3682DDEE79C29149_6039_UN""","""CC(C)(C)[N]2C=C(COCCSC1=CC=C(F)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""7B643877BF81280B_770A1FAD06D483F2_6039_UN""","""CC(C)(C)[N]1C=C(COCCCC(N(CC)CC)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""0583568780EE4D32_C3E6EFFB642771A2_6039_UN""","""CC(C)(C)[N]1C=C(COCCCCCC(OCC)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""FCFDB256D5D8426E_BAC094A8156A6A40_6039_UN""","""CC(C)(C)[N]2C=C(COCC(N1CC(C)OCC1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8133151E1AD7FA6F_F3AF0512E0388423_6039_UN""","""CC(C)(C)[N]2C=C(COCC(NC1=NC(=CS1)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""ACA38A84AC1D9CAA_E78C8B78256C665D_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(F)C=C(C=C1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""0B55B0FE81832F7F_B77D9C69D2B54A90_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(C=CC=C1)[NH]2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""EEF290DB871C509E_183573919652F830_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(=NO1)CC(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""50644D212D9D763D_59336C8600B37594_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C=C(C)C=C1C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""978C772E20A301B5_3310F8AB2A78A351_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(=NO1)CCCC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""FEA737DE6E0C7708_64C7DFBAF873A486_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(OC)=O)C=CO1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""2B965A0105E19A9C_F843470A469EFDCC_6039_UN""","""CC(C)(C)[N]1C=C(COCC(N(C)C(C)(C)C#N)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""C06D1643B94207D9_C56FF92BBBA99D6D_6039_UN""","""CC(C)(C)[N]1C=C(COCC(NCCC(OC)=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""7E245A4E5069B759_762AD266621643CD_6039_UN""","""CC(C)(C)[N]3C=C(COCC2COC1(CCCC1)O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""7F4C2554E22F76A9_AB4879D567F7D701_6039_UN""","""CC(C)(C)[N]2C=C(COCCCOC1CCCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""46BA0BA08E970DE5_9418BDA04DF286D9_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NN=C(C(C)(C)C)O1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8452E9EA9171CA93_5B13E0EE351A1120_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(OC)=O)OC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D7ABE02B331FE6F0_C3079886AC40D3D0_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC=C(C(C)(C)C)O1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""1A64AEAE43FA5E4E_18807B66C994CDAF_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=CC=CC(=C1)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""1BA5C1982265E55F_CD5AEABCC8E0C488_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CSC(=N1)CCCC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""9FAA9B1D1E19A770_5B175F96FC66C013_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NCC1CCOC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""9A7885599B9CE63E_9C2C45F4C2830059_6039_UN""","""CC(C)(C)[N]2C=C(COCC(N(C)C1=NC=CS1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""BEEC89AD630E04D7_E23C8C06C2E11767_6039_UN""","""CC(C)(C)[N]1C=C(COCC(NCCC(C)(C)C)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""5807387FDFB0DA74_E080383C4F311D90_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(N(C)C)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""DCD5198034454F3C_1F46990B90C2A39E_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NOC(=N1)CCCC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""61E16FFE4853F74A_912DD0D8ABF6A349_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=NO1)C(OC)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""56728B8B65A93BE2_F06DE6ACA4F3685C_6039_UN""","""CC(C)(C)[N]2C=C(COCC[N]1C=C([N](=O)=O)C=N1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""95995CB141D66663_98B1062F9883C92B_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(=NO1)CCOC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""49311F55FAC35205_E80C36FE7E63F9AE_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC1CCOCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""FC4782449687E09D_1A1FA5B9A0EB1A94_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC2=C(C=C1)OCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""2BE6EDE4F6F7F0F6_923D4DA0A23489D8_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NOC2=C1CCCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""80C240B16FEED11A_807B834EF19CDE04_6039_UN""","""CC(C)(C)[N]1C=C(COCCC(NCC(OC)=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""3E16A98FA6BC83E0_CAEA4EB0BD426AB6_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(OC)=O)SC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C91F101767BF4938_AAB07C3F0057DE3C_6039_UN""","""CC(C)(C)[N]2C=C(COCC[N]1N=C([N](=O)=O)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""83DC56108849468F_7DCE0F409DF75572_6039_UN""","""CC(C)(C)[N]2C=C(COCCCCC[N]1N=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""261BA6DB159C5503_C054A43F3F7FC6F8_6039_UN""","""CC(C)(C)[N]1C=C(COCC(C(OC)=O)NC(=O)C)N=N1""",21,"""071C4F5F52D57B8B"""
+"""252C2153DC862A5A_1512481561A34068_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NNC(=O)C1CC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""FB6807127FE0EF71_2038BB81281C0CA0_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=C[N](N=C1C)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""24F69ECBE729A889_86175351052BF553_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC1=CC=NC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""802A40F607203A66_A014EA60A886B8A5_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1=CC=C(CC)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""93DF3E1D693575DC_EE774963DD309F38_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC2=C(C=C1)CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""CF395E5FF7A8B216_98371C3424CC80B5_6039_UN""","""CC(C)(C)[N]2C=C(COCCOCC1CCCCO1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""28AA4E6D57DF1002_BECF0B68B7FB59AC_6039_UN""","""CC(C)(C)[N]2C=C(COCC1OCCN(C(C)C)C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C56699B2575330BE_A382616715B090FC_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C[N](C)N=C1[N](=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8152C8987CF975DE_9D83E91A4559AF70_6039_UN""","""CC(C)(C)[N]2C=C(COCCCOC1=CC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""46660A9F28AF4490_03636646C46E7103_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=C1)N(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""1A76BFD197F71609_12A912F61B94EBBD_6039_UN""","""CC(C)(C)[N]2C=C(COCCOC1CCCCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""3856E9602EDB5FD5_68FFBE9DC07FD46E_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(N=C[N]1C)[N](=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""676BD4A205809569_01F310D1DE3C4A10_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(C=CC=C1)S2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""1C8BF0B023B5C8E7_5F6D583D9CAA8BCE_6039_UN""","""CC(C)(C)[N]2C=C(COCCN(C)C1=CC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""0FB06B7ABEDAE6E8_2209C2305444AD61_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=N1)OCC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""344F7944DA7A327F_16B6A4B9AEA57856_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(=NO1)C(OC)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""6A0937761C07D8DD_1B41343B8338DF11_6039_UN""","""CC(C)(C)[N]1C=C(COCC[P](OCC)(=O)OCC)N=N1""",21,"""071C4F5F52D57B8B"""
+"""C34E118B9F589437_3CE2B7B12E22B505_6039_UN""","""CC(C)(C)[N]2C=C(COCC1ON=C(C(OC)=O)C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""91219986A6089692_4E34387F2F122D6B_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(=CS1)C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""9714613037256D82_CE4CBF822DBFA4AB_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(N=CC=C1)[NH]2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""ACA8E61DB185928B_C2D67C51D68873B3_6039_UN""","""CC(C)(C)[N]2C=C(COCC[N]1C=C(C(O)=O)C=N1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D529FD471BF7494B_B3AB80C8EE212EFE_6039_UN""","""CC(C)(C)[N]1C=C(COCCCNC(C(F)(F)F)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""A89F30D5F39CBC0D_259AC46FC67B3442_6039_UN""","""CC(C)(C)[N]2C=C(COCCNC(=O)C1CCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""6307C7B850D5A1E2_B85E57566FF64A76_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC=CC2=NSN=C12)N=N3""",21,"""071C4F5F52D57B8B"""
+"""E1845808A15E188B_287EFF6FE4A03200_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1=CC(=C(F)C=C1)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""1C3FEFE5E0E79E99_071A121768F8FA0D_6039_UN""","""CC(C)(C)[N]2C=C(COCC#CC1=CC=C(F)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""0524BF34BF5DE509_A595D9810D6685D6_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=C1)COC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""AB9100AF4F2B4F60_A31CBB7891381167_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=C1)C(O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""FA156D2BA3FC2169_8B55377F9CC15908_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC1CCSC1=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""1571CD8984DA1D8E_979A6227834EFA6D_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C=C(F)C=C1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""F8BAD95A3D823B1C_DE2E1DDB411D01D9_6039_UN""","""CC(C)(C)[N]2C=C(COCCCCC[N]1C=CN=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""A68C111F016A0797_618B9FE807EC8FB0_6039_UN""","""CC(C)(C)[N]1C=C(COCCCOC(NC(N)=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""05A2BDA933632F68_8A50DDA5422AE63C_6039_UN""","""CC(C)(C)[N]2C=C(COCCCC[N]1C=CN=C1C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""EB7A56A0348AA57E_BB62D8C4E21F1E1F_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(=NO1)C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""1DB06D2F02AA30A7_D27C8CB17B007182_6039_UN""","""CC(C)(C)[N]1C=C(COCCC(N(C)CCC#N)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""31F5FD43B89C5F3E_C956A15DF0ABB5EA_6039_UN""","""CC(C)(C)[N]1C=C(COCC(N(CCCC)CC)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""24FED7C932E73DFE_7AB1E5872B019608_6039_UN""","""CC(C)(C)[N]2C=C(COCCC(=O)N1CCCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
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+"""33E3A1B24B3B09A6_50CC8AC1D9082964_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NN=C(C(C)C)[N]1C)N=N2""",21,"""071C4F5F52D57B8B"""
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+"""006B392CB0C61370_24ECD0FD449CFBE8_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=NC=C1)N(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
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+"""DDB0148BE4767C46_D103DDCA9AC34441_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(N=CC=C1)S2)N=N3""",21,"""071C4F5F52D57B8B"""
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+"""B66AAB6FEAC44B32_068BA7424A00DA3E_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(C(F)F)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D3618B4E3FF270E0_0B744570E002A23C_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NCC1=CC=CO1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""81DFEB8E89711771_D189382A3B808C25_6039_UN""","""CC(C)(C)[N]2C=C(COCCCOC1CCCCO1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""E4FEF28790965D17_FDDD164D9EEF994D_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC1=CC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8BCDBD0FBED5C268_C5578A22FFF9E033_6039_UN""","""CC(C)(C)[N]1C=C(COCC(=O)N(CC=C)CC=C)N=N1""",21,"""071C4F5F52D57B8B"""
+"""4E41836D95595362_025CB742CC4A2A7F_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NN=N[N]1C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""DDF003D56FCC0503_2DB2FE98AC13F5B2_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NN=N[N]1CC2CC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""8B1640E19F28945A_36305580F2531F04_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=C1)[N](=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8A5A5FFDAD852DB1_234550B21C068594_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C([N](=O)=O)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C234B68217D5A73A_FADCFCA70FFFD6FF_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C[N](C)N=C1C(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""2E56D63B6AC4E231_3C788EBFF82DAA24_6039_UN""","""CC(C)(C)[N]2C=C(COCCCCC1=CC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""89EDA5094074F593_5F8D52E89C2D7AA8_6039_UN""","""CC(C)(C)[N]1C=C(COCC(N(CC)CC(=C)C)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""F01D3CBB9F8819B3_3F3ACC3653CF0F53_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C)C=C(C=C1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""33E13CBA0A9F7195_87B0AFE08FE97AAD_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=C1C#N)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""907B637B3302DA82_F9EAF50D770DFC78_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(F)(F)F)[NH]N=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""79870C9AFC3CDFDA_0CDB89DC08525DBD_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1CC[S](CC1)(=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B2A86FCC53325C69_07B14AA077074F89_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NN=C([S](C)(=O)=O)S1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""4FC903FE9C202E6C_8787C597423DA6C9_6039_UN""","""CC(C)(C)[N]2C=C(COCC(N1CCCC1(C)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""9BFB53792E182B78_C381B4C33BB81EBD_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC1(CCC1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C6082F674AF7F22F_72D6BB4303EA7A2F_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CCC1(CCCC1)O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""C58BBD817693A477_2EDF07F8152FA95A_6039_UN""","""CC(C)(C)[N]1C=C(COCC(CCC(OCC)=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""7873AEA019CB2621_DAE52BB1B3E58734_6039_UN""","""CC(C)(C)[N]1C=C(COCCCCC[S](CC)(=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""5243D7BFB109704D_B0ACCEC287F7F9C7_6039_UN""","""CC(C)(C)[N]3C=C(COCC(=O)C1CC2CCC1C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""F958D2994A02BC61_EE9AC55FFA95A89A_6039_UN""","""CC(C)(C)[N]2C=C(COCCCCN1CCOCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""6A9097B0F1DE96B1_5933959ECCA39C3F_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=C(C=C1)C#N)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B1928B3D5BFF8847_20F753EE4CF821CC_6039_UN""","""CC(C)(C)[N]2C=C(COCCCCC1(C)OCCO1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8DBC577D66F74E1A_B25F77451AD01687_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CCC1(CC1)C(=O)O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""09DD75ED2A17F67E_504E80031AF1E2DF_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1=C(CC)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""DBD6452340031116_6AEE8EE9DF21375C_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CC1=C(C=CC=C1)O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""84C73D672256C6B8_90D4D0EBCE5C418C_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NN=C2[N]1CCCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""489BC5493CEC8822_17F34B0D3AEB7BBA_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)C1CCCCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""96D30CAEE3297D97_953BB64DFD5716D4_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NOC(=C1)C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""6448D4B6625737EE_632C4EA409DF65E1_6039_UN""","""CC(C)(C)[N]2C=C(COCC(N1CCC(C)CC1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""80D117C42BF33928_D5B6F046505F9879_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(N=C(OC)N=C1)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""FCEF8D2E6F3B1917_0F5D446C430A024C_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC=N[N]1C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B0383877BD283EF0_3111CF333635CD44_6039_UN""","""CC(C)(C)[N]2C=C(COCC1N(C(C)C)CCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""CD35F3B5A28D0EEF_409D1ED885AFABC9_6039_UN""","""CC(C)(C)[N]2C=C(COCCCCC1CCOCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""CCEBC482408FB23A_D68D476C06BE479D_6039_UN""","""CC(C)(C)[N]2C=C(COCCCC1=CC(=NO1)CC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""34A2CBD913B6B1DD_C200977F456F2FB8_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=CN=CC(=C1)F)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B45F5D34CFFB17CF_B68D372CDC7D8497_6039_UN""","""CC(C)(C)[N]1C=C(COCC(C(C(OC)=O)(C)C)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""CD5A1DA32E9AE5A2_F697DE20BB45BBA0_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=NC=CC(=C1)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""04C4CBD5930CF789_507723F8E75D34E3_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(COC)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""CA9E333D959B6EC8_A74F75CB1D298DAC_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=N[NH]C(=N1)C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C18EC19EEBA8FB78_EB4DB6E97ABB1A87_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NOC(=N1)CCOC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""90A2C1BCB9F55DE2_6A146BAF836BDAC8_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=CC1=NON=C1C=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""2C580DC33C0A1A0C_67CB4B1005FB7C2E_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=C(C)N=CC=C1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""38812A35E7FAB82F_2DA9F1BACDD7EE67_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=N[N]1CC(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""332F6A0952D463B8_039629E9DDA73515_6039_UN""","""CC(C)(C)[N]2C=C(COCC(CC(C)(C)C1CC1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""BE11D16F3F9C8EC1_1803E784E153DBB7_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)C1CC[S](=O)(=O)C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""DCA3C842C757C5F9_42F483D90EC64F0A_6039_UN""","""CC(C)(C)[N]2C=C(COCC(N1CCCCC1C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""B782B88B8B40D124_A00A41BEDA40ED54_6039_UN""","""CC(C)(C)[N]2C=C(COCC[S](=O)C1=CC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""BFF7CCE6E9B60AD3_C29CAA541878228A_6039_UN""","""CC(C)(C)[N]1C=C(COCC(NNC(C(C)C)=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""80C534CABC5F5245_7135581E3553ADF3_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC=N[N]1CC(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
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+"""F90FE3BFC986EBD1_F439A2ED5C40A051_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)N1CCNC(=O)C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""9130A7B0D2BA28E3_FE8191FD477639CC_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C([N](=O)=O)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""F2E6FA62A7BDC9DA_080700CC55EC1411_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)CC1=CC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""41011263AC17DF88_8C5DCBF69A5E2EF8_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(N=C(CCC)O1)C)N=N2""",21,"""071C4F5F52D57B8B"""
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+"""F6C17EC8460DCB3B_E8D30FEA5A979B36_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1=CC=CC(=C1F)F)N=N2""",21,"""071C4F5F52D57B8B"""
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+"""32B1FAC5502900B0_A69D74203226E406_6039_UN""","""CC(C)(C)[N]1C=C(COCCNC(NC(C)(C)C)=O)N=N1""",21,"""071C4F5F52D57B8B"""
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+"""D776A55C584BBACF_55BC53C1F59E6508_6039_UN""","""CC(C)(C)[N]2C=C(COCCCCC[N]1N=CN=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C384F0EDBC3980A1_29D8576D05417007_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C=CC(=C1)F)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""DE9DAA701EEA2F03_661F1CA9731954C8_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(N(C)C)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""DFA6B5CD3B8E650E_36BB56DE04075747_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(C(C)=O)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""917D79EBC13318ED_1E34F7274BE75D82_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CSC(=N1)C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""6B43A660D89ED621_2EA29BFF83E05C00_6039_UN""","""CC(C)(C)[N]2C=C(COCCOC1=CC=CC(=C1)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""2B2631EE71317A66_C42D0E5E7BFC4F98_6039_UN""","""CC(C)(C)[N]2C=C(COCCC[N]1N=C(C)C=C1C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""624D959CF1920C82_308A8D94325EA80C_6039_DP""","""CC(C)(C)[N]2C=C(COCC1=NC(=NO1)C(N)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""94534C58DD2CEC22_C9F56A9BD3D2B732_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NOC(=N1)C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""7C7F5DEE020F7A25_0B6EF448D5DD4E29_6039_UN""","""CC(C)(C)[N]1C=C(COCC(N(C)CC(F)(F)F)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""F21B406B85BBEB96_FC1DE19D48F36221_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CN=C(N(C)C)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""5D9266519C6DFD80_7014D234466758D2_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(C(OC)=O)O1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""DBB1A40F8F0A5A93_43145BD612306786_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1C(NC(C)C1=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""4DBF2A09D6604B31_33F6CF27BA894C9C_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(C=C1)N=[N]#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C7065BA39F3DED5F_BBB8C8525C80E75F_6039_UN""","""CC(C)(C)[N]1C=C(COCCCC(NCC(C)C)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""4586F59F270D2E54_C6141F1EA2543783_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CSC(=N1)C(OC)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D96C306D59EB2FA2_56A15DE512BD9E0F_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CN(C1CC1)C(=O)O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""D98DAC9E2D4B0AC3_A4E32F0325764CAB_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1(CCCCC1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""FD3FC0210E981A24_56429AB1FAC3F945_6039_UN""","""CC(C)(C)[N]1C=C(COCCCCCCCC(O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""F6DA615673E23023_15C0B54B0CBFFA45_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1CC(OC(C)C1)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""AE9975513EA6FEF9_51E79E59A64A1191_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(C=C1)CC#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C8C5270ACEAE375F_2BFC1FE9A35EABDE_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NN=C(C(F)(F)F)S1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""A5F44D6721FED46B_083A106E6E72E10B_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1CC(C)CC(C1)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C3E4B1A410EF78A7_3975E9C1B5F0D590_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1=C(F)C=CC=C1F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""3CBAC2C2EF4A44DB_9C7E4C3B63A4F37E_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=N[N](CC)N=C1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""22959A7A49BD624A_1E04743D2BF9980E_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=N[N](C(C)(C)C)N=N1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""070002A336DA0E40_B5DA572DB736EB42_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1NC(=O)C=CC1=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""89F5F8D16768FBF8_4609F5D559528BA8_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1(C(OC)=O)CC1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""2A3ED654D1530B72_0854D1B573B49383_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1C(CN(C)C1=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D6F6EEAC2FD5FC3D_203035E008840591_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=N[N]1CCCCC1=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""D6A0BC58BA31B898_F28D6C6644B1C0EB_6039_UN""","""CC(C)(C)[N]2C=C(COCC1CN=C(C(C)(C)C)O1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""F052DD5C691C8599_29F7FCBB5E95B972_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C[N](C(C)(C)C)N=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""A65775AB2E5A64F9_672C46852F46DBD4_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC2=C(C=C1)C=N[NH]2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""4F79AFBC4F8F40D1_0DAF72EA18DBB33D_6039_UN""","""CC(C)(C)[N]2C=C(COCCSC1=CC=CC(=C1)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""9838436716494DFE_F355D2BF3FCC040B_6039_UN""","""CC(C)(C)[N]2C=C(COCCOCC1=CC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""2AFBAB7C453923F2_13A391BBD1178BC6_6039_UN""","""CC(C)(C)[N]1C=C(COCC[P](N(C)C)(=O)N(C)C)N=N1""",21,"""071C4F5F52D57B8B"""
+"""F67C61FB34C465D9_317F6DF6097FB63D_6039_UN""","""CC(C)(C)[N]1C=C(COCC(N=[S](N(C)C)(=O)C)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""B91E532390E14A79_B1B0DF8CC3AE8B95_6039_UN""","""CC(C)(C)[N]2C=C(COCCSC1=CC=CC(=C1)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""CB2F1BDE37EBF3DF_6E8727B7BC18197D_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NC(=N[N]1C)C2CC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""BDAC1856A18C3D0D_469ADE1AAEA7909C_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=COC(=C1)[S](N)(=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""2568F50789C8C9E5_2EB0EEC93D3FA724_6039_UN""","""CC(C)(C)[N]2C=C(COCC(OC)C1CCCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8F3946B143C39D5B_B73DDDE6CAF34D23_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=C(C=N1)C)OC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""9925B5E6F682AF17_7719B663A75C6AA8_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=NO1)C(F)(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""A42C5B30922D79DC_FFEC1B1BEC99C86D_6039_UN""","""CC(C)(C)[N]2C=C(COCCC#CC1=NC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D2E7511299171E86_BFC0FDCA55064E14_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=CC=C1)N=[N]#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D766AE4A3CDC0F9A_B1BB7F6D277CA6CB_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NC(=NO1)C2CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""A177E8D1E72DF957_3FE351BD2B5B23D5_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NC(=NO1)CC2CC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""DCEEC7F47D77E6B8_79C1C4CEF6CFDF9F_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(OC)=O)C=CS1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""39729AB83324CD95_81A39C938006C505_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=COC(=N1)C(F)(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""0560A46010681406_F798CC5D0C2601BE_6039_DP""","""CC(C)(C)[N]3C=C(COCC2CC1(CNC1)C(O2)=O)N=N3""",21,"""071C4F5F52D57B8B"""
+"""30F9F356A9FC41F7_C3CBB78FBF78D07E_6039_UN""","""CC(C)(C)[N]2C=C(COCCSC1=C(F)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""553E348F397FD307_B5E4F3C1B634C222_6039_UN""","""CC(C)(C)[N]2C=C(COCC1CCC(C(F)(F)F)O1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""BF7A824A18E70B80_BA150289BB15DAE8_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=CC(=C1)C#N)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""946E80A50567056A_B98C197F6DA549F7_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC1CCCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B262B97FA6E3E8CB_6C6F02A14FB78FB8_6039_UN""","""CC(C)(C)[N]2C=C(COCCOC1=C(F)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""91652E3E8C420813_E8C2636F6F4D3D6E_6039_UN""","""CC(C)(C)[N]2C=C(COCCOC1=CC=CC(=C1)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""68DDD8ADBA4661F2_15C4472A29D67DE6_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(SCC)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D299081B980C8E9F_C448ECE0A810C2CA_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(=CO1)C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""DD7B201CE0A2C4B7_979DA58AE3AECE36_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C[N](C(C)C)N=C1C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C1BB1D3AC609105F_B2C27C3D86B3C8A9_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CCCC1(CCC1)O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""F1482059659195CF_A29330DDBBA97EB9_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NOC2=C1COCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""D95B3B942AFAF1B8_3E3A290956B064E7_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C(B(O)O)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""4F692B1FB0BD1DE5_29CA223B94572196_6039_DP""","""CC(C)(C)[N]3C=C(COCC2OCC1(CCNC1)C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""4145226E538DECCC_23D463742C12957C_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC=N[N]1C2CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""0180B38D9FDDB36B_1505A9874D4201E7_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(C)C)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""32F68E86D6D6FF70_C54C550A3C8E8709_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)C1=CC=CNC1=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""03DC6CA667F65810_40506A471A6B80BB_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=C(N=C(C)S1)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""206E1F7C074559F1_CBDDF8C59BC89048_6039_UN""","""CC(C)(C)[N]2C=C(COCCCCC1(CCC1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""436AC258753F9D74_71EF4E7045D92C6F_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=C(ON=C1C)C2CC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""0F9C403EEBAC6BC7_7F287EE1B02629A1_6039_DP""","""CC(C)(C)[N]3C=C(COCC1OC(CC12CNC2)=O)N=N3""",21,"""071C4F5F52D57B8B"""
+"""B44CDBEA0A55098D_6FF2773DA1E1113E_6039_UN""","""CC(C)(C)[N]3C=C(COCC1OC(=O)CC12CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""9BEC6F4A3CD61A75_A09F7B3352AB6831_6039_DP""","""CC(C)(C)[N]2C=C(COCCC1(C(O)=O)CCOC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""BCA0208771229030_E2717F9B82D56E86_6039_UN""","""CC(C)(C)[N]1C=C(COCC(CC(OCC)=O)(F)F)N=N1""",21,"""071C4F5F52D57B8B"""
+"""D685D74C6A6823DC_4215D49EF15F23FE_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(CCC)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""607E68A65BDCD82D_8CC9133BF3397019_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1CCC(F)(CC1)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""91F2661104053D54_BBC0E97F04CF1522_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)NC1=NN=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""7E979D9284D261AD_D5F97F81122EC5EF_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=N[NH]C2=C1COCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""01897F08B1BCCF6F_D84090521AC8906C_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(F)F)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""2C489521E6970560_9C347915AB680E8C_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CSC(=N1)COCC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""4F79E249609740A0_2A75C737012CF69A_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=C1C=CC=CC1=NO2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""18CB3454F665ACDB_40F840D9AC87AC7F_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC2=C(C=C1)[NH]N=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""2EED6E5ECCD70831_1F98C2187176C02A_6039_UN""","""CC(C)(C)[N]3C=C(COCC12OCC(C)(CO1)CO2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""08416EEA1FA150F1_2C24BC49DEC73CA3_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C([N](C)N=N1)C(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""7E8C66CCE41DBF42_41F0FB6B36F87F76_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=NC=C1)OCC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""0137085C8B3FC51B_966E96CFD907BDBA_6039_DP""","""CC(C)(C)[N]3C=C(COCC1=NC(=NO1)C2CNC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""4D7020F6066D8AF8_41F0912F7CCF36FD_6039_UN""","""CC(C)(C)[N]1C=C(COCC[S](CCC(O)=O)(=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""8C8C330C7E9849C3_9F4AE00CD1F7B71F_6039_DP""","""CC(C)(C)[N]3C=C(COCC1=N[NH]C2=C1C=CC=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""CD24BCCA7DF1C21F_0E9E31396CD8231A_6039_UN""","""CC(C)(C)[N]1C=C(COCCO[S](C(F)(F)F)(=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""114518D1F26E631D_4BF9E5F7E2E1A38E_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=C1SC=CC1=CC=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""56B261364C04E2ED_BE0412B280DE58C4_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC=CC2=NC=N[N]12)N=N3""",21,"""071C4F5F52D57B8B"""
+"""050359DB74E96693_AC210906C467B5BC_6039_UN""","""CC(C)(C)[N]2C=C(COCC1CCC(F)(F)C(N1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D4246CD32659ABED_B1144A26FDE7BDDD_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC=C[N]2C1=NC=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""7A80C5AF46B30FF2_13142A29B640A400_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CC1COCCC1O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""4E5376FEA61CD06D_6A9C49243A982FB1_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)CCC1CCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""1C4AAC6BF0F5318D_C2413836DCF1393A_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=C(C)SC(=C1)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8FC515B49EBD2997_723E129432FB63B4_6039_UN""","""CC(C)(C)[N]1C=C(COCCC[S](CCOC)(=O)=O)N=N1""",21,"""071C4F5F52D57B8B"""
+"""94AAF71B7747C88B_09A7037DF32BBFB3_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CSC(=N1)NC(C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B5CDD884E7CE5E14_FC173028CC430E41_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NN=N[N]1C2CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""770F248EE94CADDD_C2C13C15574A2D81_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NOC(=N1)CC(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B84BED33EA4E16B6_757559C70ADC13BC_6039_UN""","""CC(C)(C)[N]2C=C(COCCOC1=C(C)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""4BD7152819BB1514_DEF93DE87A724745_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NN=N[N]1CCCC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B1FAA6BC48A51C32_E9993136358D35F8_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NN=C(C(F)(F)F)O1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""3D184E9E3FE6AA8A_15DFE89E3D52FC78_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=C(F)C=C1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""CCBE4D084DF23E53_3A25DAF19F4DBF8A_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C([S](C)(=O)=O)SC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""457688BC5F2AE8D5_47B2B2D81682D571_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=C([S](C)(=O)=O)O1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""2BFB014E022B5D52_1F92F438633D6AB5_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NSC2=C1C=CC=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""9CF7803F5E6870A0_7BC6EF24C8CA1D16_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=C(OC=N1)C2CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""67AEF521246B7AF8_486C76F008F7527A_6039_UN""","""CC(C)(C)[N]2C=C(COCCOC1(CCOC1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""6430CC18F21B089D_D9A6DCF7FD89AB2D_6039_UN""","""CC(C)(C)[N]3C=C(COCCC1C2CCN(C1)CC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""47E7462E2D7E64BE_ABBFF67ED176355E_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=CC1=NC=N[N]1C=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""5DF59AB2DEDE28E8_0FA92786072EC52A_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=NO1)C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C553DD1F6F8C0634_EFF40F9418342808_6039_UN""","""CC(C)(C)[N]3C=C(COCC1NC(=O)CC12CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""564DD8FFD832C71A_7A5B62195DBDE993_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(CCCC1)[NH]2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""A656854CBCD79C97_E62596F0E38CE135_6039_UN""","""CC(C)(C)[N]3C=C(COCC1CCCC(O1)C2CC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""1F22EDBBF5F08D56_0D5E96B9AAC63A23_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(CCCC1)S2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""94DAB141D467938F_ADEA1C03E7A6F3AC_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=CC1=NSN=C1C=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""1D2DAFF5D5F7E37E_F9AE495E0A1AD792_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC(=CC=C1)C2CC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""C5D2A0E10E031F9D_DD67F4CDA87C8736_6039_UN""","""CC(C)(C)[N]2C=C(COCC(OC)C1CCCOC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""91EDD68BD4CE9250_B65743FDE1894736_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC=CC(=N1)CCC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""0C70F254F5CD819A_B604E683B3536AB7_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CN=C(OC)C=C1C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""DAACE737D0289508_4ECAE70F6ACB71AC_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=CC(=NC=C1)F)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""95D8C1C3D4C9FD18_C6D09BD5A9DAE7CC_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1=CC=CC(=C1)OC)N=N2""",21,"""071C4F5F52D57B8B"""
+"""1E9E6B018C9E7D42_714AA41598E0E406_6039_DP""","""CC(C)(C)[N]2C=C(COCCOC1=CC=C(O)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C091F78B7A9AC6B4_540E1712F477E993_6039_UN""","""CC(C)(C)[N]3C=C(COCC2[N]1C=CN=C1CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""2C25DD136E9C5C5B_C6852916FD898779_6039_UN""","""CC(C)(C)[N]2C=C(COCC1ON=C(C(C)(C)C)C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""095DA48B34043B30_6251525F37A198BB_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CCC1(CCOC1)O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""EBA4C4BA9EAA75C8_384986CEDF5160A6_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=N[N](C(=C1)C)C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""6D67A3E0F0B40090_1F0D71A7871DEC2E_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=NC1=C(COCC1)S2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""B761D5FB127C8C37_D1D194D79A7A84E4_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C=CC(=C1)OC)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8051B53152330684_813F6B3272855A6F_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC=C(C(O)=O)C=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""BFE75EDD0DE44156_4E632D5D994501EB_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(C)C)ON=C1C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""CEAAC3BBF3626F76_D142CEC2608C3065_6039_UN""","""CC(C)(C)[N]1C=C(COCCO[Si](C(C)(C)C)(C)C)N=N1""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""C18A03891746356B_F8E5E15199E684A3_6039_UN""","""CC(C)(C)[N]1C=C(COCCOC[P](OC)(=O)OC)N=N1""",21,"""071C4F5F52D57B8B"""
+"""4AEE2582818612D4_F13372381E424C2E_6039_DP""","""CC(C)(C)[N]3C=C(COCC2CC1(CCN1)C(O2)=O)N=N3""",21,"""071C4F5F52D57B8B"""
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+"""C7019FE363C52613_ED42CA033A5FA9A3_6039_UN""","""CC(C)(C)[N]2C=C(COCC(=O)C1=CNC(C=C1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""76792B05138BB492_E6512082D8B4386B_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C=C(OC)C=C1)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""E2746DFE3F5BD716_4228234CD1F5507C_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1=C(C=C(C)C=C1)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""A21F39999914B4B6_2244F4263008D050_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(=NO1)C(C)(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""BDA9023294E6AB2F_4EB21EDF399DDCDD_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CC1CCCCC1O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""142091786F5051A7_3325BDEA9AC606B9_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CON=C1C(C)(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8E400667010A0CE3_3A4DFC9FC5B52184_6039_DP""","""CC(C)(C)[N]3C=C(COCC2=C(C1CNC1)OC=N2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""CFBBEDEBE6087D7A_9C6F17A9D7B16B0B_6039_UN""","""CC(C)(C)[N]2C=C(COCCCN1CCOCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""F9F9D9FFA0642381_1A640A18C7E24274_6039_UN""","""CC(C)(C)[N]3C=C(COCC2COC1=CSC=C1O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""610F967CC6FB8789_08E136AF3C4544CB_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C=CC=C1)CC=C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""EDDFFE128AF66EA7_F3DA43C1FF871222_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CON=C1C2CCC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""3B3E7173CB056554_C33597F134F9640C_6039_UN""","""CC(C)(C)[N]2C=C(COCCC=CC1=CC=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B04C47A76DCEF2BC_D517B7F032A75D14_6039_UN""","""CC(C)(C)[N]2C=C(COCCCN[S](=O)(=O)C1CC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""9ECA1BD24DC4D005_8E1879BB58EF3B2D_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C[N](C(C)(C)C)N=N1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""C2FA77D8E89D8049_8BA8260F25F80D1A_6039_UN""","""CC(C)(C)[N]2C=C(COCC(C1=C(C)C=CC=C1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""5F8F82577556447D_8A7DB396B8AE4C09_6039_DP""","""CC(C)(C)[N]3C=C(COCC2CC1(CCNCC1)O2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""E1020A1897396C40_75ED19473FE5A845_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1(C(F)(F)F)CCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""DD9B0663D9DA7E7E_CAA1D851476B6AEF_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CSC=C1C(F)(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""FCE5DBEDEB160A62_CC5B9F331B769918_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1C(C)(COCC1)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""EADC3CDD5CFCB5F9_D9CBE334B4F37E67_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C([S](C)(=O)=O)C=CS1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""711382744EA88883_6976ACEA58817E6F_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(OC)C=CC(=N1)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""79870C9AFC3CDFDA_80C09690BC43B486_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1CC[S](=O)(=O)CC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""613F51A3080276E2_985AC56B62E6C1AF_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NSC(=C1)C(F)(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""92589FF33824D5BB_36E1325F7AE5928A_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(N=C(OC)C=C1)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""1AA381A47347EF46_054C5290E3A0E6DB_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CSC(=C1)C(F)(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""207135CFAD5C5048_82DEA7307CBF5C94_6039_UN""","""CC(C)(C)[N]2C=C(COCCCCCC1OCCO1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""3A0FC88EA436BCD4_B5F227F465B81B75_6039_UN""","""CC(C)(C)[N]3C=C(COCC2CC1(CC1)[S](=O)(=O)N2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""C031EAD563D036F3_080F123709D6498F_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC2=C(C=C1)N=N[NH]2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""2CBD641C985691DE_D2BF9F71D21DF45F_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC=CC2=CC=N[N]12)N=N3""",21,"""071C4F5F52D57B8B"""
+"""3239C2C7DD271345_DD5BFF12DDFF2F3A_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(COC)C=CC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B247C9A36540D816_26C83CC1489E6021_6039_UN""","""CC(C)(C)[N]2C=C(COCCCC1=C(C)C=CN=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""9FD32E27E2463F62_F5185F1B19D763A0_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(C(OC)=O)CO1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""B55F2B1A2930E1A5_7AC0FE8231780DCE_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NC(=CC=C1)CC#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""046BB39E3E0B17A2_C710D59A969B52C7_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=CS1)C(F)(F)F)N=N2""",21,"""071C4F5F52D57B8B"""
+"""E72CC3E369789250_F7099EC2D316372C_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=N[N](C)C=C1[N](=O)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""32C6BCEFBBF8F6E1_ECAF12F774D82EA8_6039_DP""","""CC(C)(C)[N]3C=C(COCC1=CC(=NO1)C2CNC2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""DE2876265364BF35_896B1C1EF58F1D38_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=CC2=C(C=C1)C=CO2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""B481C106EF18C686_4EC52203654AFDF2_6039_DP""","""CC(C)(C)[N]2C=C(COCC(N1CCNCC1C)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""9F29AE78A9A10A5D_5FF203D40A298A41_6039_DP""","""CC(C)(C)[N]2C=C(COCC(NC1CCNCC1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""95B389C0296428A9_B0965231CE9BC392_6039_DP""","""CC(C)(C)[N]2C=C(COCCC1(CCNCC1)C#N)N=N2""",21,"""071C4F5F52D57B8B"""
+"""5A3282C2EF992FB1_08504749BD80EE52_6039_UN""","""CC(C)(C)[N]3C=C(COCC1=NN=C2C=CC=N[N]12)N=N3""",21,"""071C4F5F52D57B8B"""
+"""6DC31EAE0298337C_315B122365540A88_6039_DP""","""CC(C)(C)[N]3C=C(COCC2=CC1=C(CNC1)C=C2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""431B1575BAAB50D0_2916257DD5B2DC31_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NCC(C(OC)=O)O1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D47AF02F4E4C202E_427684C46EE2C0A9_6039_UN""","""CC(C)(C)[N]2C=C(COCCNC(=O)N1CCCC1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""4A04D7D1B4217645_52979936CDF53E4F_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=NOC(=C1)CC(C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""4D218FB960C22E82_E1D80B734B332F45_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=N[NH]C(=C1)C(OC)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D9726B44349BE750_E9772C9CC6B51DE8_6039_DP""","""CC(C)(C)[N]2C=C(COCC(N1CC(C)NCC1)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""8D0FED8624AC760B_3DF5F6A1CC337073_6039_UN""","""CC(C)(C)[N]3C=C(COCC2=CC1=C(C=CC=N1)S2)N=N3""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""1B85D882DF4FCF36_FA2197C7FDF90FE1_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=CC(=NC(=N1)OC)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""D90237C5172F3D24_DF5535A5FEEA6509_6039_UN""","""CC(C)(C)[N]2C=C(COCCN1CCCO[P]1(N)=O)N=N2""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""8207068339DA8D81_65E86569E43A8E70_6039_UN""","""CC(C)(C)[N]2C=C(COCCC1=C([N](N=C1C)C)C)N=N2""",21,"""071C4F5F52D57B8B"""
+"""23E98BC27BBE559D_D0D1264AB6EF4129_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(OC)=O)SN=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""209710FBA713BC7D_D69B9C862147272B_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(F)F)C=NC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""F96BB776166B3009_5A555BAF2A643139_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(F)(F)F)SC=C1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""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"""
+"""90AFBBC08F1D48E6_B73A4FA62406858D_6039_UN""","""CC(C)(C)[N]2C=C(COCC1=C(C(C)(C)C)OC=N1)N=N2""",21,"""071C4F5F52D57B8B"""
+"""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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+"""B679520782EDBA96_08E12CEB5344FADC_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NOCC2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
+"""BE6D9CAD908D6894_4203E09483374562_6039_UN""","""O(CC1CCC(F)CC1)CC2=C[N](N=C2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
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+"""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"""
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+"""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"""
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+"""80C270D6D47697CA_89E66F982CF73644_6039_UN""","""O(CC1CCC(F)CC1)CC2=N[N](C=C2)C3=CC=CC=C3""",21,"""520A53A4D10B1B78"""
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+"""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"""
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+"""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"""
+"""8989CD9458E48A4B_28416F0B5A65441D_6039_UN""","""O(CC1CCC(F)CC1)CCC2=C[N](CC(OC)=O)N=N2""",21,"""520A53A4D10B1B78"""
+"""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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+"""7FDA2329B1B9C5D0_D5C82C2D381AA9C1_6039_UN""","""O(CC1CCC(F)CC1)CCCC2=N[N](C)C=C2C(=O)O""",21,"""520A53A4D10B1B78"""
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+"""2485113A4A9FEC9D_73D3EE4E6A269FD3_6039_UN""","""O(CC1CCC(F)CC1)CC[S](=O)(=O)CC2=CC=CC=C2""",21,"""520A53A4D10B1B78"""
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+"""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"""
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+"""5928416D3F1E158C_86707ABF763B4164_6039_UN""","""O(CC1CCC(F)CC1)CC3=CC2=C(OC(F)(F)O2)C=C3""",21,"""520A53A4D10B1B78"""
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+"""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"""
+"""8F1DD73F3948FD2D_B5859F6A21BE72E4_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)NC2=CC=C(C=C2)C#N""",21,"""520A53A4D10B1B78"""
+"""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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+"""CB6A8D721C6EDFCC_16F30121690DD767_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C)C=CC(=C2)[S](=O)(=O)Cl""",21,"""520A53A4D10B1B78"""
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+"""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"""
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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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+"""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"""
+"""6FE498B7C475E53A_56CF0DCC75DDE7BE_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C3=CC2=C(C=CC=C2)O3""",21,"""520A53A4D10B1B78"""
+"""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"""
+"""82051DE613AA2FD2_94324A276080485C_6039_UN""","""O(CC1CCC(F)CC1)CC(NCC2=C(C)C=CC=C2)=O""",21,"""520A53A4D10B1B78"""
+"""4410797C09D19881_114F9176F697182D_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC(=C(C(OC)=O)C=C2)C""",21,"""520A53A4D10B1B78"""
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+"""7ECEF5F7D522BA1D_6C0EEF6F1A6CECAF_6039_UN""","""O(CC1CCC(F)CC1)CC3=NC2=C(CC(C)(CC2)C)S3""",21,"""520A53A4D10B1B78"""
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+"""785F5C3F1E169FFD_DA60F8FB1D0D7B97_6039_UN""","""O(CC1CCC(F)CC1)CC(C2=CC(=C(C=C2)C#N)F)=O""",21,"""520A53A4D10B1B78"""
+"""CBB27B91CBFB3FCD_AEBED0E5DCDB552C_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=CC(=C2F)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"""
+"""816B8053F902A4BC_C75CE6E11AE5054F_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C)C=C(C=C2)C(F)(F)F""",21,"""520A53A4D10B1B78"""
+"""E6D374359044A373_F6DE2318A8946D77_6039_UN""","""O(CC1CCC(F)CC1)CCC2=C(C(F)(F)F)C=CC=C2""",21,"""520A53A4D10B1B78"""
+"""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"""
+"""B89EB54D7D75DA0F_C4FA922657A82E71_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)C3=C2C=CC=C[N]2C=N3""",21,"""520A53A4D10B1B78"""
+"""F0DEA104BA2F6715_1662543EB04ECB45_6039_UN""","""O(CC1CCC(F)CC1)CC2=C(C(=N[N]2C)C)[S](=O)(=O)Cl""",21,"""520A53A4D10B1B78"""
+"""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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+"""D1652A7B8A6B3378_EE2A733C5C7F7D4B_6039_UN""","""O(CC1CCC(F)CC1)CCCCO[S](C(F)(F)F)(=O)=O""",21,"""520A53A4D10B1B78"""
+"""C54D54F91621E826_36754679F3DCE47E_6039_UN""","""O(CC1CCC(F)CC1)CC(N=[S](N(C)C)(=O)N(C)C)=O""",21,"""520A53A4D10B1B78"""
+"""F3B98B34646EE7E0_A9D70A35398264FA_6039_UN""","""O(CC1CCC(F)CC1)CC3=CC2=C([N](CC)N=N2)C=C3""",21,"""520A53A4D10B1B78"""
+"""77F6945333BA577C_B1211C4DFEF964A9_6039_UN""","""O(CC1CCC(F)CC1)CC2=CC=C(NC(OC)=O)C=C2""",21,"""520A53A4D10B1B78"""
+"""A774954CD2B00C48_921E602CE1A9EFAA_6039_UN""","""O(CC1CCC(F)CC1)CC2=CN=C(C(OC)=O)C=C2C""",21,"""520A53A4D10B1B78"""
+"""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"""
+"""64A9E9F48FAB25FB_BA50C490E3EF3532_6039_UN""","""O(CC1CCC(F)CC1)CC(=O)N3CC2=C(C=CC=C2)C3""",21,"""520A53A4D10B1B78"""
+"""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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+"""7F935C24289A6718_2042B71C7CDC739E_6039_UN""","""O(CCOCCOCCF)CC(NCC1=CC=C(C)S1)=O""",21,"""FCDA031414BF628E"""
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+"""90C01B311E470607_E6403AB1DFEF16B8_6039_UN""","""O(CCOCCOCCF)CCN(CCCC)CCCC""",21,"""FCDA031414BF628E"""
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+"""799A6BE89E8A02A5_B860B0E87C395AA6_6039_UN""","""O(CCOCCOCCF)CC2=CC1=C([N](C)N=N1)C=C2""",21,"""FCDA031414BF628E"""
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+"""6C66716D5F8A0A5A_6E25E2B2436E1BFF_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)C(SCC)C""",21,"""FCDA031414BF628E"""
+"""A7F53C65BECE0C78_BA6F26D93849EA1F_6039_UN""","""O(CCOCCOCCF)CC1=C[NH]C(=N1)C2=CC=CS2""",21,"""FCDA031414BF628E"""
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+"""99379B9E9DED9436_CB8087B8A99DCDC1_6039_UN""","""O(CCOCCOCCF)CC(NC1CCC(C)CC1)=O""",21,"""FCDA031414BF628E"""
+"""E2F8D4612403B8D1_299F2E72D614822B_6039_UN""","""O(CCOCCOCCF)CC1=NC(=NO1)C2=CC=CO2""",21,"""FCDA031414BF628E"""
+"""00DC42FE72D382A0_4B6475E1700D57F6_6039_UN""","""O(CCOCCOCCF)CCOC1=C(C)C=CC=C1C""",21,"""FCDA031414BF628E"""
+"""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"""
+"""D25D3FC019BD42C5_07C885B64C46F292_6039_UN""","""O(CCOCCOCCF)CC2=NC1=C(SC=C1)C(=O)N2""",21,"""FCDA031414BF628E"""
+"""880D0FD0D308511C_36F41971C79A20D3_6039_UN""","""O(CCOCCOCCF)CC(=O)NCCC1=CC=CS1""",21,"""FCDA031414BF628E"""
+"""786A8FFE7DD07498_EA2B1511BBE376C5_6039_UN""","""O(CCOCCOCCF)CCN1C(NC(C)(C)C1=O)=O""",21,"""FCDA031414BF628E"""
+"""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"""
+"""A919AF3E3405C2A4_5DEAC058BFD5D2B6_6039_UN""","""O(CCOCCOCCF)CC1=C(OC)C=C(C=C1)C#N""",21,"""FCDA031414BF628E"""
+"""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"""
+"""459A756D01CA154A_B561DB7D3F8001A3_6039_UN""","""O(CCOCCOCCF)CCCOCC1=CC=CC=C1""",21,"""FCDA031414BF628E"""
+"""A368603994B0BF16_3943BE2B43C70844_6039_UN""","""O(CCOCCOCCF)CC(N1CC(C)OC(C1)C)=O""",21,"""FCDA031414BF628E"""
+"""47D41D2F7A428933_CD6F756AE8961087_6039_UN""","""O(CCOCCOCCF)CC(NC1=CC=CC(=C1)C)=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"""
+"""A425269676D1FD39_72D3F456A65ED6FC_6039_UN""","""O(CCOCCOCCF)CC(NC1=CC=CC(=C1)F)=O""",21,"""FCDA031414BF628E"""
+"""4A57C7E0B2990751_104323BFEDD5050D_6039_UN""","""O(CCOCCOCCF)CC(C1=CC=CC(=C1)OC)=O""",21,"""FCDA031414BF628E"""
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+"""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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+"""D8E54396D130C830_A215CFB4F167DD04_6039_UN""","""O(CCOCCOCCF)CC1=NN=N[N]1CC(F)(F)F""",21,"""FCDA031414BF628E"""
+"""7F0D94048AB4E797_E99A8AC051F1E434_6039_UN""","""O(CCOCCOCCF)CC1=N[N](CC(F)(F)F)N=N1""",21,"""FCDA031414BF628E"""
+"""7A06F0F6B805EAF6_5B01B2800CB188E8_6039_UN""","""O(CCOCCOCCF)CC1=CC=C(C=C1)C2CCC2""",21,"""FCDA031414BF628E"""
+"""BC966CE5A6162D6B_D37845D1025ADE67_6039_UN""","""O(CCOCCOCCF)CC1=NN=C2[N]1CCCCC2""",21,"""FCDA031414BF628E"""
+"""B357AAE912CA727A_FE0811EF2EBA8CCB_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=N1)C(OC)=O""",21,"""FCDA031414BF628E"""
+"""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"""
+"""3766B77FAD34EF53_B0BB41B95BF65AB9_6039_UN""","""O(CCOCCOCCF)CC1=CC=C([S](Cl)(=O)=O)C=C1""",21,"""FCDA031414BF628E"""
+"""DE7EC1E5B536D9D9_4CF03AF78040BBD7_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(N=C1)C=CC=C2""",21,"""FCDA031414BF628E"""
+"""3F10E74EABA7E536_D8D76EFE0D46E61B_6039_UN""","""O(CCOCCOCCF)CC1=CC=C([S](C)(=O)=O)C=C1""",21,"""FCDA031414BF628E"""
+"""AF3041D733AA08F4_60194C0B083D45EC_6039_UN""","""O(CCOCCOCCF)CC1=C(C=CC=C1)[S](=O)(=O)Cl""",21,"""FCDA031414BF628E"""
+"""3EB6951CC3CB37A1_50126B59CED03986_6039_UN""","""O(CCOCCOCCF)CCCC1(CCOCC1)C#N""",21,"""FCDA031414BF628E"""
+"""6664801D901987D4_1977AFFBC7DA4EA2_6039_UN""","""O(CCOCCOCCF)CC1=C(OC)N=C(C=C1C)C""",21,"""FCDA031414BF628E"""
+"""1D1AB7E94B9FDE9D_0B64CAF0C2D27299_6039_UN""","""O(CCOCCOCCF)CC1=CC(=CC=C1)[S](=O)(=O)Cl""",21,"""FCDA031414BF628E"""
+"""9EA22B1BCBCE3E48_84F716C78F664E16_6039_UN""","""O(CCOCCOCCF)CC1=C(C(F)(F)F)C=CC=C1""",21,"""FCDA031414BF628E"""
+"""3A7D381ECF423A63_4C3212EFEBCE2480_6039_UN""","""O(CCOCCOCCF)CC(=O)COC1=CC=CC=C1""",21,"""FCDA031414BF628E"""
+"""9CCE9EC1A07C7969_58240099632CD358_6039_UN""","""O(CCOCCOCCF)CCC(CC(OCC)=O)(C)C""",21,"""FCDA031414BF628E"""
+"""795DA5297B525613_682FA97552F6588F_6039_UN""","""O(CCOCCOCCF)CC1=CC=C(NC(C)=O)C=C1""",21,"""FCDA031414BF628E"""
+"""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"""
+"""F910F10997E342C7_D94016B1C83B784E_6039_UN""","""O(CCOCCOCCF)CC(C1=CC=CC(=N1)OC)=O""",21,"""FCDA031414BF628E"""
+"""D4B33A17890D028F_DDC25A19F02A768B_6039_UN""","""O(CCOCCOCCF)CCN1C2=C(CC1)C=CC=C2""",21,"""FCDA031414BF628E"""
+"""190426FAAFA626F6_0E1EA822E87EE230_6039_UN""","""O(CCOCCOCCF)CC1=C(N=C(C(C)C)C=C1)C""",21,"""FCDA031414BF628E"""
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+"""B20CA6F7B16B1DC3_956830C94D26C03B_6039_UN""","""O(CCOCCOCCF)CC1=N[N](CC(F)(F)F)C=C1""",21,"""FCDA031414BF628E"""
+"""FACCDEF2B18E9904_AF7AD9D5BBB9096D_6039_UN""","""O(CCOCCOCCF)CCN(C)CC1=CC=CC=C1""",21,"""FCDA031414BF628E"""
+"""958B6A243F139EF1_12482059393E7C23_6039_UN""","""O(CCOCCOCCF)CC1=CC=CC(=C1)[S](C)(=O)=O""",21,"""FCDA031414BF628E"""
+"""FD7663AD71AC1122_5619CFC054518131_6039_UN""","""O(CCOCCOCCF)CC1=C[N](CC(OC)=O)N=N1""",21,"""FCDA031414BF628E"""
+"""B69B1EA52C08F7FF_5A58DFEDB633A11A_6039_UN""","""O(CCOCCOCCF)CC(N1CC(CC(C)C1)C)=O""",21,"""FCDA031414BF628E"""
+"""675059E43F0938B9_7EB43DFC132F79F8_6039_UN""","""O(CCOCCOCCF)CC(N1CCCCC1CC)=O""",21,"""FCDA031414BF628E"""
+"""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"""
+"""BE5800F2C1000A2E_F7708E46ED876BC7_6039_UN""","""O(CCOCCOCCF)CC2COC1=C(C=CC=C1)O2""",21,"""FCDA031414BF628E"""
+"""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"""
+"""5AE210869C468A9A_CC3AD831E0CA7637_6039_UN""","""O(CCOCCOCCF)CC1=C(ON=C1)C2=CC=CS2""",21,"""FCDA031414BF628E"""
+"""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"""
+"""4AEFCEC6DEB51393_9728213F99A6CFFF_6039_UN""","""O(CCOCCOCCF)CCOCC(C(F)(F)F)(F)F""",21,"""FCDA031414BF628E"""
+"""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"""
+"""00A8829908D158F7_B68678A0BAD05A2E_6039_UN""","""O(CCOCCOCCF)CC(N(C)CC1=CC=CS1)=O""",21,"""FCDA031414BF628E"""
+"""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"""
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+"""7CB733B4992FC052_3BFD793A23DE2664_6039_UN""","""O(CCOCCOCCF)CCC1=NSC2=C1C=CC=C2""",21,"""FCDA031414BF628E"""
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+"""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"""
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+"""A54CA7A1FFA5D3F5_3117D8896E551F27_6039_DP""","""O(CCOCCOCCF)CC1=CC=CC2=C1CCNC2""",21,"""FCDA031414BF628E"""
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+"""B8AAE3105B1D9043_2E523D05DB0EC2BD_6039_UN""","""O(CCOCCOCCF)CC1=CC2=C(C=C1)C=CN=C2""",21,"""FCDA031414BF628E"""
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+"""35D20BD79734E328_552C2455D27262A5_6039_UN""","""O(CCOCCOCCF)CC(NC1CCN(C)CC1)=O""",21,"""FCDA031414BF628E"""
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+"""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"""
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+"""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"""
+"""0B9774BFE264936B_84C4853CDCA2465E_6039_UN""","""O(CCOCCOCCF)CC2=NC1=C(CC(C)CC1)S2""",21,"""FCDA031414BF628E"""
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+"""C9148E47DAECE9BD_2FD23D4E07D9073D_6039_UN""","""O(CCOCCOCCF)CC1CN1CC2=C[N](C)N=C2""",21,"""FCDA031414BF628E"""
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+"""CBA1FB6CCF7B3670_2E25CCF5BC4C0E15_6039_UN""","""O(CCOCCOCCF)CC(N1CC(CC)OCC1)=O""",21,"""FCDA031414BF628E"""
+"""95068A2B75698E7F_C04D9EF4BEAD70D5_6039_UN""","""O(CCOCCOCCF)CCC1=CC=C(C(N)=O)C=C1""",21,"""FCDA031414BF628E"""
+"""C24BB2B7535FF4D8_635126DCABAC4343_6039_UN""","""O(CCOCCOCCF)CC(C12CC(C)(C1)OCC2)=O""",21,"""FCDA031414BF628E"""
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+"""000E1E4BCCBEDDA6_47E32051B90A26ED_6039_UN""","""O(CCOCCOCCF)CC(C1CCC(C)(C)CC1)=O""",21,"""FCDA031414BF628E"""
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+"""1D53945CFCBDB6FB_A94AFE10CD0EED54_6039_UN""","""O(CCOCCOCCF)CC1=C(C=N[N]1C)[S](=O)(=O)Cl""",21,"""FCDA031414BF628E"""
+"""8E72DDB2FDD9FF97_D79BAB3AF220A654_6039_UN""","""C[N]1C=CC(=N1)CCOCC(NC(C2=CC=C[N]2C)=O)=O""",21,"""87A152E70E3EDF25"""
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+"""F7DE2988E1DA4506_6740225D396F9717_6039_UN""","""C[N]1C=CC(=N1)CCOCC(N2CCCC(C(N)=O)C2)=O""",21,"""87A152E70E3EDF25"""
+"""BBBA18ACE7A69FDF_444192D0B96BB119_6039_UN""","""C[N]1C=CC(=N1)CCOCC2CN=C(O2)C3=CC=CC=C3""",21,"""87A152E70E3EDF25"""
+"""2B308917A654BC84_4745AE72A599AA11_6039_UN""","""C[N]1C=CC(=N1)CCOCCCCCCCCCCCC""",21,"""87A152E70E3EDF25"""
+"""28A17A1A4D76364A_C0CF90308FCEFC3A_6039_UN""","""C[N]1C=CC(=N1)CCOCC(N2CCC(C(N)=O)CC2)=O""",21,"""87A152E70E3EDF25"""
+"""466EC4C860769FD6_29FA363F4B72146C_6039_UN""","""C[N]1C=CC(=N1)CCOCCCC3=NC2=C(C=CC=C2)O3""",21,"""87A152E70E3EDF25"""
+"""D2C2A88ACB58F838_2AC65E3C028EB0D7_6039_UN""","""C[N]1C=CC(=N1)CCOCC(C2=CC(=C(C)C=C2C)C)=O""",21,"""87A152E70E3EDF25"""
+"""167797359AAC26C0_04BC37471F5280DC_6039_UN""","""C[N]1C=CC(=N1)CCOCC(NC2=C(C=C(C)C=C2)F)=O""",21,"""87A152E70E3EDF25"""
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+"""3D6BFB7BA8DB0FA7_1EF0872A578AC876_6039_UN""","""C[N]1C=CC(=N1)CCOCCOC2=CC=C(OCC)C=C2""",21,"""87A152E70E3EDF25"""
+"""618B423DF400B5D9_2597ECC800A646AE_6039_UN""","""C[N]1C=CC(=N1)CCOCC(=O)NC(=O)NC2CCCC2""",21,"""87A152E70E3EDF25"""
+"""ECBA1E2D4F6D4AA6_463E0C177A59219E_6039_UN""","""C[N]1C=CC(=N1)CCOCC(NC(CCCC(C)C)C)=O""",21,"""87A152E70E3EDF25"""
+"""52F45CD036508F91_21AB38E7D36BC518_6039_UN""","""C[N]1C=CC(=N1)CCOCCN[S](=O)(=O)C2=CC=CC=C2""",21,"""87A152E70E3EDF25"""
+"""5A0FE1E6C32A6633_41E19DB1C26A1650_6039_UN""","""C[N]1C=CC(=N1)CCOCC(C2=C(C=C(C)C=C2C)C)=O""",21,"""87A152E70E3EDF25"""
+"""5DDFF20EC04F5567_4424B92902FC16B5_6039_UN""","""C[N]1C=CC(=N1)CCOCC2=COC(=N2)C3=CC=CC=C3""",21,"""87A152E70E3EDF25"""
+"""05C01DFAD94C880A_95F5A7614D35ABCB_6039_UN""","""C[N]1C=CC(=N1)CCOCC(NC2=CC(=NO2)C(C)C)=O""",21,"""87A152E70E3EDF25"""
+"""C15D29612B2A1FFC_04028B5F47692264_6039_UN""","""C[N]1C=CC(=N1)CCOCC2=CSC(=N2)N(CC)C(=O)C""",21,"""87A152E70E3EDF25"""
+"""C168B93EAC7C3C74_090668719E2C6D0B_6039_UN""","""C[N]1C=CC(=N1)CCOCCC34CC2CC(CC(C2)C3)C4""",21,"""87A152E70E3EDF25"""
+"""AF38E26E809D6B58_951C18EB6E4BCBE2_6039_UN""","""C[N]1C=CC(=N1)CCOCC2=NC=C(O2)C3=CC=CC=C3""",21,"""87A152E70E3EDF25"""
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+"""E0FC505238E21551_BFC49941E83C8654_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC(=N2)OCC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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+"""ADFBBEE4940256F1_5F1B27206AF05886_6039_UN""","""CC1=C(C=C(C=C1)OCC[N]2C=C(C(O)=O)C=N2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""5F8646BFFDE25204_2E66DBB9525905CB_6039_UN""","""CC1=C(C=C(C=C1)OCCCNC(C(F)(F)F)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""90F8A7FEBBA57B28_B8579F1E7A031F77_6039_UN""","""CC1=C(C=C(C=C1)OCCNC(=O)C2CCCC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""A2C14F6FF2110DA6_25930C27D38E6143_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC3=NSN=C23)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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+"""1B1FB4F5089AC29B_385882F0B11EAEE3_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC(=C2)COC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""BDCF752C6D6016FC_3ED1E0092D403A52_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC(=C2)C(O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""EC770850130DD4B6_16986C0E20B9723D_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)NC2CCSC2=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""3E204DD48F574755_0A5739563F36D158_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(C=C(F)C=C2)C#N)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""4D06EB7DC0753CE9_43E346AAFD652AEC_6039_UN""","""CC1=C(C=C(C=C1)OCCCCC[N]2C=CN=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""F682E14786D640B8_FC46C499BB94A485_6039_UN""","""CC1=C(C=C(C=C1)OCCCOC(NC(N)=O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""2568F70DF1564968_179D86D4FE52CD09_6039_UN""","""CC1=C(C=C(C=C1)OCCCC[N]2C=CN=C2C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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+"""FF732152EDA12D26_4FB1D7C0C7785AB7_6039_UN""","""CC1=C(C=C(C=C1)OCCC(N(C)CCC#N)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""CEFF8AD3FF1CC8B2_549BFA2C4CD39EDF_6039_UN""","""CC1=C(C=C(C=C1)OCC(N(CCCC)CC)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""0D1660F5DD691830_E77CBEF69779BD3D_6039_UN""","""CC1=C(C=C(C=C1)OCCC(=O)N2CCCCC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""B1901EB027C0AFFA_E5F52F8F784C90A6_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(OC)C=CC(=C2)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""1F50850638ED49BA_1D9C0DA65AB7CD4A_6039_UN""","""CC1=C(C=C(C=C1)OCCC(=O)N2CCOCC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""442AA6BE4E247B61_E8266291E0833BF8_6039_UN""","""CC1=C(C=C(C=C1)OCC3=CC2=C(C=CC=C2)O3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""9C9D5AADB9405A0B_9A7DFEFEAEF90952_6039_UN""","""CC1=C(C=C(C=C1)OCC(N(CC)CCC#N)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""C25D5D7958FB20FC_03A300AA14CC3116_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC(=CS2)C(F)(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""9482D303948816EC_EE2482BFCFEA7D92_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC=C(OCC)C=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""ACC1E6B0E716259D_4CD6E703DB156A0C_6039_UN""","""CC1=C(C=C(C=C1)OCCC2CC(CC(C)C2)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""DA70B22ADFB72DD7_B5A6C53C1AE1C13D_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=C(N=C(C)O2)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""87737123273DD945_9EB1164F40BCC9E4_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)NC2=NC=CN=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""82036401CC36C6DD_DF5CF0EE90C9EB7B_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)NC2=CN=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""EFD04992A32ACB03_8F0F98E372C7EA03_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC(=N2)N(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""5304A87DD580DB46_22DBB55F3B269C4F_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NN=C(C)[N]2C3CC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""3EE8B5281E523C14_B0CA0FB47FD22C56_6039_UN""","""CC1=C(C=C(C=C1)OCC3=CC2=C(C=CC=C2)S3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""62BECDFE13A21590_89945F784AC77613_6039_UN""","""CC1=C(C=C(C=C1)OCCN2CC3CCC(C2)O3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""1E889C6FA9F4345A_8A35E65A8937D6F7_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CSC(=N2)C(F)(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""1D9E2949033363E1_8569F8680E6533A3_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NOC(=N2)C(F)(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""F31673E973FCEECD_F391A4C1417964CF_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC(=N2)C(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""E72F0A90308BC604_9895F8E7EC5FFF6F_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC(=C2F)C#N)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""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"""
+"""4D2D2E3385895186_589AD1534381CB06_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)N(CC=C)CC=C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""F3FD1437D6C44832_9F91EC337032014A_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NN=N[N]2C(C)(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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+"""520A3396EE8BAFAF_472870C00F9DAC01_6039_UN""","""CC1=C(C=C(C=C1)OCCCCC[S](CC)(=O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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+"""C8B17A4B688402C9_0D198B9A72246AB9_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NN=C3[N]2CCCC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""2E0804880E42FA34_8A3E107C8693508F_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)C2CCCCCC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""E3EAA27ADDDB50AC_08F6ED3C412F3DE1_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NOC(=C2)C(C)(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""04B14DB0B754C599_FEE115D5B5A74ED4_6039_UN""","""CC1=C(C=C(C=C1)OCC(N2CCC(C)CC2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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+"""D7F2CBE30275E504_92901F1DFF722979_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC=N[N]2C(C)(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""48881C5E16531E5C_ACDC94428A4DE671_6039_UN""","""CC1=C(C=C(C=C1)OCC2N(C(C)C)CCCC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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+"""6FDB49F0111E26B0_4B401C1DBAC66CA8_6039_UN""","""CC1=C(C=C(C=C1)OCCCC2=CC(=NO2)CC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""6CC60EDA12C65D6C_5FCDCC0EF917048D_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=CN=CC(=C2)F)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""39C4E0C1771BDA7F_2B406C5D6005AFA2_6039_UN""","""CC1=C(C=C(C=C1)OCC(C(C(OC)=O)(C)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""02C5B34171068E2B_C4D7F0C55D73EF2C_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(C(OC)=O)C=NO2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""2CAE33D6B844DC03_EF4980BD2016E8CA_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NN=C3[N]2CCOC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""CCCE1815BF39A8B3_EF7CB822A82F5846_6039_UN""","""CC1=C(C=C(C=C1)OCC(OC)C2=CC=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""FC6523238A085490_6B5A8551073D9095_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=NC=CC(=C2)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""BE49A7C628CA00E2_CDBA78895B251FD6_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=C(COC)C=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""440381F1EF630D62_3A822EBAA151A699_6039_UN""","""CC1=C(C=C(C=C1)OCC2=N[NH]C(=N2)C(C)(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""A722E01BC83CB58D_7680ED98C6C331B2_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NOC(=N2)CCOC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""AA99B0B7443836B6_F7D930DE3F13F1FD_6039_UN""","""CC1=C(C=C(C=C1)OCC3=CC2=NON=C2C=C3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""494DB8382B71BD1A_FA061061B983571B_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=C(C)N=CC=C2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""C9BBDEB2F339BFCF_B064AACB71AFC552_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=N[N]2CC(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""D8B5023AC12A4FE0_995552C25AEE730B_6039_UN""","""CC1=C(C=C(C=C1)OCCSCC2=CC=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""D6041CC5834466B5_C55FDB17A9F50B87_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CSC(=C2)C(OC)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""77BB99F1492848B7_9E5B729861DF1E20_6039_UN""","""CC1=C(C=C(C=C1)OCC(CC(C)(C)C2CC2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""28303F04B13FE516_85CEBCF55D2BF082_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)C2CC[S](=O)(=O)C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""DA86DB172DC8BFB0_169449F2E97CE370_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)NCC2CCCO2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""1E84731E973E0BA9_160327A0069F28EB_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)N2CCCCCC2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""C15C6FDA0A3DB094_6E8C2CF8101837B9_6039_UN""","""CC1=C(C=C(C=C1)OCC(N2CCCC(C)C2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""3336B7DD2C25250F_DF39D8A8B2BE643F_6039_UN""","""CC1=C(C=C(C=C1)OCC(N2CCCCC2C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""6B3F4C987FC08377_55A06EB6722A9CEC_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=CC(=C2)C(C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""B041D63FFA6AA894_94C7FC7D855E099B_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(C(O)=O)C=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""BD159CF1E4E8A541_AF4BE53F57B16D3C_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC(=CO2)C(OC)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""07378E789149A7C7_4E4E04BDB1B93CE8_6039_UN""","""CC1=C(C=C(C=C1)OCC(NCCCCCC)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""CCA203E86E99DE0F_938AC13EF9E69F4C_6039_UN""","""CC1=C(C=C(C=C1)OCC(NCCCOCC)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""635CF0A064EBBB6E_3DC71ACF6638C661_6039_UN""","""CC1=C(C=C(C=C1)OCC[S](=O)C2=CC=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""B76AD1658C1B702D_5F51F125A40009BF_6039_UN""","""CC1=C(C=C(C=C1)OCC(NNC(C(C)C)=O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""A24E920F4322D260_ECF8036F892B86C6_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC=N[N]2CC(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""25364ED50C9B11ED_CCABAC47C81A8E91_6039_UN""","""CC1=C(C=C(C=C1)OCCCC2=C(C)C=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""25F11C78F6AC3B23_3E4940FCC8C057A7_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=C(F)C=NC=C2)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""1B3467A3B36A46A2_8A59E4EC429BAEE5_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC(=CO2)C(OC)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""9B09F8E855D3615B_A24E813934BE6A85_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NC(=CS2)C(OC)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""1304E731876DBFDC_8734BF3B727576B2_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC(=C(OC)C=C2)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""86240CDED7A98E64_69F4F99CE0388B64_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)N2CCNC(=O)C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""C5A4FD02FC46CC6C_634CCA8CFB0E12F9_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C([N](=O)=O)C=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""3E0EB3B1561FF0E7_95CA5BBDE9943F24_6039_UN""","""CC1=C(C=C(C=C1)OCC(=O)CC2=CC=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""7B19F53FFA03F00D_11909087262605CD_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(N=C(CCC)O2)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""9A9EFB85194B6EEE_D61097027763F50B_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC3=C(C=C2)COC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""B4EAEB38127A7225_057B3CCE434D90DE_6039_UN""","""CC1=C(C=C(C=C1)OCCCC2=CC=CC(=C2)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""DF8D9D6E5096AE3A_FA876455B26AB0C1_6039_UN""","""CC1=C(C=C(C=C1)OCC(C2=C(ON=C2C)C)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""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"""
+"""FD3D0823A3EAD696_B4150C1CB9395B32_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(C=CC(=C2)F)C#N)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""BBE59F4AFE09EB93_FBD247D8CF617FFD_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C(N(C)C)C=CC=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""1C65CB807FB2B06F_AB760DAFB87F7C72_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC=C(C(C)=O)C=C2)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""A4F338E045C860A7_83F9AC56F79F76B7_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CSC(=N2)C(C)(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""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"""
+"""86F7C9C5C01E71FE_543831EA6FAA9C07_6039_UN""","""CC1=C(C=C(C=C1)OCC2=NOC(=N2)C(C)(C)C)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""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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+"""571F3D06D1A41550_01F92264171025B9_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CSC(=N2)COCC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
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+"""11E58748EB350BB0_DD351BA810FF874A_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC3=C(C=C2)[NH]N=C3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""9493017F2445EE3F_82559969CD0EEB1F_6039_UN""","""CC1=C(C=C(C=C1)OCC23OCC(C)(CO2)CO3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""DB7A28EB415F6FA4_B1E9E73862BF1796_6039_UN""","""CC1=C(C=C(C=C1)OCC2=C([N](C)N=N2)C(F)F)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""958DCF0A7FA17E59_DC3DA01A8A805443_6039_UN""","""CC1=C(C=C(C=C1)OCC2=CC(=NC=C2)OCC)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""2716C1D29EF6CC21_0BA3CDBE657F968F_6039_DP""","""CC1=C(C=C(C=C1)OCC2=NC(=NO2)C3CNC3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""E3067E0D26896157_DC3DCA5EC0B71DC8_6039_UN""","""CC1=C(C=C(C=C1)OCC[S](CCC(O)=O)(=O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""87EE956A6E991748_0287BB7D6D8F9C2A_6039_DP""","""CC1=C(C=C(C=C1)OCC2=N[NH]C3=C2C=CC=C3)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""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"""
+"""87DC034B7439F7C5_6AC4C5B36F6E1C19_6039_UN""","""CC1=C(C=C(C=C1)OCC2=N[N](C)C=C2[N](=O)=O)C(=O)N""",21,"""9AD1142EEEAD50BE"""
+"""7B73629F0A091CC6_71624986C8A0059D_6039_DP""","""CC1=C(C=C(C=C1)OCC2=CC(=NO2)C3CNC3)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"""
+"""DB8DCEF2388BE488_1FA8882323D62F87_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC(OC(C)C)=O""",21,"""93233C30C095383F"""
+"""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"""
+"""84AFF93109691E25_0AE834A227595156_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3NC(OC3)(C)C""",21,"""93233C30C095383F"""
+"""6FAE15D2D14643CA_B46C5963FC414044_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC[S](CC)(=O)=O""",21,"""93233C30C095383F"""
+"""F92367130DDF6356_666C53BD8911BB3E_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCNC(=O)C3CC3""",21,"""93233C30C095383F"""
+"""FABFBF352218878B_09849A6A9B974548_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3CCOC3=O""",21,"""93233C30C095383F"""
+"""81C09F51FF24907F_CB9FF1A479EF566A_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3CCCCC3""",21,"""93233C30C095383F"""
+"""34690983AC63517B_AAE45749E030EEA7_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCC(OC)OC""",21,"""93233C30C095383F"""
+"""99C64EDD0C1BBB08_5E6ED1A737ED0F84_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)OC(O3)=O""",21,"""93233C30C095383F"""
+"""380A4A57A29ACF67_FC1F32314C21D2B4_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(N(C)C3CC3)=O""",21,"""93233C30C095383F"""
+"""A802645C75591ACA_577056339951C9FF_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCCN(CC)CC""",21,"""93233C30C095383F"""
+"""C9B23F54A6B9C0D7_E31E7AB5D5CEF8E6_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=C[N](C)N=C3""",21,"""93233C30C095383F"""
+"""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"""
+"""56F9619CDC9BCA92_5025EE29E13A92CE_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=CC(=C3)N""",21,"""93233C30C095383F"""
+"""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"""
+"""10CE276E818B48AF_FA527DFBA34CA079_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=CN=CC=C3""",21,"""93233C30C095383F"""
+"""6C14C8D15E4F6C0D_61F978FE09B4904B_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(OC)(OC)OC""",21,"""93233C30C095383F"""
+"""9D71401645518A2C_4FD81BD4A4889E83_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC(=O)NC3CC3""",21,"""93233C30C095383F"""
+"""2F674AD26C23F0BC_2E93227685F8F352_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)NCC3CC3""",21,"""93233C30C095383F"""
+"""DE105AD737C52920_517E39F60FA20CC9_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC(NC(N)=O)=O""",21,"""93233C30C095383F"""
+"""AF12670CC6FAB5B4_A1F8C8AAB8A36E1A_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC=C[N]3CC""",21,"""93233C30C095383F"""
+"""A0CCE23AA12F59D5_980803EB9EAD8C6D_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC[S](NC)(=O)=O""",21,"""93233C30C095383F"""
+"""D694DF10984DC3BA_5936961FC846856A_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=N[N](C(=C3)C)C""",21,"""93233C30C095383F"""
+"""9C978A576C1AA69D_2F6D02C4CF7660C2_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC(=C(S3)C)C""",21,"""93233C30C095383F"""
+"""E9072E11D219A86D_445BC16E94A5635B_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC=C(C)C=N3""",21,"""93233C30C095383F"""
+"""DB5C4C7A03942FF1_B9B2488D00478618_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC[S](C(C)C)(=O)=O""",21,"""93233C30C095383F"""
+"""9454B762224B2B77_D7D2250CF179FE50_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=CC(=N3)C""",21,"""93233C30C095383F"""
+"""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"""
+"""8030C49CFE0CDEA6_723B9375597FECA5_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCC3=CSC(=N3)C""",21,"""93233C30C095383F"""
+"""150DEF3907C6B29B_354942DFE630CF63_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)[N](N=C3)C""",21,"""93233C30C095383F"""
+"""685EC679F5EB6E00_6A4B638EC27389C6_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(NCC(F)F)=O""",21,"""93233C30C095383F"""
+"""6DEE94C3D60C1432_DAF70881ABCF2844_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NC=CC(=N3)C""",21,"""93233C30C095383F"""
+"""BF0CB964D012E1FA_0E96E6F550A5653C_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)N3CCCC3""",21,"""93233C30C095383F"""
+"""60D47D199A8B9E7F_85BAF2909AA00E78_6039_DP""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(NCC(O)=O)=O""",21,"""93233C30C095383F"""
+"""A1F809DA793F6D52_D645BF03BAD3E7E8_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(OCCCC)=O""",21,"""93233C30C095383F"""
+"""37CB57B9D5EA8FCB_40FA15A6170AAF3A_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CCOC(N(C)C)=O""",21,"""93233C30C095383F"""
+"""F18C56308F06091E_F315F2032EDCA7EC_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(=O)C3CCOC3""",21,"""93233C30C095383F"""
+"""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"""
+"""F1836C7D12BAFA0B_91AF62B87E2C54EB_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CN=CC(=C3)F""",21,"""93233C30C095383F"""
+"""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"""
+"""3FA4A428F2D1837B_D5A7FCAD7A325DE7_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(F)C=CC=C3""",21,"""93233C30C095383F"""
+"""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"""
+"""1CAD459E3F60AF7B_86E2B7577C451DAA_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=NNC(C=C3)=O""",21,"""93233C30C095383F"""
+"""290F4B2F4CD59581_B2793B02158A771A_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CC=NC(=N3)C""",21,"""93233C30C095383F"""
+"""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"""
+"""A2BF9DD5699A62E4_CDA6F5C8DA8115D6_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(CC(C)(C)C)=O""",21,"""93233C30C095383F"""
+"""185CE7061CB9A728_7043F4BBE7128FA9_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC(C(CC)(C)C)=O""",21,"""93233C30C095383F"""
+"""FB44634669CF6B56_2E21F7AB286A2E7B_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(C)N=CC=C3""",21,"""93233C30C095383F"""
+"""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"""
+"""45BD7A5B1429A6F8_AC442E51465396F3_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=C(SN=C3C)C""",21,"""93233C30C095383F"""
+"""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"""
+"""50DC2335C91D6BE9_ED176E32FCFE8CCF_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC3=CSN=C3OC""",21,"""93233C30C095383F"""
+"""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"""
+"""59441B9093E2297F_5724FBECE8ABBDDD_6039_UN""","""O(CC2=C1OC(OC1=CC=C2)(F)F)CC#CCOC(C)=O""",21,"""93233C30C095383F"""
+"""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"""
+"""3AD146965E69605D_6E481650C0DF2500_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(NC2=C(C=C(C)C=C2)F)=O""",21,"""ED5573F0D1B37AF9"""
+"""26F802B107DD85C0_B1AAF88E35443AA4_6039_UN""","""O(CC1CCC[S]1(=O)=O)CC(C2=CC=C(OCC)C=C2)=O""",21,"""ED5573F0D1B37AF9"""
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+"""1AE5B1266E8A631A_52429AE671E99348_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCCC3=NC2=C(C=CC=C2)[NH]3""",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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+"""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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+"""EC1A1126D4DDA749_C71C106C02D68FEE_6039_UN""","""O(CC1CCC[S]1(=O)=O)CCC2=CC=C(NC(C)=O)C=C2""",21,"""ED5573F0D1B37AF9"""
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+"""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"""
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+"""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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+"""51ACBC7CA53387B4_DCECD4CF8F8461E6_6039_UN""","""COC1=CC=C(C=C1)[C@@H]2C[C@H]2COCC3=C(N=C(C)O3)C""",21,"""647ECA867E27A281"""
+"""E3E47ABAF83FDBE7_400F13C552D910FA_6039_DP""","""COC1=CC=C(C=C1)[C@@H]2C[C@H]2COCCN3CCNCC3""",21,"""647ECA867E27A281"""
+"""1544443210B0017D_6A7A4C813684B8EC_6039_UN""","""COC1=CC=C(C=C1)[C@@H]2C[C@H]2COCCC3OCCCO3""",21,"""647ECA867E27A281"""
+"""929BC37EB946A516_64FC89C406ABE570_6039_UN""","""COC1=CC=C(C=C1)[C@@H]2C[C@H]2COCCCC(C)(C)C#N""",21,"""647ECA867E27A281"""
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+"""481211D8BC5446CF_20350E142A7A9AB3_6039_UN""","""COC1=CC=C(C=C1)[C@@H]2C[C@H]2COCCC[N]3N=CN=C3""",21,"""647ECA867E27A281"""
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+"""0494CA71EE0FE113_45190160CB45F018_6039_UN""","""COC1=CC=C(C=C1)[C@@H]2C[C@H]2COCCC(C(F)F)(F)F""",21,"""647ECA867E27A281"""
+"""60E002B43AF80471_B52FDC48C6C2A3A0_6039_UN""","""COC1=CC=C(C=C1)[C@@H]2C[C@H]2COCCC3=CC=C[N]3C""",21,"""647ECA867E27A281"""
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+"""E293DCD60B34D10F_7A013195A32F6BF5_6039_UN""","""COC2=C1N=CC(=CC1=CC=C2)OCCCC3CCCC3""",21,"""10A24D95C6D10DD2"""
+"""E452E56B2EC41522_DAD0B9E0F5D81240_6039_UN""","""COC2=C1N=CC(=CC1=CC=C2)OCCCOCCOC""",21,"""10A24D95C6D10DD2"""
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+"""A651C7D067183FC6_1ECE65BEAA869BA6_6039_UN""","""COC2=C1N=CC(=CC1=CC=C2)OCCC3=NN=C[N]3C""",21,"""10A24D95C6D10DD2"""
+"""42A0EEAEEF5257AD_824975DC5E51D85E_6039_UN""","""COC2=C1N=CC(=CC1=CC=C2)OCCCC(C(C)C)=O""",21,"""10A24D95C6D10DD2"""
+"""3CCA3F3C10E17CC3_E48D0D1C18C360CA_6039_UN""","""COC2=C1N=CC(=CC1=CC=C2)OCC[S](C(F)(F)F)=O""",21,"""10A24D95C6D10DD2"""
+"""C2FBAFCF2204761A_3AC776E75AAAB633_6039_UN""","""COC2=C1N=CC(=CC1=CC=C2)OCCOCCOCC""",21,"""10A24D95C6D10DD2"""
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+"""3BB44DAECEC45427_37E1445709AF3CCE_6039_UN""","""CC2(COCC(C1=C(C)[N](C(=C1)C)CC=C)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""C38B9A983DF43E9C_24C7B27905CAEC66_6039_UN""","""CC3(COCC1=C(C)OC(=N1)C2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""BC1A78882003A181_DFD01DD4B8F30BEB_6039_UN""","""CC3(COCC1=NC2=C([N]1C(F)F)C=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""725CCD373B8AA9C8_D88737B78785C5F2_6039_UN""","""CC3(COCC1=COC(=N1)C2=CC=C(C)C=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""2CB2BEED6D6C43F7_C29B1917AAE2EF7A_6039_UN""","""CC2(COCC(C1=CC=C(CC(OC)=O)S1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""11E120A360B656E3_09154F5656D1AC9F_6039_UN""","""CC3(COCC1=COC(=N1)C2=CC=C(F)C=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""820B24077795338C_AA86B4E076DCDB4A_6039_UN""","""CC2(COCC(NC1=C(C(=C(C)O1)C)C#N)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""7EDFC9C4D7A7EC1B_710DF9E1FFBB313F_6039_UN""","""CC2(COCCC(=O)NC1=C(C=CC=C1)C#N)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""1ED3246903890D3E_F2B5E9F1F2B927C7_6039_UN""","""CC2(COCCC(NC1=C(OC)C=CC=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""6B7F494144D75B2D_1E33B607D802CB59_6039_UN""","""CC2(COCCC(=O)NC1=CC(=CC=C1)C#N)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""93E44DD63309AB97_8AD37542739F6D9C_6039_UN""","""CC1(COCC(N(C)CC(=O)NC(C)(C)C)=O)CC1(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""2AE27C47DEC613D5_FC12475CEA343F3B_6039_UN""","""CC2(COCC(C1=CC=C([S](C)(=O)=O)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""065EE2A866969D90_CD5C4C1B11DF5279_6039_UN""","""CC2(COCC(N(CC)C1CC[S](=O)(=O)C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""34C8FA9950DC4D64_3739F27C702342C5_6039_UN""","""CC3(COCC2=NN=C(C1=C(C)OC(=C1)C)O2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""64369EA46E2AE656_7F4FC3E897207C25_6039_UN""","""CC2(COCC(C1=CC=C(CNC(C)=O)S1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""6D5AF6AF1AAF4BEE_F27CAC51AD237ACB_6039_UN""","""CC3(COCC2=NN=C(C1=C(F)C=CC=C1)O2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""B968D078935EB31B_07B1DCBAF9B78470_6039_UN""","""CC2(COCC1=C(C=C(C(=C1C)C(C)=O)C)C)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""72B346B757B7B7EF_6B338429B50091EF_6039_UN""","""CC2(COCC(=O)NCCSC1=CC=CC=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""32F7577E85C587A5_9BD01F4F91F5FB7A_6039_UN""","""CC2(COCC(N(CC)C1=CC=C(C=C1)F)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""93BA8A1EECAFE20E_EA9753B73F12CB5F_6039_UN""","""CC3(COCCC(=O)N1CCC2=C1C=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""F29BAA6373FC9980_C39E21DCA3D4B496_6039_UN""","""CC2(COCCC(NC1=C(C(N)=O)C=CS1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""C21820EDA3308025_2297B54BB2C9758D_6039_UN""","""CC2(COCC(C1=CC(=C(C(=C1C)C)C)C)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""6D21E5FDB041BE18_47CB0AC80566AED4_6039_UN""","""CC2(COCC(C1=CC=C(C(CC)C)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""A7B4FDA692D306DE_32C76472DF880527_6039_UN""","""CC3(COCC(C1=C(C)C2=C(S1)C=CC=C2)=O)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""E875E18A9679BA84_6E263990F2B4A504_6039_UN""","""CC3(COCC(=O)C1=CC2=C(C=C1)CCCC2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""D2AD71B389002A5E_4903FDCF18C8DC0D_6039_UN""","""CC2(COCC1=CC=C([S](C(F)F)(=O)=O)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""6A9510B857329A52_ED2B9C26E347C18D_6039_UN""","""CC2(COCC(N(C)CC1=C(C=CC=C1)C)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""31D3AE0CE6403BB2_B39E9C75AAD2A5B7_6039_UN""","""CC2(COCC(=O)N(CC#N)C1=CC=CC=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""959FC909D1892186_F55587DD5DA4C535_6039_UN""","""CC2(COCC1=CC=C(OCC(F)(F)F)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""2FEB10048ED8FD2D_9B5247B3126A4018_6039_UN""","""CC2(COCCSC1=CC=CC(=C1)C(F)(F)F)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""22E93D2C316D8F09_DE1E0412981E54B6_6039_UN""","""CC2(COCC(=O)NCC1=CC(=CC=C1)C#N)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""CE2F05C4B0EDF191_D45552BAF384863D_6039_UN""","""CC3(COCC1=CC(=NO1)C2=CC=C(F)C=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""E2DCCB0170CA7AD6_F59473002BF36500_6039_UN""","""CC2(COCC(N1CCCC(NC(C)=O)C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""D058743302FC43DC_51AB41317794F55D_6039_UN""","""CC2(COCC(N=C1C=CNN1CC(C)C)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""6AD3EAD5D34F495C_3EAA8758A8D5088B_6039_UN""","""CC1(COCC(N(CC(C)C)CC(F)(F)F)=O)CC1(F)F""",21,"""AF87CAC09B0D53C0"""
+"""9246296CB7256CA7_88E5BC12DC43325D_6039_UN""","""CC2(COCC1=CC=CC(=C1)OCC(F)(F)F)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""36D624E2572B27D1_C6B2E2DE307ED865_6039_UN""","""CC2(COCC(N1CCCC(C(F)(F)F)C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""BEA99CED7D60962A_D02B6B8DDD0240AF_6039_UN""","""CC2(COCC(N1CCC(C(NC)=O)CC1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""C88C7DF0DE83C55B_0826C0D730C7DEA3_6039_UN""","""CC3(COCC1=NC2=C(N(C)C1=O)C=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""9749765672C819A6_9DE89AEC803BF7D3_6039_UN""","""CC2(COCC(C1=CC=C(CC(C)C)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""FD19F00A4DC15253_E8B52E6CD04373EE_6039_UN""","""CC2(COCC(C1=CC=C([S](N)(=O)=O)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""B5D6F3E9648BB4FA_29055798958801E0_6039_UN""","""CC2(COCC(NC1=C(C(O)=O)C=CC=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""905B099637F4D67A_9D1536D04C94EF9E_6039_UN""","""CC3(COCC(=O)N(CC1=CC=CS1)C2CC2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""EAAAD25B25854499_D75AD3C8B856A169_6039_UN""","""CC3(COCC2=C([N](=O)=O)[N]1C=CC=CC1=N2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""E37301EBEF122315_5E53656A035DE6E2_6039_UN""","""CC3(COCC2=NC1=C(C)C=CC=C1C(N2)=O)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""92392A7263C70665_1590AA81056AF30B_6039_UN""","""CC2(COCC(=O)NC1(CCCCCC1)C#N)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""0D195B8FEE682276_CCCBD88696165490_6039_UN""","""CC3(COCC(C1=C(C)C2=C(O1)C=CC=C2)=O)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""56325FAB4EDE94FB_EF7AEA59B0EE2B63_6039_UN""","""CC1(COCCC[Si](OCC)(OCC)OCC)CC1(F)F""",21,"""AF87CAC09B0D53C0"""
+"""186E0A26A59A50FF_80AEFDEF80336A33_6039_UN""","""CC3(COCC(=O)N1CCCC2CCCCC12)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""261A728B093AB927_6C5DF06544A9610B_6039_UN""","""CC3(COCC1=NC(=NO1)C2=CC=CC(=C2)C)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""E03476E0307D1B5E_C1C7978BC93AB523_6039_UN""","""CC2(COCCC(NC1=CC=CC(=C1)OC)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""39137B43C393B8F2_E761D5A5E3C51DDE_6039_UN""","""CC3(COCCN2C(=O)NC1(CCCC1)C2=O)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""31C3826EB02FD684_D5D7AA173A856758_6039_UN""","""CC3(COCC1=NC(=NO1)CC2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""794C9424C543C02B_F1E98AEBD859C9DF_6039_UN""","""CC2(COCC(=O)NCC1=CC=C(C=C1)C#N)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""3468A841F216E6D9_727CE9BAAC6DBC5C_6039_UN""","""CC2(COCC(C1=CC=C(NC(C)=O)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""183F77CF1E0CDD89_FE6AFCA730B3B653_6039_UN""","""CC3(COCC2=NC=C(C1=C(F)C=CC=C1)O2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""A891410DEAABB0A4_921D8249A3AFACA6_6039_UN""","""CC2(COCC1=CC=C(C(OC(C)C)=O)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""199D62B97438314F_C405F64E76B5BC66_6039_UN""","""CC2(COCC1=CSC(=N1)C(OCC(C)C)C)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""1AE0FE79BCC7A0D8_3A1CF580C384FA80_6039_UN""","""CC2(COCC1=C(C=C(C(OC)=O)C=C1)OC)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""74FC741202225866_773A53ADD3EF29B3_6039_UN""","""CC2(COCCOC1=CC=CC(=C1)C(C)(C)C)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""8728B263C6C21112_97753FF937D986FA_6039_UN""","""CC2(COCC(=O)C[S](=O)(=O)C1=CC=CC=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""A5B47FD66243C845_05275362BC433163_6039_UN""","""CC3(COCC2=N[N](C1=CC=C(F)C=C1)C=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""0320E109423E26E5_0712959DAA04D453_6039_UN""","""CC3(COCC2=NN=C(C1=C(C)C=CC=C1)O2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""36EB43EFD83C0F0E_5799A0D5E6A8C97A_6039_UN""","""CC3(COCC2=NC=C(C1=CC=C(C)C=C1)O2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""06372650FC4E83E4_825DE8004080126B_6039_UN""","""CC2(COCCC1=CC=C(OC(F)(F)F)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""EA5B943865F95ECF_DE489DBBC380569D_6039_UN""","""CC2(COCCCN1CCC(C(OC)=O)CC1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""FC1AEE44E088D448_5CF0E6CDAA75516C_6039_UN""","""CC2(COCC1=CC(=C(C(OC)=O)C=C1)OC)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""B83A45CDD47F6EE8_44DB37D29DF1551D_6039_UN""","""CC3(COCCN1C(=O)COC2=C1C=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""DF6FEA16EF30AC05_0CD66552803CB00F_6039_UN""","""CC2(COCCC[S](C1=CC=C(C)C=C1)(=O)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""392CEB1D26AC7EE7_FFD16BFB26AE5234_6039_UN""","""CC2(COCC1=C(C(O)=O)C=C(C=C1)[N](=O)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""F35F5648DE7CD42A_E1176AC4CA438237_6039_UN""","""CC2(COCC(C1=CC=CC(=C1)C(OC)=O)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""62112EBC8EFD6B27_682A5319847FA54D_6039_UN""","""CC2(COCC(NC1=CC=C(C(O)=O)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""7D4E5AFB84877F27_58A690C3DED1496B_6039_UN""","""CC2(COCC1=CC=CC(=C1C#N)C(OC)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""848FFFEDEB5D8288_86CDB0CFF732203C_6039_UN""","""CC2(COCC(NC1=CC=C(C(C)C)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""3D83AC573F790912_C666BDF9C3C1853A_6039_UN""","""CC2(COCC(NC1=C(OC)C=CC(=C1)C)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""A332BA5BF0377C4C_E4D2B5FFDF15CA2C_6039_UN""","""CC2(COCC(C1=CC=C(C(OC)=O)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""BC79616DEC844DC5_DC89023A686D7DA3_6039_UN""","""CC3(COCC2ON=C(C1=CC=C(F)C=C1)C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""2A602427DA5BCC5E_BC1C0DA5693812EE_6039_UN""","""CC3(COCC1=NC(=NO1)C2=C(F)C=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""D2C1F1100FC81FFD_0AD4E837D295B999_6039_UN""","""CC2(COCC(N(C)CC1=CC=C(C=C1)F)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""2B548FAF9DC43801_8279B7F333CA4CB0_6039_UN""","""CC2(COCCOC1=CC=C([S](Cl)(=O)=O)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""E8B11E8A2C1F5A1E_B244F83D5BC03F29_6039_UN""","""CC2(COCC1=C(OCC)C=CC(=C1)[N](=O)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""55F49410B5646A3D_7E8E8627FB29A173_6039_UN""","""CC2(COCC(N(CC)C1=C(C=CC=C1)C)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""620B464AFDE1CEE9_4A87EBAF42501A37_6039_UN""","""CC3(COCC1=COC(=N1)C2=CC=CC(=C2)F)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""62493A115C34E328_EF6985A740C95DD3_6039_UN""","""CC2(COCC(NC1=NC(=CC(=O)N1)OC)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""66FC8D40FE9570DE_CB2C7F48F14074FD_6039_UN""","""CC2(COCC(=O)NCCCC1CCCCC1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""E4BE23213EF22EBC_A2D779D4BEA8CFB6_6039_UN""","""CC1(COCC(NCCCN(C)[S](=O)(=O)C)=O)CC1(F)F""",21,"""AF87CAC09B0D53C0"""
+"""6ABF54A974D92DE6_FBE349A3B120E692_6039_UN""","""CC2(COCC1=C(C=C(C(C)C)C=C1)C(C)C)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""6BAA442F749DE84B_5B6B0281C8C335F6_6039_UN""","""CC3(COCC2=NC=C(C1=CC=CC(=C1)F)O2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""1AD149E2B5AA129E_8995066B36D29CB4_6039_UN""","""CC2(COCC1=CC=CC(=C1)C(C(F)(F)F)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""4E005DC6C85FA956_274976200EE44E49_6039_UN""","""CC3(COCC1=CN=C(C=C1)C2=NC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""0CC2DA4BE7ECD36A_3F2ECB1B7D47C9B3_6039_UN""","""CC3(COCCC2SC1=C(C=CC=C1)NC2=O)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""BA7AE83A3AA5B2F9_C3484241C2250460_6039_UN""","""CC3(COCC2CN(C1CCCCC1)C(=O)O2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""62684DEC447A8AF6_60C9388F3F580040_6039_UN""","""CC2(COCC1=NN=C(OCC(F)(F)F)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""C19EB523533AC6F3_0E5DEE357152335B_6039_UN""","""CC2(COCC1=C(C=C(C(O)=O)C=C1)[N](=O)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""BF3A1F690F7668E7_B33E5D38E9365CF5_6039_UN""","""CC3(COCC2=NC1=C(C=CC(=C1)C(O)=O)[NH]2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""E680EA6B3693A10F_EFA975EC3F1CF535_6039_UN""","""CC3(COCC1=CN=C(N=C1)C2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""673519627D48BD08_0EC963AAB9CCA7E0_6039_UN""","""CC3(COCC2=NN=C(C1(OC)CCOC1)O2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""CFA9FA3E779DAFAD_F680E9FF530FD49D_6039_UN""","""CC3(COCCC2=CC1=C(OC(F)(F)O1)C=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""FD9930BBE710EF24_7565948E5696F926_6039_UN""","""CC3(COCC(C1=C[NH]C2=C1C=C(F)C=C2)=O)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""8B8B86B5560D3F10_D7BDFBBB827A9443_6039_UN""","""CC2(COCC1=C(C(OC)=O)C=CC=C1OC)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""4B3CACEBB9166ADA_B6B21FE2DAB696C6_6039_UN""","""CC2(COCC(C1=C(C=C([N](=O)=O)C=C1)F)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""50DB0E1EE52A1185_8AA074A379E6A2DD_6039_UN""","""CC3(COCC2=C1C=CC=CC1=C(OC)N=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""6316B470AEFF2A02_38922DE1EAB28283_6039_UN""","""CC3(COCC1=COC(=N1)C2=C(F)C=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""7DB7CEBBCF05C0F8_8DAE32DE04700B61_6039_UN""","""CC2(COCC(C1CCCC(C(F)(F)F)C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""CCFD6EAD7751A477_D9413DFB07088E2B_6039_UN""","""CC2(COCC(C1=C(C)[NH]C(=C1)C(OC)=O)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""301EA5D9F7786278_0E240DBF1DEB1D99_6039_UN""","""CC3(COCCC1=CC=CC2=C1OC(F)(F)O2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""DD08F0458DEB936B_C53580468F4B51CD_6039_UN""","""CC2(COCC1=C(C(OCC)=O)C(=CC=N1)C)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""0646968990B6C7FD_708B1275A6C27F5F_6039_UN""","""CC2(COCCCOC1=CC=C([N](=O)=O)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""BD397ADC2207A817_C24FBB299AC5C77A_6039_UN""","""CC3(COCC1=C(C)C=CC2=C1C=CC(=C2)C)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""26FBF8BB84EA906D_F89FDA1A6ACA3F28_6039_UN""","""CC3(COCC1=NC2=C(O1)CC(C)(C)CC2=O)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""234F9EAC2C534548_D383F432779E7073_6039_UN""","""CC3(COCC1=C(C)N=C(O1)C2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""C4AD99D3D4219B8E_5100CB571AF7B73C_6039_UN""","""CC2(COCC(C1=C(C(=CC(=C1C)C)C)C)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""D9BA4B94FB3C1A28_A3E050CB83BE40B0_6039_UN""","""CC3(COCC1=NOC(=N1)CC2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""47083B5481D2C104_366B7B7A4EC5CB8E_6039_UN""","""CC2(COCC(C1(NC(C(F)(F)F)=O)CC1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""396CA3E36F28EE7C_D8757B3A2236BCD5_6039_UN""","""CC2(COCC(C(C1=C(C)C=CC=C1)=O)(F)F)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""18956EEAFD0A5695_8DD749F11C7D31F0_6039_UN""","""CC3(COCC2=C1C=CC=CC1=C(C=C2)C#N)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""2CEA1A708A80FF55_8CC85D7CFC1CBBDE_6039_UN""","""CC2(COCCC1=C(OC(F)(F)F)C=CC=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""2F3BEE2A8696F4DA_7780D992406E3859_6039_UN""","""CC4(COCC2=CC(=C1OCOC1=C2)C3CC3)CC4(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""C52931A6FD4C58E0_0BBEBCB0297D4B0C_6039_UN""","""CC2(COCC1=C(C=CC(=C1)C(OCC)=O)F)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""D3CF601E87B04811_A544A61DF5D6C09D_6039_UN""","""CC3(COCC2=N[N]1CCCC1=C2C(OC)=O)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""910D4E10F4E6944A_A0595D97A55B2A53_6039_UN""","""CC3(COCC1=NOC(=C1)CC2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""978B8CF3BF25C870_B5D5653619D477A8_6039_UN""","""CC3(COCC1=COC(=N1)OC2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""EE73380DDCF9463C_B77E6F49F1E3522F_6039_UN""","""CC3(COCC1=CN=C(N=C1)C2=CN=CN=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""97279E563F5B563C_1C51C27522DB3121_6039_UN""","""CC2(COCC1=CC(=C(C=C1)C#N)C(OC)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""E3F99FF7EC4E478D_AB2770104A46BC12_6039_UN""","""CC3(COCC(=O)N(C1CC1)C2=CCCCC2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""E5D8A0499E65407B_62AFAB48ADB9B7BF_6039_UN""","""CC3(COCC2CCC1(CCCCCCC1)O2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""017A19FF54CFF1FA_7B87020E6A0A6A1B_6039_UN""","""CC3(COCC1=N[N](C=C1)CC2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""C770E8664CDFE219_A0B5A6F2E77D8E70_6039_UN""","""CC3(COCC1=COC(=N1)CC2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""16616794D4F726C2_A9156DF3A115E220_6039_UN""","""CC2(COCC1=CC=CC(=C1)OCC(OC)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""C209D29F8FF4849D_408194B11F16E00C_6039_UN""","""CC2(COCC1=CC=CC(=C1)[S](CCC)(=N)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""1BF666D6BE81AA12_F9CFE39C0158DECF_6039_UN""","""CC2(COCC1=C(C(OCC)=O)C=NC(=N1)C)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""527DF09110BEC0A0_87D9A7C09F125790_6039_UN""","""CC3(COCC1=N[NH]C(=C1C)C2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""034D0669C6917463_315191C8474B7E2F_6039_UN""","""CC2(COCC(C1=C(C)[N](C(=C1)C)CC#C)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""7D32730C32164567_D589AE76536FE260_6039_UN""","""CC3(COCC1(O)CSC(=N1)C2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""7A83F9C634A0F8DF_6277665B4409DDBD_6039_UN""","""CC2(COCC1=CC=C(CCC(OC)=O)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""F0936447B3367E40_3F892F581DBCC5C7_6039_UN""","""CC2(COCC(N(C(C)C)C1=CC=CC=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""B182C4A1FDAA6529_299A070BCE58C0CC_6039_UN""","""CC1(COCCOCCO[Si](C(C)(C)C)(C)C)CC1(F)F""",21,"""AF87CAC09B0D53C0"""
+"""ED2AC29A9F54D5D6_7C04AD25449EABD9_6039_UN""","""CC2(COCC1=C(C=CC(=C1)OC)[S](=O)(=O)N)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""BDEA90ACD9EF07C2_F197215B95709C10_6039_UN""","""CC3(COCC2=N[N](C1=CC=C(C)C=C1)C=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""85A501B1DD801ED8_2D6696F0DAFFC7D6_6039_UN""","""CC2(COCC1=C(C=CC(=C1)OC)[S](=O)(=O)F)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""EEB96AF8926E20A8_9EC2AF69849D0B93_6039_UN""","""CC3(COCC1=C(C)N=C(S1)C2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""3A85C50E8350A3A4_9ED1F5366F06BEA4_6039_UN""","""CC2(COCC1=C(C=CC(=C1)OC)[S](=O)(=O)Cl)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""DD7741585E250F6C_B35EBC1BFC5DE513_6039_UN""","""CC2(COCC1=C(F)C=C(C=C1F)C(F)(F)F)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""12B260074B65373C_FF07FD0B3F06BB42_6039_UN""","""CC2(COCC1=CC=CC(=C1[N](=O)=O)C(O)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""2CB60D31FA5AA79E_C3271E8229F32CE1_6039_UN""","""CC3(COCC1=NC2=C([N]1CC)C=CC(=C2)F)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""29A88AAD5E7675E7_C7308CCE3C5C1A4E_6039_UN""","""CC3(COCC1=NOC(=N1)C2=CC=CC(=C2)F)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""32D84A23D02E374F_59388AA95A504809_6039_UN""","""CC3(COCC1=NOC(=N1)C2=C(F)C=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""359A412F4D21CC87_F8A8BF2B849F3416_6039_UN""","""CC2(COCC([C@@H]1CC[C@H](C(F)(F)F)CC1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""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"""
+"""4EDC564CCC23AD14_595FE46C389BD454_6039_UN""","""CC3(COCCCC1=CC2=C(C=C1)C=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""9E5A9E1DB3EE0F30_CAB3E340270D7976_6039_UN""","""CC3(COCC2=NC1=C(C=CC=C1)C(N2C)=O)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""8C6EF62557C4B891_09C4908B7B56C481_6039_UN""","""CC2(COCC(NCC1=CC(=C(C)C=C1)F)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""BACB7511A2A285F0_CEDB5CD554F47917_6039_UN""","""CC2(COCCC(NC(C)C1=CC=CC=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
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+"""34EA6B09BA1A243D_AA99A915FB8F8AC2_6039_UN""","""CC2(COCC(NC1=NN=C(CCCC)S1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""28E3031D4E2550F5_F64557CDE0F5A940_6039_UN""","""CC2(COCC(=O)NCC#CC1=CC=CC=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""216E2DCEADE77D4C_390A1E0913EE0799_6039_UN""","""CC3(COCC1=NOC(=N1)C2=CN=CC(=C2)C)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""8F6279F9D1ECA94A_2FC27650C66D9ECD_6039_UN""","""CC2(COCC(C1=C(OC(F)F)C=CC=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""D62B1F7CEF7797E2_A1ED4A267485849F_6039_UN""","""CC2(COCC1=C(OCC(F)(F)F)C=CC=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""73C24B7CF5C37DF0_9D2BBD0BAE8D5DF4_6039_UN""","""CC2(COCC(N1CCC(C(OC)=O)CC1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""66F0CE7A7025A609_0EC4525FDB87CC7E_6039_UN""","""CC2(COCC1=C(OC(F)F)C=C(C=C1)C#N)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""0050DB326E4563B3_624A44CFA4FB8B45_6039_UN""","""CC3(COCC1=CN=C[N]1CC2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""F180453137002F67_0CC422008D658C42_6039_UN""","""CC3(COCC1=N[N](C(=C1)C)C2=CC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""848A83E9E3F9224F_A7C6D37D5B953C32_6039_UN""","""CC3(COCC1=CSC(=N1)C2=CC=C(C)C=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""20D3D1C63773BB17_C5880FA7D28C39BD_6039_UN""","""CC2(COCC(C1=CN=C(C(F)(F)F)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""1312E1E7EBF1A3D8_F50096018E3FFD5D_6039_UN""","""CC2(COCCOC1=CC=C([S](C)(=O)=O)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""423EE93E40505EF5_B0BE42A3566CF72D_6039_UN""","""CC2(COCC1=C(C(F)(F)F)C=C(C=C1)C#N)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""DFFB15094D0BA78C_02B7FCF7ECCC4C88_6039_UN""","""CC2(COCC(N=C1C=CNN1CCCC)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""4A779AAD6120E49A_246CB25D2BBE8F5B_6039_UN""","""CC2(COCC(NCC1=CC(=CC(=C1)F)F)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""41CB588475E359B4_3352EFADF9894103_6039_UN""","""CC2(COCC(N(C(C)C1=CC=CC=C1)C)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""D7A7D937451686A9_CE38AE16E31704E9_6039_UN""","""CC2(COCCOC1=C(C(F)(F)F)C=CC=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""67DE893092F5AACF_5BA366C93281F2C3_6039_UN""","""CC2(COCC(C1=CC=CC(=C1)[S](C)(=O)=O)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""A1ED348CA8337273_D7371A9CDBA5D1BF_6039_UN""","""CC3(COCC1=CSC(=N1)CC2=NC=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""F84D8049D30C8F2E_6110EDA015F24F05_6039_UN""","""CC2(COCC1=CC=C([S](C(C)C)(=O)=O)C=C1)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""A063F7C3CD513839_B3260A0613BCB0CC_6039_UN""","""CC2(COCC(C1=CN=C(OC(F)F)C=C1)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""538C192FDF81D0E6_12F0BAACD71E291E_6039_UN""","""CC3(COCC(=O)C1CCOC2=C1C=CC=C2)CC3(F)F""",21,"""AF87CAC09B0D53C0"""
+"""07A7308950713252_E5CC8FBC8DA4318C_6039_UN""","""CC2(COCC(N[C@H](C)C1=CC=C(C=C1)F)=O)CC2(F)F""",21,"""AF87CAC09B0D53C0"""
+"""F45E7690A254CEAC_6B818BEA9E9B8542_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(C(N)=O)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""CE8B257C02D471EB_D6EAAB0FA203951E_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(F)C=CC(=C2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""E1E69F4C7A84ACA4_E179089E5608D569_6039_UN""","""CC3=NC1=C(CCCC1OCC(N2C(C=C(C)O2)=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""3523A683175CA279_08C98FEC45426D4F_6039_UN""","""CC3=NC1=C(CCCC1OCC(NC2=CC(=NO2)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""000D9D17C8C58FC0_CFF3F37E995F2384_6039_UN""","""CC3=NC1=C(CCCC1OCC(NC2=NN=C(C)S2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""7C4EFCE3EDB1B789_9A15C46740D91EA7_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(OCC)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1A68906896D17B03_6DE917C59A03ED89_6039_UN""","""CC2=NC1=C(CCCC1OCCCCCCCCCC)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""AA45B38D42E400C4_D582DED35E1715BA_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=CC=C(F)C=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F8903A46CD7C427F_4F87DAB8CCFEF53A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(OC)C=CC(=C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6D1C4909A46C097D_1825A62B5030A208_6039_UN""","""CC2=NC1=C(CCCC1OCC(=O)NC(=O)NCC=C)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""D4CE4AEE684D4E70_200644A88F407051_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=CC=C(C)C=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""21AF2A6499F1B3FE_94C2FDD6E5C39307_6039_UN""","""CC3=NC1=C(CCCC1OCC(NC2=NOC(=C2)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""D29B575EA434714B_48293A27DDDAE617_6039_UN""","""CC3=NC1=C(CCCC1OCCC(=O)NC2CCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DB84370A8A5188FB_C7BE30F7CD5B1F72_6039_UN""","""CC2=NC1=C(CCCC1OCC(N(CCC)CCC)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""D6DCA8E39C314AFC_A9429675F1DE4AB3_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(C(O)=O)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""E3385560A9A50F51_4B93D06FA28CDE31_6039_UN""","""CC2=NC1=C(CCCC1OCC(N(C(C)C)C(C)C)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""5C4956871D3F292D_7A96FB5F8929E36D_6039_UN""","""CC4=NC1=C(CCCC1OCC2=C[N]3C(=N2)C=CC=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""BF0161A06A1F0A5C_694691C59E42BFFF_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C(C)[NH]C(=C2)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""9284AF71547CA765_2F52E90F0F2DF23C_6039_UN""","""CC3=NC1=C(CCCC1OCCSC2=CC=C(C)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8F6C0685DE3F1C89_5A598D3FF665571B_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC(=O)NC2CC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1B5F3678E8B6F948_FC0AE6DDC2048814_6039_UN""","""CC4=NC1=C(CCCC1OCC3=NC2=C(C=CC=C2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""0FD567B340890228_94E608894318ED0A_6039_UN""","""CC2=NC1=C(CCCC1OCC[S](CCC(N)=O)(=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""323DB449C420F605_E86B402ECBF5148D_6039_UN""","""CC3=NC1=C(CCCC1OCCSC2=CC=C(F)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""637E93F7ED29989C_A9E3826DB4E30636_6039_UN""","""CC2=NC1=C(CCCC1OCCCC(N(CC)CC)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""C724EA365392B082_1D0F723BD610F466_6039_UN""","""CC2=NC1=C(CCCC1OCCCCCC(OCC)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""73C2DC339C07873B_64290968A75DEF84_6039_UN""","""CC3=NC1=C(CCCC1OCC(N2CC(C)OCC2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""9F20D499947BC036_2D4698D2520F01E7_6039_UN""","""CC3=NC1=C(CCCC1OCC(NC2=NC(=CS2)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""330F761A52C4FFF8_396516B8975BE399_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(F)C=C(C=C2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""13DA663C47685FB6_699401A96082CF54_6039_UN""","""CC4=NC1=C(CCCC1OCC3=NC2=C(C=CC=C2)[NH]3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""6800BCC87F1E0FAD_C6DCEE5124657DF4_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=NO2)CC(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""19D5518D4EA8EE6A_87DAF146B284F050_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C=C(C)C=C2C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6446EF82A1F3BA6C_EDF9656B984F2695_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=NO2)CCCC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""090EE35F95CD646C_BA2E427A4A442142_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(OC)=O)C=CO2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""EF9E8DFA29A42DEA_26AADACAF4A97808_6039_UN""","""CC2=NC1=C(CCCC1OCC(N(C)C(C)(C)C#N)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""DC8B760E8236C8EF_1B8664EB099E18A9_6039_UN""","""CC2=NC1=C(CCCC1OCC(NCCC(OC)=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""0EA7FC81A481F61E_A8C34FA6D021C609_6039_UN""","""CC4=NC1=C(CCCC1OCC3COC2(CCCC2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""6B3B83E00361025E_75A1E415D5C052C5_6039_UN""","""CC3=NC1=C(CCCC1OCCCOC2CCCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""D8DF79F1E3C7DC5F_4AF12060FFC5031D_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NN=C(C(C)(C)C)O2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""E84A34BD9BEEB048_85FA7D2E872D94E4_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(OC)=O)OC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A85598AC75434A6D_1DEE05461E775614_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC=C(C(C)(C)C)O2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8A304BDA7DE099A2_C669E6A67BA3486B_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=CC=CC(=C2)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""348F033470E4F183_13B3777C7AD7414C_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CSC(=N2)CCCC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""561EA7A5749A2E04_85FEC2564E5145D7_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NCC2CCOC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""09D4E98B755B2DA6_42C5D83470B4859D_6039_UN""","""CC3=NC1=C(CCCC1OCC(N(C)C2=NC=CS2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""B753372D8948A340_3CD511C670D692A3_6039_UN""","""CC2=NC1=C(CCCC1OCC(NCCC(C)(C)C)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""25A7A1B1F3937018_3E69A5FCFD069854_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(N(C)C)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F0920E1362322CB9_C1AF04CB22F5265A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NOC(=N2)CCCC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""910FADC6F14802E6_4FC44D1819C1268D_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=NO2)C(OC)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DFCE4FB7210BA2EF_2E847B6C16C4ED98_6039_UN""","""CC3=NC1=C(CCCC1OCC[N]2C=C([N](=O)=O)C=N2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F959A95B816216B3_46589BEF2AB44CEF_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=NO2)CCOC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""262DBF7D64D8F2CE_36E5AB3ECC547C6A_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2CCOCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""EFD84E106AEED0C0_C4F6387912DC9F50_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC3=C(C=C2)OCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""0CED11BE23D9E429_4CD4D06010030C1C_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NOC3=C2CCCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""C122BD855341714B_5E921E8E43AB5BC0_6039_UN""","""CC2=NC1=C(CCCC1OCCC(NCC(OC)=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""F84A541AB760CA43_1403D3700F75EF72_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(OC)=O)SC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""530D2692072A1489_7459E1FFB2605BF8_6039_UN""","""CC3=NC1=C(CCCC1OCC[N]2N=C([N](=O)=O)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2C08CCBD37D0F680_A32792802FC0D0B6_6039_UN""","""CC3=NC1=C(CCCC1OCCCCC[N]2N=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""16175B036CA97F08_1EBD39FF8D48433C_6039_UN""","""CC2=NC1=C(CCCC1OCC(C(OC)=O)NC(=O)C)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""A36B6499B2B1FBC1_CBFBD5D5D394C5AC_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NNC(=O)C2CC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A4BBE4CA1E42F4B1_FED126419A2B8964_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C[N](N=C2C)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""CC9B064FB2D528FD_58FECE91B71C7097_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2=CC=NC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1BA2827F9083F807_7EFD77A01AB13D61_6039_UN""","""CC3=NC1=C(CCCC1OCCC2=CC=C(CC)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A5D4964730DEB5F8_309ED4A36F071AFC_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC3=C(C=C2)CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""B76B6633D20F6FD0_46DE81F496FB0571_6039_UN""","""CC3=NC1=C(CCCC1OCCOCC2CCCCO2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""841DFB4C85875C0E_602696A805CCDC68_6039_UN""","""CC3=NC1=C(CCCC1OCC2OCCN(C(C)C)C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""AC549D9B9255953B_7D6BFCA7A7871538_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C[N](C)N=C2[N](=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DF2786EDC815345D_436A74DAF76E2AB4_6039_UN""","""CC3=NC1=C(CCCC1OCCCOC2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2A0159861A3CD53B_DD8AFB867659F4C7_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2)N(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""06FAC8DFE2804B58_CC408F36A9A36E79_6039_UN""","""CC3=NC1=C(CCCC1OCCOC2CCCCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""85FEB791E2E6BF87_B616235D724851AA_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(N=C[N]2C)[N](=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""7475C809EADE39B7_DF1A8D116C0BCFD4_6039_UN""","""CC4=NC1=C(CCCC1OCC3=NC2=C(C=CC=C2)S3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""D916BCC8EB3363D5_8184C5FD2E9D0E0A_6039_UN""","""CC3=NC1=C(CCCC1OCCN(C)C2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1E0AE09A7FB93F97_FCE05FF0E67328A5_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=N2)OCC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2D4F099D18988BEB_C85F39791C92FD92_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=NO2)C(OC)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2E129682C884BE47_C5A8A9FB310F5AD5_6039_UN""","""CC2=NC1=C(CCCC1OCC[P](OCC)(=O)OCC)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""7B6A7BC128B5F929_E20B2A719C1530C1_6039_UN""","""CC3=NC1=C(CCCC1OCC2ON=C(C(OC)=O)C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F5B45348F1973301_90DDA5BF9D25A8AF_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=CS2)C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2DBA566C13E07135_10A522429F88216F_6039_UN""","""CC4=NC1=C(CCCC1OCC3=NC2=C(N=CC=C2)[NH]3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""8A45B2A7DBA678D1_1C3FE19164BFF677_6039_UN""","""CC3=NC1=C(CCCC1OCC[N]2C=C(C(O)=O)C=N2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""01EF38370409E706_6D421D085C16AB3A_6039_UN""","""CC2=NC1=C(CCCC1OCCCNC(C(F)(F)F)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""13DBB21023D6C0C3_FB7359AF744CB186_6039_UN""","""CC3=NC1=C(CCCC1OCCNC(=O)C2CCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""5285789D72EEB2B3_66B7CA96DDC1CFB2_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC=CC3=NSN=C23)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""66167216FE6BC115_F69762AF5697B7C4_6039_UN""","""CC3=NC1=C(CCCC1OCCC2=CC(=C(F)C=C2)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DB5CD6B8BF26C012_D9F38FD7DACF7FC9_6039_UN""","""CC3=NC1=C(CCCC1OCC#CC2=CC=C(F)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""4E17E5717CB5D50F_7B7C4441BF510012_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2)COC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8DDAD7E1A4C7AEAB_7DF526B8230F94A3_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2)C(O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""13DAECC102802C68_55BCAABF2EF6DCCC_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2CCSC2=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DA56AF1B2BCAD98C_4973FFE731797FA9_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C=C(F)C=C2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""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"""
+"""1F78F2D426F776E4_54B94065F01D63F8_6039_UN""","""CC3=NC1=C(CCCC1OCCCC[N]2C=CN=C2C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""5B514FB64A40AF3A_658B450450289BDB_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=NO2)C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8FE8BEE351971525_0C951171C937F446_6039_UN""","""CC2=NC1=C(CCCC1OCCC(N(C)CCC#N)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""8B05B29135F70D6B_17BF3C9D429C302E_6039_UN""","""CC2=NC1=C(CCCC1OCC(N(CCCC)CC)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""362DBFBD24B9C90C_A4587847993613CC_6039_UN""","""CC3=NC1=C(CCCC1OCCC(=O)N2CCCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""4498FCEC7E12E268_A6D1E93E76033E57_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(OC)C=CC(=C2)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""70BAA23A85B69BE8_5EB8CB1754F863BB_6039_UN""","""CC3=NC1=C(CCCC1OCCC(=O)N2CCOCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""580D84653F491AE1_AB02A420EECC9509_6039_UN""","""CC4=NC1=C(CCCC1OCC3=CC2=C(C=CC=C2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""6CA68A0F44B1675D_D959384FA0B6A7A3_6039_UN""","""CC2=NC1=C(CCCC1OCC(N(CC)CCC#N)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""B8E347544AF7B535_4087C61B1A839FE7_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=CS2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""021916C48B9A4FE3_AD00440EC1A5D363_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC=C(OCC)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6007516A57D550CF_0FF221B2D55AC4FD_6039_UN""","""CC3=NC1=C(CCCC1OCCC2CC(CC(C)C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""72736D4B6D3B9CF7_F682038D14AE6FCC_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C(N=C(C)O2)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""9A15CDE8D2362502_DD95D0FE4EF36715_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2=NC=CN=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""E2ED0918AB91D98E_9C78365F9E86458A_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2=CN=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8363395A1220C6B8_CC2B5E527C8844F2_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=N2)N(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1EBB784F7D120655_61FF73EE356932BE_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NN=C(C)[N]2C3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""EF386B28AB17AD93_F3EEC905719D82A7_6039_UN""","""CC4=NC1=C(CCCC1OCC3=CC2=C(C=CC=C2)S3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""EFB4350E8A5BA6AD_CAB099C94488D8E2_6039_UN""","""CC4=NC1=C(CCCC1OCCN2CC3CCC(C2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""C24C85C03BB1180D_C91120EB87787806_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CSC(=N2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""B21028FE742909A3_C64D3ED9002A9D52_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NOC(=N2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""30ED52525DBED93D_B0B562704F36CA3E_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=N2)C(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F7A6C0D720819895_DBB13E56E210519E_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2F)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8947EE6510D09390_58D8EC9293BDA4E7_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NN=C([N]2CCC)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""E0BFCD4F9D741208_8E2517016B3FACA0_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NN=C(C(C)C)[N]2C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""82AA1F0C739FADF7_F8F18992664BB73B_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=CC(=N2)OC)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""CD8A2A8D332C8D64_70A0877696EFBDF5_6039_UN""","""CC3=NC1=C(CCCC1OCC(N2CCN(C)CC2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""B58A86694F40CD45_7B5F6981723B8B8B_6039_UN""","""CC3=NC1=C(CCCC1OCCCC2=CC=CC(=C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F5101740EA4E2EDF_FA054D3DF6AB7E2C_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=NC=C2)N(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""AFDF3AC92CF8C29B_654354BD5418DED0_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=CC(=C2)OC)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F71B03614D360C16_09023F7986DB6E07_6039_UN""","""CC2=NC1=C(CCCC1OCC(NCCCN(C)C)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""53426C816D35EB69_9361D5E8F1953F42_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC=C([N]2C)[N](=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""146BD97327C04607_0FEA400A28F4C185_6039_UN""","""CC4=NC1=C(CCCC1OCC3=NC2=C(N=CC=C2)S3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""E2FE5D8F9F37F7E2_8941CAD38DA543FF_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(CCC)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""CE5675BEA3948F48_349485AF1AA6A37D_6039_UN""","""CC3=NC1=C(CCCC1OCCCC2=CC=C(C)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""44DF717166FB0809_D8623A82F8375FFA_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(C(F)F)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""C4C7F3FE5BB63127_D59DD8B0523527F8_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NCC2=CC=CO2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6FBF7D46CB2292C6_0F60A5EA89B709E1_6039_UN""","""CC3=NC1=C(CCCC1OCCCOC2CCCCO2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2E115EA971322D68_23348B8D2CD81C89_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A993B2DD59EB2A34_1BBE17E24DCE65F7_6039_UN""","""CC2=NC1=C(CCCC1OCC(=O)N(CC=C)CC=C)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""BF27284DCC54AFDA_DCB52A827E7DAFBB_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NN=N[N]2C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""CBD770389324D77C_F35B63581E247076_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NN=N[N]2CC3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""9EA51E299D543541_E8D9C84040649AC0_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2)[N](=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""34218297E91AF182_FDACCD72AE310050_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C([N](=O)=O)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1CC3315D7D3F90AC_24356167BDC8533B_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C[N](C)N=C2C(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A3EF05F8A42CC40B_E291137F4A1A2FE0_6039_UN""","""CC3=NC1=C(CCCC1OCCCCC2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""E774F86BE20068A7_8164CF282E1AFF6C_6039_UN""","""CC2=NC1=C(CCCC1OCC(N(CC)CC(=C)C)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""9E85484D43F398B1_E1D351F6E1F88A97_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C)C=C(C=C2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""72BDBA5E3492B796_595932203DDEFF69_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2C#N)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""3812D902470AE156_270368CDC53A79BC_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(F)(F)F)[NH]N=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""953B70133B9A921E_D232141CBA65D879_6039_UN""","""CC3=NC1=C(CCCC1OCCN2CC[S](CC2)(=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8A72EE566652E04F_D958D760C530CA4D_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NN=C([S](C)(=O)=O)S2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A487E504F0028F58_596E5857F00A230D_6039_UN""","""CC3=NC1=C(CCCC1OCC(N2CCCC2(C)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""4FF63F5DE115CB14_1D682903898F9B79_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2(CCC2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""3087BAF288C7868B_AC3F2683B1DDFFEB_6039_UN""","""CC4=NC1=C(CCCC1OCC3CCC2(CCCC2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""6BE0E3E5C1E2A625_F0369A38A7182C9E_6039_UN""","""CC2=NC1=C(CCCC1OCC(CCC(OCC)=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""B365670F827C9D30_040CB67101D202F0_6039_UN""","""CC2=NC1=C(CCCC1OCCCCC[S](CC)(=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""DEAE6DB5DD8A4C92_6E45530235C07C03_6039_UN""","""CC4=NC1=C(CCCC1OCC(=O)C2CC3CCC2C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""9377DA948E239D9D_3073589F48A22D5E_6039_UN""","""CC3=NC1=C(CCCC1OCCCCN2CCOCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""0D6B1AC8DF5B84C1_87DA085E7E9419FB_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=C(C=C2)C#N)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""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"""
+"""6765EFF2686AB442_8EA71DC3A8C6671B_6039_UN""","""CC3=NC1=C(CCCC1OCCC2=C(CC)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""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"""
+"""BFA182E877A2FD84_B4FDF66F315C5F0C_6039_UN""","""CC4=NC1=C(CCCC1OCC3=CC2=NON=C2C=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""AB1E3B37D6D669E9_B922D6D0B7CCF9EA_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C(C)N=CC=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A4922097AC81FB78_F3406C7A7FE06BA3_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=N[N]2CC(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1D24A85D542B87F7_DA71947354A1DDFA_6039_UN""","""CC3=NC1=C(CCCC1OCCSCC2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2FA9FB394D1D7D62_867B1DA6A7BAA576_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CSC(=C2)C(OC)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DD811F70D390A834_DD7FB4296F90B0D1_6039_UN""","""CC3=NC1=C(CCCC1OCC(CC(C)(C)C2CC2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8A3FDEEBA0EE0587_C6EA7A4453645E73_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)C2CC[S](=O)(=O)C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1A6D986F41B04277_55B08F43E7334D81_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NCC2CCCO2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""67B569F3A753A000_5527E11108D0861A_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)N2CCCCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""B7791A2E733CC2B1_2DA8EA491E579948_6039_UN""","""CC3=NC1=C(CCCC1OCC(N2CCCC(C)C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""E1CE737644C47BD7_9C1D1E19BCF1CACE_6039_UN""","""CC3=NC1=C(CCCC1OCC(N2CCCCC2C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8EA60B950BA8E947_1684A8077C65321D_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2)C(C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A9EA8D8AE83F0BB9_D7E33ACC8B11A76A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(O)=O)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""81481D35EA305E3E_EC6F238E59FEC3CD_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=CO2)C(OC)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""94D9B865D454C1EB_0D6AC20CBFF69219_6039_UN""","""CC2=NC1=C(CCCC1OCC(NCCCCCC)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""921C4226B8ADC41C_D0AE078FF7A931BD_6039_UN""","""CC2=NC1=C(CCCC1OCC(NCCCOCC)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""BA0090432B875B1C_7EE3DC7E68776890_6039_UN""","""CC3=NC1=C(CCCC1OCC[S](=O)C2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""894706025EBB57E8_1C753794AA4FA74E_6039_UN""","""CC2=NC1=C(CCCC1OCC(NNC(C(C)C)=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""A80DF0F3EB784A78_AFDCC5DE87642837_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC=N[N]2CC(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""568BBF2B01FCF6FD_8F8F6AF6C6552060_6039_UN""","""CC3=NC1=C(CCCC1OCCCC2=C(C)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""5FDCCF42C8D1EA64_7D6D864DC68FF956_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C(F)C=NC=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""14FD0C456ED103AE_C97D225D4CD40014_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=CO2)C(OC)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6EFD1494D9A5F55A_E16A47883AF1C474_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=CS2)C(OC)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""815365C7B15B714A_C410798A7C3AD843_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=C(OC)C=C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F654D3684250D596_2AD03F2DEE772595_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)N2CCNC(=O)C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6788F1BDE1D05EF8_20680C3DF541BC08_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C([N](=O)=O)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""47DF2D63964A792B_D6EE9D0CE7DB91D5_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)CC2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""08CC77A40FCB63B5_52B456362869AB3C_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(N=C(CCC)O2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8F88965FB8F55153_953451B3792C5BFA_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC3=C(C=C2)COC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""8F1FDE3535322F10_465FFA7F4D023E2F_6039_UN""","""CC3=NC1=C(CCCC1OCCCC2=CC=CC(=C2)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""C05D2D2CF6D725DC_B9A3A2E4BC251E30_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C(ON=C2C)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DB50517F1D651FBD_363A922AE8A01EF2_6039_UN""","""CC3=NC1=C(CCCC1OCCC2=CC=CC(=C2F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1276D682AF663715_FD7DD04CFA37AEB2_6039_UN""","""CC3=NC1=C(CCCC1OCCCN2CCN(C)CC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""0F32E390701C28C9_7874E9E0801161C2_6039_UN""","""CC2=NC1=C(CCCC1OCCNC(NC(C)(C)C)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""81E164697C5179A6_A32843F8C8378065_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=CN=CC(=C2)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""4D14F8C1DD00FB34_21C5E71978B1AEEB_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NN=C(O2)C3CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""D85BC97000004429_EB5EF4F1AEC811A2_6039_UN""","""CC3=NC1=C(CCCC1OCCC(=O)C2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""FFC15515C63F0D3A_508990D76EF4B891_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CSC3=NCCCN23)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""4198585DC4F91C65_8B55CE0147A9E0CC_6039_UN""","""CC3=NC1=C(CCCC1OCCCCC[N]2N=CN=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""4BE01A31C13799FB_F731CAADB776F5C3_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C=CC(=C2)F)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""323D0F39B36932E8_B8F68169C12ED10C_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(N(C)C)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""10576EFA2BD1C131_E852CB1EB630D283_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(C(C)=O)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""EE64385C57967C85_C0DD6AE7F9D0D846_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CSC(=N2)C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""9CADFBB857161FFB_F04B063F31D7D9C4_6039_UN""","""CC3=NC1=C(CCCC1OCCOC2=CC=CC(=C2)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""66BAE3116E2B76F0_1AC4939EC9CBCA5C_6039_UN""","""CC3=NC1=C(CCCC1OCCC[N]2N=C(C)C=C2C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A753D8213755C1D9_EE63105480692DC8_6039_DP""","""CC3=NC1=C(CCCC1OCC2=NC(=NO2)C(N)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""B76499D67BCAE415_171CF75B61E532F6_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NOC(=N2)C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""CEDE4C13A51849E6_D587698867EACBED_6039_UN""","""CC2=NC1=C(CCCC1OCC(N(C)CC(F)(F)F)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""4462806E60BFA112_22F47C5DFAC4E7E5_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CN=C(N(C)C)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8260600794ABC0A7_AEFD4FF4F450DD16_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(C(OC)=O)O2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8D2442E385F402FA_9DFDC616A007E242_6039_UN""","""CC3=NC1=C(CCCC1OCCN2C(NC(C)C2=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6B730CE84D420022_ED1F52E708BEC958_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(C=C2)N=[N]#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DB20C637544531F7_65515592EEB7629B_6039_UN""","""CC2=NC1=C(CCCC1OCCCC(NCC(C)C)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""2B0C97E38335875E_18FD82DE1063B247_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CSC(=N2)C(OC)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""5BC5B575ED85EB4B_8848C025A08A1BCB_6039_UN""","""CC4=NC1=C(CCCC1OCC3CN(C2CC2)C(=O)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""4A8D782C9FAF5FF3_7A0AB2C39741C96F_6039_UN""","""CC3=NC1=C(CCCC1OCCC2(CCCCC2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""AD15A4C91E9C3F8E_88AB077148F47C81_6039_UN""","""CC2=NC1=C(CCCC1OCCCCCCCC(O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""CF0D3F392924C6D4_CB29288BBE887F81_6039_UN""","""CC3=NC1=C(CCCC1OCCN2CC(OC(C)C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""D77C9341B3AE3E84_8F0E0399147D9455_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(C=C2)CC#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""C0B9ECCA3303A308_F515822911692E1A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NN=C(C(F)(F)F)S2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""63B94F8518A63829_D6D38DAEDC4564CF_6039_UN""","""CC3=NC1=C(CCCC1OCCN2CC(C)CC(C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""AE3252B59850612D_E79C740107C75054_6039_UN""","""CC3=NC1=C(CCCC1OCCC2=C(F)C=CC=C2F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F1F9C9CE9818ADD8_4297D1FBD19376BA_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=N[N](CC)N=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""29D0DA9A07970B4E_C0EDE9FD99CE1DCA_6039_UN""","""CC3=NC1=C(CCCC1OCC2=N[N](C(C)(C)C)N=N2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1BBEA6FB6C8073DC_6B33CAED05016E86_6039_UN""","""CC3=NC1=C(CCCC1OCCN2NC(=O)C=CC2=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""3EDA965F8AD44E0A_98E06815EB650E6C_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2(C(OC)=O)CC2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""86C93CA990E40224_D6BD4C75C1831647_6039_UN""","""CC3=NC1=C(CCCC1OCCN2C(CN(C)C2=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""AD5A22148882F0D4_FED9A820BAB38055_6039_UN""","""CC4=NC1=C(CCCC1OCC3=N[N]2CCCCC2=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""2B0766158670DB24_2C64F1A6F686452F_6039_UN""","""CC3=NC1=C(CCCC1OCC2CN=C(C(C)(C)C)O2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""83745E4D47F3E8C0_F71E617BECA23CB6_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C[N](C(C)(C)C)N=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""95CB96DEEF56D1F9_B9C5DB459D715E10_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC3=C(C=C2)C=N[NH]3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""9B91E41E34658E73_D346EF2AAAEC36F9_6039_UN""","""CC3=NC1=C(CCCC1OCCSC2=CC=CC(=C2)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""C11B33117DE7B423_2DBC4F7F8DFB81CF_6039_UN""","""CC3=NC1=C(CCCC1OCCOCC2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""69F15128EA87A2DB_CD4A0C7B63200E02_6039_UN""","""CC2=NC1=C(CCCC1OCC[P](N(C)C)(=O)N(C)C)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""45C451D4258E07A9_EF96F036BB4833F9_6039_UN""","""CC2=NC1=C(CCCC1OCC(N=[S](N(C)C)(=O)C)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""D61A2CD6D9BCEB9C_6F59424C71990E51_6039_UN""","""CC3=NC1=C(CCCC1OCCSC2=CC=CC(=C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""50DBBC3C8FAB3E51_B06EBA770E2F9CB9_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NC(=N[N]2C)C3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""DA7EA7D357A74D54_987343DA1C901558_6039_UN""","""CC3=NC1=C(CCCC1OCC2=COC(=C2)[S](N)(=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""05AEBDBB55A40969_F05973098F0822E0_6039_UN""","""CC3=NC1=C(CCCC1OCC(OC)C2CCCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""95202C8366B4C405_69D4402678C4C8E7_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=C(C=N2)C)OC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""87B876B967D1D3E0_A9F02BA3156BEF6C_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=NO2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2EF8CE4EF4CE7C89_A8C24B2FE73AC782_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2)C(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""EB05B317842B6929_AF2941C57514921A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=COC(=C2)[S](C)(=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""376A5D32D18196B6_210586DB5EAE4DA9_6039_UN""","""CC3=NC1=C(CCCC1OCCC#CC2=NC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""5C0987A9C2921031_6129600AE731CBD0_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=CC=C2)N=[N]#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""FF58DBB70B05B020_6F52E2AD954B230F_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NC(=NO2)C3CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""F430685375302CB4_61B98FB9E2C9A8D5_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=C(C)C=C2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""01F5C4C6E131BBF7_937B66F7849DB9F5_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(N=C(C)C=C2C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""48E4338B406B03C8_F7DD5A83B1730D8A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=C2C)OC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""26B185AD82A134D9_E10ACC7D996CA611_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NC(=NO2)CC3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""DCE4C3D8476220D7_4F58B335709E55CC_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(C(C)(C)C)O2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""95B11B64BC0AB748_94E447169240C25F_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C=CC=C2)N=[N]#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""614F309E86787731_A728590E44F85A5B_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(OC)=O)C=CS2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8473155262A5611B_9255F723B2935FFB_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2=NC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""90D74FFF2A49DED0_7F59AC30BD19FB2D_6039_UN""","""CC4=NC1=C(CCCC1OCC3CC2(CCCC2)CO3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""0A4E54D1AE23AE7E_B3E0E0A9449C7C90_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C(F)C=CC=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8014A3A6D54FB54A_48B8B3BD78DDF15B_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=CS2)C(OC)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""D12893736B6D07B3_CB8668A865B21D89_6039_UN""","""CC4=NC1=C(CCCC1OCC3=NC2=C(CCOC2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""456C7421FF2CD923_C210C71EED27B636_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=CO2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""5440347152DF0FE2_3D37DE46D9F02245_6039_UN""","""CC4=NC1=C(CCCC1OCC3=NC2=C(CCCC2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""57DA9B0DCB97EDAC_55BDA7B6D2368356_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C([N](=O)=O)N=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""235B1B7BD785AB66_103F09E87A44FD13_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NOC(=N2)C3CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""DF4BEF4A8A8F63EE_69739001BCF6B96B_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC=C[N]2CC(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""11320AA8B281BA82_1CB0D3839288CC52_6039_UN""","""CC4=NC1=C(CCCC1OCC3CCC2(CCC2)CO3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""FB0D7A109B3047A2_2C8A5CD0AD69B76A_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CN=C(N=C2)C3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""2989D91E8307A760_D1887A6CB0FD542B_6039_UN""","""CC3=NC1=C(CCCC1OCC2=COC(=N2)C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""66C4934C8B59FE3C_9C8ADF71A6D4CC48_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2=NC=CC=N2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1E6E54272257E4E4_E3F631721AD934D0_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=C(OC)C=C2)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""5CEA6DE30E036020_DA1A887307D12B4C_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC3=C(C=C2)[NH]C=N3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""60B9315F4B5429F4_DBB13A253FF09829_6039_UN""","""CC3=NC1=C(CCCC1OCCOC2=CC=C(F)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1BC5EF1C27F47F69_676C78CF79705049_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=CC=CC(=C2)F)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F3473CCD52645117_5F4A0153323140C1_6039_UN""","""CC3=NC1=C(CCCC1OCC2=COC(=N2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""CB1837308FB6C6E5_2971519DBE11847A_6039_DP""","""CC4=NC1=C(CCCC1OCC3CC2(CNC2)C(O3)=O)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""B7C00FB65EE21D92_1D222A4F0D4F55BA_6039_UN""","""CC3=NC1=C(CCCC1OCCSC2=C(F)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1E1861B878002CF5_6B0D6E01040347E6_6039_UN""","""CC3=NC1=C(CCCC1OCC2CCC(C(F)(F)F)O2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""7E0AA10DFEAE4740_64FC9F4909225F2C_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=CC(=C2)C#N)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""FEAC1E4BADF0740D_676584BFDF92CC33_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2CCCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""538AB0704AC499CC_B2869F61FD800A7C_6039_UN""","""CC3=NC1=C(CCCC1OCCOC2=C(F)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2A6A0F0A220C8A16_362BFEAFDD7AB8AA_6039_UN""","""CC3=NC1=C(CCCC1OCCOC2=CC=CC(=C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""E32005532193A4C6_CB2DDAEA9BE1F822_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(SCC)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""AE499FACDEC0A349_1AA171201A27470E_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=CO2)C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""079BBF8E3A9D9A94_4974384A51994BF2_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C[N](C(C)C)N=C2C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""22EC731268832ACD_6C2BE1FD34844D6D_6039_UN""","""CC4=NC1=C(CCCC1OCC3CCCC2(CCC2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""24EE04E58B385EBE_7C7AAD1D099EFB7D_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NOC3=C2COCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""344D070BE27CCD0A_E0D3B4C9E487E123_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C(B(O)O)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DDED38E1C9D1C501_F723BFFB2660A452_6039_DP""","""CC4=NC1=C(CCCC1OCC3OCC2(CCNC2)C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""3E4AC128E64A7FAE_FD3DFEB49E2510B8_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC=N[N]2C3CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""C906CEE9799DAC41_CBEC3447FF758423_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(C)C)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""073E128C8239C1EE_1BA5C8CA8EB902CD_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)C2=CC=CNC2=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6F5A31730A312227_9EB9F787A85C057F_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C(N=C(C)S2)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""24EF399B62F48FB4_1534650529FF158C_6039_UN""","""CC3=NC1=C(CCCC1OCCCCC2(CCC2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""925927A821BF855C_AF06D3B0F7EEA9AB_6039_UN""","""CC4=NC1=C(CCCC1OCC2=C(ON=C2C)C3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""30BAF67F910DA606_A1C1E3210211AC65_6039_DP""","""CC4=NC1=C(CCCC1OCC2OC(CC23CNC3)=O)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""3320F97D532B667C_B11BEAFD13D694FA_6039_UN""","""CC4=NC1=C(CCCC1OCC2OC(=O)CC23CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""42E5F54A1D6CCE70_7E76E6F3E09CEDF5_6039_DP""","""CC3=NC1=C(CCCC1OCCC2(C(O)=O)CCOC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6CC4582390D75F6A_3C98E25B30E2EB42_6039_UN""","""CC2=NC1=C(CCCC1OCC(CC(OCC)=O)(F)F)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""2570451F37814B31_9CFC495E4368A63A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(CCC)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""17319C7A70CDF63A_52208EFB410EF5DD_6039_UN""","""CC3=NC1=C(CCCC1OCCN2CCC(F)(CC2)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""11C670F8524A384E_652974BFB6F890E6_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)NC2=NN=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F9F82B6A118192A9_0B10E241A019402B_6039_UN""","""CC4=NC1=C(CCCC1OCC2=N[NH]C3=C2COCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""8E6EEBA1FFFCDA86_06A90D92A8FF15A8_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(F)F)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""9FA0DA9AD5073609_42DDE4D5195F8B48_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CSC(=N2)COCC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""47594264F0A6F780_F49C5AF7B31B735E_6039_UN""","""CC4=NC1=C(CCCC1OCC3=C2C=CC=CC2=NO3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""29FE7BF668FE5B59_9E11DD191EB029BB_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC3=C(C=C2)[NH]N=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""39A3A664EB351ABE_C1715FD8C34145EE_6039_UN""","""CC4=NC1=C(CCCC1OCC23OCC(C)(CO2)CO3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""4A3D659141476049_F2CD21896CF0B967_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C([N](C)N=N2)C(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1386957A1AE4AA4C_9F1966AB84CFFAB2_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=NC=C2)OCC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""27E42F093F5F01FB_48870B0F6B30387E_6039_DP""","""CC4=NC1=C(CCCC1OCC2=NC(=NO2)C3CNC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""4C716B2308601919_9F190CEFCEF8B339_6039_UN""","""CC2=NC1=C(CCCC1OCC[S](CCC(O)=O)(=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""6511302A4ED24E40_41A37DCC63C032DB_6039_DP""","""CC4=NC1=C(CCCC1OCC2=N[NH]C3=C2C=CC=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""F023B063C67ADA0A_D077ACF9DEEFA6DE_6039_UN""","""CC2=NC1=C(CCCC1OCCO[S](C(F)(F)F)(=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""F2C910145EE5A349_9510783750D6264A_6039_UN""","""CC4=NC1=C(CCCC1OCC3=C2SC=CC2=CC=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""3F6FAE43CF8E47E3_60ED8F7232E9DD00_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC=CC3=NC=N[N]23)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""05AA75C654EF7FF9_72C894C676503078_6039_UN""","""CC3=NC1=C(CCCC1OCC2CCC(F)(F)C(N2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""17800EDD6005DA31_6FFDD7E64FD03819_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC=C[N]3C2=NC=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""187F4B6DBBC9423F_CDFDB7E9047721C4_6039_UN""","""CC4=NC1=C(CCCC1OCC3CC2COCCC2O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""C94974F882999823_B475D4E488AFAA75_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)CCC2CCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""4CBBD9571F68F505_1CA8A5F66EC6BCFE_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C(C)SC(=C2)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""FEB1B0F98093C04F_ACD78F5480CCE670_6039_UN""","""CC2=NC1=C(CCCC1OCCC[S](CCOC)(=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""416FEF7C97AD7D2E_D74E9EBD411C3A77_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CSC(=N2)NC(C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A54DA6E58B4E420A_22FEADE87E748B85_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NN=N[N]2C3CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""2A01E23C387671BB_1C28A1D5E57DA845_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NOC(=N2)CC(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""ABB6EC4F0DDBC7D7_AB9CC407B8EB9678_6039_UN""","""CC3=NC1=C(CCCC1OCCOC2=C(C)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""642DD22F557493E5_0010A028C845C281_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NN=N[N]2CCCC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""33F569308755EB54_3770ACF687BAB03C_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NN=C(C(F)(F)F)O2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F67FD9ABBA05A095_CB36755E8F6579BC_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=C(F)C=C2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""ABD926EE835A24C2_E4CC47312D7A3A4E_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C([S](C)(=O)=O)SC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6F0A495679E5F45D_995B2F18A4B550B5_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=C([S](C)(=O)=O)O2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""B648EF8FA3CEC76B_C17B69F8D10AEF71_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NSC3=C2C=CC=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""78DF030063327EB2_A52F72E47AFD98D2_6039_UN""","""CC4=NC1=C(CCCC1OCC2=C(OC=N2)C3CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""8F8DAED9B5083352_9685EB30BAC0D7BE_6039_UN""","""CC3=NC1=C(CCCC1OCCOC2(CCOC2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""7C55B86F35AA947D_074F41374FBE2EE9_6039_UN""","""CC4=NC1=C(CCCC1OCCC2C3CCN(C2)CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""00FCF98300144D4C_75566BBE6341B09A_6039_UN""","""CC4=NC1=C(CCCC1OCC3=CC2=NC=N[N]2C=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""A9A3D09D9C94E9E7_D140BA46B51940EE_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=NO2)C(C)(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2FD96B75B4180FFD_311D9254AA03ADCC_6039_UN""","""CC4=NC1=C(CCCC1OCC2NC(=O)CC23CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""8EAD475C330A8561_A4B2FFD9EF8A6C57_6039_UN""","""CC4=NC1=C(CCCC1OCC3=NC2=C(CCCC2)[NH]3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""B6A9AC7344CC6AF8_38CC0B3051BB64F1_6039_UN""","""CC4=NC1=C(CCCC1OCC2CCCC(O2)C3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""99D100EDEC62A034_D3B70B7918F1BFE7_6039_UN""","""CC4=NC1=C(CCCC1OCC3=NC2=C(CCCC2)S3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""590C8B080EEFFC52_730381C355917668_6039_UN""","""CC4=NC1=C(CCCC1OCC3=CC2=NSN=C2C=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""5BFF477837B94396_2747D49EB82D5256_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC(=CC=C2)C3CC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""F4205C4666CAD1B3_038E690D1A4B02F2_6039_UN""","""CC3=NC1=C(CCCC1OCC(OC)C2CCCOC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""84C498DA7638B536_68BEDE3D53BEC2F2_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC=CC(=N2)CCC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""527D3928A70FABA8_68ED7B430164EF73_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CN=C(OC)C=C2C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""AAB5A7A25ECD7505_C0FBBE056F06A4A1_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC=CC3=NC=C[N]23)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""80028F4C06964142_1EDBE80D352C1892_6039_UN""","""CC4=NC1=C(CCCC1OC[C@@H]2O[C@H]2C3=CC=CC=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""EE619D6987AAB8B3_90237ACFD8FCF468_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=CC(=NC=C2)F)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6095EB5829FB85E8_183906151BED6208_6039_UN""","""CC3=NC1=C(CCCC1OCCC2=CC=CC(=C2)OC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""7608A972817D5063_AFA339D52AD761C2_6039_DP""","""CC3=NC1=C(CCCC1OCCOC2=CC=C(O)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""EB9E1CED5FDEFE6E_8AE78AD246406C57_6039_UN""","""CC4=NC1=C(CCCC1OCC3[N]2C=CN=C2CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""8197F94C0E7F16F8_186CB4D64FBE02BD_6039_UN""","""CC3=NC1=C(CCCC1OCC2ON=C(C(C)(C)C)C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""ED03A587E7DDBFEF_BCB8CF9F85961D7F_6039_UN""","""CC4=NC1=C(CCCC1OCC3CCC2(CCOC2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""F537967759E24802_E6A01B0E6D66E562_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=N[N](C(=C2)C)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""7341823A48707BAE_C1E4EC67352A69EA_6039_UN""","""CC4=NC1=C(CCCC1OCC3=NC2=C(COCC2)S3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""EFB61707714B7535_790D508BDAC7546D_6039_UN""","""CC3=NC1=C(CCCC1OCCC2CC(C)(C)NC2=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""97F4437DF74F7AC9_E4AB0521A72EBEBD_6039_UN""","""CC3=NC1=C(CCCC1OCCC2=C(OC)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""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"""
+"""0FB2239216BE7B84_5FD6F6F2C0B2DFAB_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC=C(C(O)=O)C=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""9812BF6CF9CB46C4_A7B7A9BA069AA6BF_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2C(C)(C)C2(C)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6B90011D0798DF84_5745CEE745FF811A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=CC=C2)CC=C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1E9A34BD64401518_F7FDF9155C38CEE5_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C=CC(=C2F)C)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""843A3EBB7A825A82_908AB09D2B72842F_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(C)C)ON=C2C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DEF6D53A962F36F1_0FAB5302D2BBB5A1_6039_UN""","""CC2=NC1=C(CCCC1OCCO[Si](C(C)(C)C)(C)C)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""58B971CBB469BED5_BE1D9CF63A5AF41B_6039_UN""","""CC2=NC1=C(CCCC1OCCC[S](C(C)(C)C)(=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""2580F10FFB5E6411_0CE45344A016529A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(OC)C=CC=C2F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""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"""
+"""842A8F5F1DD34B47_F733406E8567B46E_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=CC(=N[N]2C)C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""AA5B08EC8C47C46C_33AB57C388682C67_6039_UN""","""CC3=NC1=C(CCCC1OCC(=O)C2=CNC(C=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8AE9CFA1FC42627F_38B8BD426A83BDAF_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C=C(OC)C=C2)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""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"""
+"""8A13A880D0B5E11A_C48D97D875D5C7B0_6039_UN""","""CC4=NC1=C(CCCC1OCC3COC2=CSC=C2O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""4A989284DA52D634_D608AB6F8E72C10F_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C=CC=C2)CC=C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""CD2E735518BAF111_2D33DE014DB097E6_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CON=C2C3CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""C9D53795893FC034_1DDC0A3186CEE1C8_6039_UN""","""CC3=NC1=C(CCCC1OCCC=CC2=CC=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DFB92E0FF43189AC_0BFE2A308090D8D0_6039_UN""","""CC3=NC1=C(CCCC1OCCCN[S](=O)(=O)C2CC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""5A56AD8EF12824B6_50F1E47BEAD8BEE9_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C[N](C(C)(C)C)N=N2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""C699BDD792542101_5541BBCF97CF88DE_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2=C(C)C=CC=C2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""83809A58F6ED3C9D_54942E560A99C9CD_6039_DP""","""CC4=NC1=C(CCCC1OCC3CC2(CCNCC2)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""CF9F5590CF0C1DBB_AB0484878DD22D81_6039_UN""","""CC3=NC1=C(CCCC1OCCC2(C(F)(F)F)CCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""0068E6B7AD5B35A4_14484591F55CEF2B_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CSC=C2C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""A421A5A7506626D5_12B202F3A9411CDC_6039_UN""","""CC3=NC1=C(CCCC1OCCN2C(C)(COCC2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DFDDCEBF696FD385_07227EF406C4FBA3_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C([S](C)(=O)=O)C=CS2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""326214FFDF353486_B79F312AEAB6FBAB_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(OC)C=CC(=N2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""953B70133B9A921E_5E290B500E743142_6039_UN""","""CC3=NC1=C(CCCC1OCCN2CC[S](=O)(=O)CC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""AACD7CD9DA386267_46B358ABD0D1446B_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NSC(=C2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""BEC55F650EB22D36_E808AF9FC8D2174E_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(N=C(OC)C=C2)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""D44B44F647F09982_DBA5CF505197631F_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CSC(=C2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""0183F86C1E48287F_5C373AF0CE88D950_6039_UN""","""CC3=NC1=C(CCCC1OCCCCCC2OCCO2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""FB54C8482081C144_6B1BBA34D78F9EB1_6039_UN""","""CC4=NC1=C(CCCC1OCC3CC2(CC2)[S](=O)(=O)N3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""8C333AD5A69920C4_D6E68FF7BBE1CC4B_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC3=C(C=C2)N=N[NH]3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""ED0A6D25786C551D_0C5602B1602A719B_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC=CC3=CC=N[N]23)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""21C1EEA69BA38FF6_03B262D26FC8AAFE_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(COC)C=CC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""6CC1EAE7243AFA88_F821A101FAA9E5E5_6039_UN""","""CC3=NC1=C(CCCC1OCCCC2=C(C)C=CN=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""E6A2EB1DFCC15398_2BF1C2DBABE0E664_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(C(OC)=O)CO2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""BA6821ED8DEE6278_A4296342834F880A_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=CC=C2)CC#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""1B12470207DF8032_19F9485A24ACD703_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=CS2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""B6EA42039F54A8C4_29E003026121B2E8_6039_UN""","""CC3=NC1=C(CCCC1OCC2=N[N](C)C=C2[N](=O)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""D708681D6404D8F3_32468F37C6EFAB6C_6039_DP""","""CC4=NC1=C(CCCC1OCC2=CC(=NO2)C3CNC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""035899F09B488133_578281DE47B898FC_6039_UN""","""CC4=NC1=C(CCCC1OCC2=CC3=C(C=C2)C=CO3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""6E1B6F6EECC551F7_902CBFC3D77D7836_6039_DP""","""CC3=NC1=C(CCCC1OCC(N2CCNCC2C)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""2F38770D14D29928_811B9E14B81E0F85_6039_DP""","""CC3=NC1=C(CCCC1OCC(NC2CCNCC2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""9D6F7C0C260F9DE5_6E7FCFF17CAC4656_6039_DP""","""CC3=NC1=C(CCCC1OCCC2(CCNCC2)C#N)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""804843502F056599_D6B9DA890FB76B96_6039_UN""","""CC4=NC1=C(CCCC1OCC2=NN=C3C=CC=N[N]23)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""AFC6A3C4BF3546ED_EFB28FE3D7638F4C_6039_DP""","""CC4=NC1=C(CCCC1OCC3=CC2=C(CNC2)C=C3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""FFAE4A10EA88DA66_F7FFB8BD678559F5_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NCC(C(OC)=O)O2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""D45D7DCC8F4F3327_9C9F1904DCD5456D_6039_UN""","""CC3=NC1=C(CCCC1OCCNC(=O)N2CCCC2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""C4C3223F63DB5A61_8C7E04F67FC2BB8B_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NOC(=C2)CC(C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""534CB0F8915DB820_3F3196B3F904AA81_6039_UN""","""CC3=NC1=C(CCCC1OCC2=N[NH]C(=C2)C(OC)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""E5DCDA63DC7B2E68_379EB15C7482982C_6039_DP""","""CC3=NC1=C(CCCC1OCC(N2CC(C)NCC2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""EC354FA8DC00EE25_E31C6B617E04F5B7_6039_UN""","""CC4=NC1=C(CCCC1OCC3=CC2=C(C=CC=N2)S3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""B6D1CF338C186002_6A8FBCE3B0B7F0D3_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=NC(=C2)C)OC)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""0C5B9EA9A6BAEEAF_2ED73070241F5098_6039_DP""","""CC4=NC1=C(CCCC1OCC2CNCC3(O2)CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""A98E20D00AF49F5A_24C80A074FCE8A25_6039_UN""","""CC3=NC1=C(CCCC1OCC2=CC(=NC(=N2)OC)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""8C9572009383E238_01BCA8654CDDE0CD_6039_UN""","""CC3=NC1=C(CCCC1OCCN2CCCO[P]2(N)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""F5918EAABF0548D8_C6DBA4BDA1606DF6_6039_DP""","""CC4=NC1=C(CCCC1OCC2=N[NH]C3=C2CNCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""12A55AFFAE7D9866_01B3676CF99A7EB4_6039_UN""","""CC4=NC1=C(CCCC1OCC2=C3C(=N[NH]2)CCCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""5D00EC26BE36FF0B_BB01F8A9560D0BB4_6039_UN""","""CC3=NC1=C(CCCC1OCCC2=C([N](N=C2C)C)C)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""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"""
+"""AFDB3384E72F5228_84BCC66F9853B4FD_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(F)(F)F)SC=C2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""DA2D45728AE60AFB_1D6A8E62A01A8257_6039_UN""","""CC3=NC1=C(CCCC1OCC(C2(C(F)(F)F)CC2)=O)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""882B972DCA67B22B_2DA0703E7F0F65F1_6039_DP""","""CC4=NC1=C(CCCC1OCC2CNC3(CO2)CCC3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""119A21A68BA31B3B_69D3D26696310049_6039_UN""","""CC3=NC1=C(CCCC1OCC2=C(C(C)(C)C)OC=N2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""997E4422ED7A423A_69DCF1640E230DB1_6039_UN""","""CC2=NC1=C(CCCC1OCCOCCOCCOC)O2""",21,"""D9F5D29FE0E2FE4F"""
+"""D472B1A535A7A2E2_A114440266909372_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NN=C(C(F)(F)Cl)S2)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""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"""
+"""1544F794E6C154E2_CAFDE39CD0BF8EF0_6039_UN""","""CC3=NC1=C(CCCC1OCC2=NC(=C[NH]2)C(F)(F)F)O3""",21,"""D9F5D29FE0E2FE4F"""
+"""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"""
+"""2F7F780B81273426_A57060BABDDF3F42_6039_UN""","""CC4=NC1=C(CCCC1OCC3CC2(CCC2)C(=O)O3)O4""",21,"""D9F5D29FE0E2FE4F"""
+"""0D53E9FE8F8E0D4E_9DFE26778F819DA9_6039_UN""","""CC2=NC1=C(CCCC1OCC(NCC(C(C)C)=O)=O)O2""",21,"""D9F5D29FE0E2FE4F"""
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+"""F5B837CADE384B96_1D919A408BA3290C_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)NC2=NN=C(O2)C3CC3""",21,"""B864DAFFF20826F7"""
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+"""C773A47E55F65C1E_76E5B77A99F9E156_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NCC2=CC=C(CC)S2)=O""",21,"""B864DAFFF20826F7"""
+"""95B3E4204570A762_2960F844333270C6_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)NC3=NC2=C(CCC2)S3""",21,"""B864DAFFF20826F7"""
+"""D6DAEEB5525FBA22_5712B77A02AF6D35_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)N(C2CC2)C3CCCC3""",21,"""B864DAFFF20826F7"""
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+"""97F243FC515185A3_A3AE086CB8D0B654_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)NCC2CC[S](=O)(=O)C2""",21,"""B864DAFFF20826F7"""
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+"""D5C575CBF771ADBC_BD31FC0403560749_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=NC2=C(C=N[N]2C)C(N3)=O""",21,"""B864DAFFF20826F7"""
+"""25354CA7C0A3644A_2F1824E460154FB6_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NC2=NC(=C(S2)C)CC)=O""",21,"""B864DAFFF20826F7"""
+"""791A48E4981754E1_0F5C49ECA81CF1A2_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C([S](N(C)C)(=O)=O)O2""",21,"""B864DAFFF20826F7"""
+"""DE7A59AD9E1EB030_6388E6C30FF40BCB_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=N[N](C=C2)C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
+"""C918656EB6053FC6_61922F1B0515F085_6039_UN""","""O(C1CCC=C(C1)C#N)CCC2=CC=C([S](N)(=O)=O)C=C2""",21,"""B864DAFFF20826F7"""
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+"""9D3786D4D2742E1B_D8E2F057A531BCCF_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C2=CC3=C(C=C2)CCC3""",21,"""B864DAFFF20826F7"""
+"""9F69B3C67458CE77_5AC13CBFF66B1373_6039_UN""","""O(C1CCC=C(C1)C#N)CCOC(=O)NC2=CN=CC=C2""",21,"""B864DAFFF20826F7"""
+"""BB895B6641CE2459_AB54028E10628FD1_6039_UN""","""O(C1CCC=C(C1)C#N)CCCN(CCCC)CCCC""",21,"""B864DAFFF20826F7"""
+"""3301BF6DA8EB5081_92006C648764F23D_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NCC2=C(ON=C2C)C)=O""",21,"""B864DAFFF20826F7"""
+"""61C7EC9726440740_FD7E24B4CD6DF603_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=CC(=CO2)C(OC)=O)=O""",21,"""B864DAFFF20826F7"""
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+"""9CB1D525D887FF9D_4C73350556722B67_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C=CC(=C2)C(OC)=O)F""",21,"""B864DAFFF20826F7"""
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+"""8E70B421345EAE39_DF46E209B822B014_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NN=C(S2)C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
+"""AA209742B03B0975_60614FED281FAE04_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=NC=C2)OCCOC""",21,"""B864DAFFF20826F7"""
+"""B2197E7A939BD759_19654DE58533F073_6039_UN""","""O(C1CCC=C(C1)C#N)CCC2=C(C(OC)=O)C=CC=C2""",21,"""B864DAFFF20826F7"""
+"""2C38B525F112BB9B_60523D92F3D56638_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)N2CCC3=C2C=CC=C3""",21,"""B864DAFFF20826F7"""
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+"""7A1135410AC936E2_B6F364CA9B1594E7_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(C(C)(C)C#N)C=C2""",21,"""B864DAFFF20826F7"""
+"""C3A77019648A3A02_4ED2C91578CE3E73_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NC2=CC(=C(F)C=C2)F)=O""",21,"""B864DAFFF20826F7"""
+"""5AB51ADB5ACE7101_F0075AC3BEF9F1A0_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)N(CCC#N)CCC#N""",21,"""B864DAFFF20826F7"""
+"""49BDC30DE635D2D6_1B71DE69F9D766A8_6039_UN""","""O(C1CCC=C(C1)C#N)CC(CC2=CC=C(OC)C=C2)=O""",21,"""B864DAFFF20826F7"""
+"""CF9365D6F850CC50_5C884967DC7172AC_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=CC=C([N](=O)=O)C=C2)=O""",21,"""B864DAFFF20826F7"""
+"""A76E442C2812B458_32164BE1F36AD2F9_6039_UN""","""O(C1CCC=C(C1)C#N)CCC[S](=O)(=O)C2=CC=CC=C2""",21,"""B864DAFFF20826F7"""
+"""AF4139C8A764CD47_0D4F3A138785B6AE_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=NO2)C3=C[N](C)N=C3""",21,"""B864DAFFF20826F7"""
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+"""96FF8F617C732C7B_99BD67154925A25C_6039_UN""","""O(C1CCC=C(C1)C#N)CC[S](=O)(=O)CC2=CC=CC=C2""",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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+"""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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+"""675739447E3E5B3B_546FF04807521B6D_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C=CC(=C2)C)OC(F)F""",21,"""B864DAFFF20826F7"""
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+"""1740F30D90CBD4D8_0B1813D040EC31C8_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NN=N[N]2C3CCCCC3""",21,"""B864DAFFF20826F7"""
+"""E8BF416280CD1374_F1476B1F21993FA5_6039_UN""","""O(C1CCC=C(C1)C#N)CCN3N=C2C=CC=CN2C3=O""",21,"""B864DAFFF20826F7"""
+"""A2C0D612C1404BE0_8040CF619CE1FB4A_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=CC2=C([N](N=C2C)C)N=C3""",21,"""B864DAFFF20826F7"""
+"""B2AE018C8610739D_D8207FD6064F9861_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=C2N=CC=CC2=C(F)C=C3""",21,"""B864DAFFF20826F7"""
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+"""C01D6A764FC77B3F_3A1F75651B6D7D74_6039_UN""","""O(C1CCC=C(C1)C#N)CCCOC2=CC(=C(C)C=C2)C""",21,"""B864DAFFF20826F7"""
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+"""5993F45ADDFE726D_A2069C5143D6B485_6039_UN""","""O(C1CCC=C(C1)C#N)CC(N(C(C)C)CC(F)(F)F)=O""",21,"""B864DAFFF20826F7"""
+"""09CBCE29F93ADD01_84D3CE75F5E79BD2_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NC(CCCCCC)C)=O""",21,"""B864DAFFF20826F7"""
+"""DD4D9D2060027EC2_BD0CB4AC0B84D4D8_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CN=C(C(OCC)=O)C=C2""",21,"""B864DAFFF20826F7"""
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+"""B1C43DE832D145C4_0632C43493D2C01B_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(OC)C=C(C=C2)[N](=O)=O""",21,"""B864DAFFF20826F7"""
+"""A18E993E4F63E628_8CDFDD8328639113_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(C=C2)N3CCCC3""",21,"""B864DAFFF20826F7"""
+"""CBD2CB550F6EF171_1EEA6D1CC015D773_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=CC=C(C(OC)=O)O2)=O""",21,"""B864DAFFF20826F7"""
+"""FBAA9ADC8606B33F_3D39AA8492D662D5_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C(C2=NC(=CS2)C)C#N)=O""",21,"""B864DAFFF20826F7"""
+"""E07D479CD33830EB_18236162603F8E78_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC3=C(C=C2)OC(C)(C)C3""",21,"""B864DAFFF20826F7"""
+"""9EE0D8B570DBE1B1_6110C18DF3A81DFF_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)NC2=NC(=NO2)C3CC3""",21,"""B864DAFFF20826F7"""
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+"""CE7CC9C2FD5813AE_59261FC725F0BF77_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(C=C2)[N]3C=CC=N3""",21,"""B864DAFFF20826F7"""
+"""DBE5A9EBBE6D862F_5E2ABDB9C29123FA_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NC(=NO2)C3=NC=NC=C3""",21,"""B864DAFFF20826F7"""
+"""87B97A2B4A84C76B_005A077E2A7363C6_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CSC(=N2)C3=NC=CC=N3""",21,"""B864DAFFF20826F7"""
+"""50B6AA21CF9F03FE_A0FA10E5A740D715_6039_UN""","""O(C1CCC=C(C1)C#N)CC(N(C(C)C)C2CCCC2)=O""",21,"""B864DAFFF20826F7"""
+"""AE503499439272E4_0D9AAA32DC403499_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NCC(NC(C)(C)C)=O)=O""",21,"""B864DAFFF20826F7"""
+"""0F5954AA4D048DFF_3F17FA2878D6707A_6039_UN""","""O(C1CCC=C(C1)C#N)CCCCCCCCCC(O)=O""",21,"""B864DAFFF20826F7"""
+"""13A9CF64BC108E4B_050A083B89D0EAB3_6039_UN""","""O(C1CCC=C(C1)C#N)CCC(C2=C(C=C(F)C=C2)F)=O""",21,"""B864DAFFF20826F7"""
+"""6E5E24291FF26DF3_161B7A2FA2B2BFF0_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C(=C(F)C(=C2F)F)F)F""",21,"""B864DAFFF20826F7"""
+"""A7FECCA304918F41_77184D529401E706_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NC=C(C(OCC)=O)C=C2""",21,"""B864DAFFF20826F7"""
+"""86605C4F72A70AED_E4448C543C291C59_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=CC(=C(C=C2F)F)C)=O""",21,"""B864DAFFF20826F7"""
+"""3B1C75F976E1CFC8_79A9CC73A6E50B1E_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C(OC)=O)C=CN=C2F""",21,"""B864DAFFF20826F7"""
+"""2121C74C7273D38F_DB8AF8411CADE662_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C=C(C(OC)=O)C=C2)F""",21,"""B864DAFFF20826F7"""
+"""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"""
+"""C66418F355D14CE3_44E0AF833A5C5986_6039_DP""","""O(C1CCC=C(C1)C#N)CC(N[C@@H]([C@H](CC)C)C(=O)O)=O""",21,"""B864DAFFF20826F7"""
+"""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"""
+"""C78454FCB8AAEAC0_CE3FDD6C947FD531_6039_UN""","""O(C1CCC=C(C1)C#N)CC3CN=C(C2=C[N](C)N=C2)O3""",21,"""B864DAFFF20826F7"""
+"""F97FC7DA9801E04D_815B1F240CB4E5C5_6039_UN""","""O(C1CCC=C(C1)C#N)CC(COC2=CC=C(F)C=C2)=O""",21,"""B864DAFFF20826F7"""
+"""6D4113BFE73DBF94_0C2E729025C86EFB_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=NC2=C(C=CC=C2)C(=O)N3""",21,"""B864DAFFF20826F7"""
+"""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"""
+"""163623A66AEE7DED_A205BEC55267FB35_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=CC2=C(OC(N2C)=O)C=C3""",21,"""B864DAFFF20826F7"""
+"""72049550CD7771AF_A826E5F05A57EEE5_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=CC(=N2)C(OCC)=O""",21,"""B864DAFFF20826F7"""
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+"""2343A62B36FD3623_3C1C9913D879B3AF_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NC2=C(C)C=CC=C2C)=O""",21,"""B864DAFFF20826F7"""
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+"""D8B965192A5DC2A5_AD94F9E7296D3A78_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)NC2=CC=C(C=C2)C#C""",21,"""B864DAFFF20826F7"""
+"""78DDE425A5A48F27_D129A654962F1646_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C)C=CC(=C2)[S](=O)(=O)F""",21,"""B864DAFFF20826F7"""
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+"""F956D2C91BFE649A_FC9D887A4A0EEAE8_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C)C=CC(=C2)[S](=O)(=O)Cl""",21,"""B864DAFFF20826F7"""
+"""CC2E3B11EECC121E_E593261BD3447F69_6039_UN""","""O(C1CCC=C(C1)C#N)CC3CCC2(CCCCCC2)O3""",21,"""B864DAFFF20826F7"""
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+"""F4D72754EEB1B9AE_C2B6EE366AD82540_6039_UN""","""O(C1CCC=C(C1)C#N)C[C@@H]2CCC[C@@H](C(OCC)=O)O2""",21,"""B864DAFFF20826F7"""
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+"""A91C225C94104E0C_63A6051E8A760FC9_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CSC(=N2)COCC(F)F""",21,"""B864DAFFF20826F7"""
+"""F212D45445CA2FBC_8F029647E9E1896F_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=CSC(=N2)C(C)(C)C)=O""",21,"""B864DAFFF20826F7"""
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+"""E59215089A12CFAB_6A7B407F7A73ED88_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)NC(=O)C2=CC=CC=C2""",21,"""B864DAFFF20826F7"""
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+"""DF09F787CAF82465_CAA21380D67D799B_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=C(C=C2)[N](=O)=O)OC""",21,"""B864DAFFF20826F7"""
+"""2C6009E63737C51C_5ED9B1298109ABD7_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(N[S](C)(=O)=O)C=C2""",21,"""B864DAFFF20826F7"""
+"""F1DF7DC61CDC2097_D522B294B2221E20_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NN=N[N]2C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
+"""3B37F678DA37AC97_7CFAAFDA61F53C29_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NC=C(S2)C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
+"""E44A3610B2FF2F55_08F639F5C56DDB14_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=C(OC)C=CC(=C2)C)=O""",21,"""B864DAFFF20826F7"""
+"""56DFE20DE98F850C_E2BC4248DC1A61C6_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)N2CCOCC2C3CC3""",21,"""B864DAFFF20826F7"""
+"""EEEB2894A68DC864_BCA1849756DEDA31_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C3=CC2=C(C=CC=C2)O3""",21,"""B864DAFFF20826F7"""
+"""CD5573E85CA23A87_5A6E1A870DA2A6CB_6039_UN""","""O(C1CCC=C(C1)C#N)CCOC2=C(C(C)=O)C=CC=C2""",21,"""B864DAFFF20826F7"""
+"""F3BFAF06725BDE89_3117A35912BA43C6_6039_UN""","""O(C1CCC=C(C1)C#N)CC=NNC(=O)C2=CC=CC=C2""",21,"""B864DAFFF20826F7"""
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+"""90C63A3D47F44E8C_D4BC80D8979E42CF_6039_UN""","""O(C1CCC=C(C1)C#N)CCC(=O)NC2=C(C=CS2)C#N""",21,"""B864DAFFF20826F7"""
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+"""5C7CC7A4976B8E75_45988C0E47D80DB1_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NCCCC(OCC)=O)=O""",21,"""B864DAFFF20826F7"""
+"""0901EB4F8F3227F5_40893D582028680F_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(C=C2)[N]3C=NC=C3""",21,"""B864DAFFF20826F7"""
+"""1FCAD6C3B7B2B090_30BC2D6DC66F0549_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(OC(F)(F)F)C=C2""",21,"""B864DAFFF20826F7"""
+"""A5B390CF9DDC28B2_F366B5BC670CCB18_6039_UN""","""O(C1CCC=C(C1)C#N)CCCOC2=C(C=CC(=C2)C)C""",21,"""B864DAFFF20826F7"""
+"""756C1C1990EBB352_7E5CC37C438375D3_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NCC2=C(C)C=CC=C2)=O""",21,"""B864DAFFF20826F7"""
+"""60757AD06EF6EA85_FB21182DD59425A2_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=C(C(OC)=O)C=C2)C""",21,"""B864DAFFF20826F7"""
+"""4DE1F9FF9C36EE31_22024B8894E86605_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=N[N](C(=C2[S](=O)(=O)N)C)C""",21,"""B864DAFFF20826F7"""
+"""93D185A2941DF50E_FBFFBF35DBEF09FA_6039_DP""","""O(C1CCC=C(C1)C#N)C[C@@H]2C[C@](OC)(CN2)C(F)(F)F""",21,"""B864DAFFF20826F7"""
+"""0461165D2D262641_07E4CE5E981A539A_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NC2=C([N](N=C2C)C)C)=O""",21,"""B864DAFFF20826F7"""
+"""9A2DEF1724FE2DEA_29923A2929EDE050_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NN=C(O2)C3CCOCC3""",21,"""B864DAFFF20826F7"""
+"""C4A0E9D33C773276_E18F7E9F2233C6F4_6039_UN""","""O(C1CCC=C(C1)C#N)CCC(C(F)F)N2CCOCC2""",21,"""B864DAFFF20826F7"""
+"""FF6E6A84F45175FF_92464CBC5F921A7D_6039_UN""","""O(C1CCC=C(C1)C#N)CC(N(CCOC)CCOC)=O""",21,"""B864DAFFF20826F7"""
+"""F4123B44394ACDE4_CF4409565AACC2F2_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NOC(=N2)N3CCOCC3""",21,"""B864DAFFF20826F7"""
+"""C6C43A75810B502D_DA3209B4F3C4C4D1_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(C=C2)C3CCCC3""",21,"""B864DAFFF20826F7"""
+"""8BF26F024A7909F3_AEC063A0737DD704_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NC(=NS2)C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
+"""3022027C27B19A33_73864C1806145F37_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=CC(=C2)OC(C)=O)C""",21,"""B864DAFFF20826F7"""
+"""487C8FF816B2982C_C40E9C3DFAEC777D_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=CC=C2)OCC3CC3""",21,"""B864DAFFF20826F7"""
+"""EFA2D9ED5540B7C2_5AD1DE0C2229DDEB_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=NC2=C(CCCC2)C(=O)N3""",21,"""B864DAFFF20826F7"""
+"""52EA3F217B07F25B_D8709245325C15C1_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C3=CC2=C(C=CC=C2)[NH]3""",21,"""B864DAFFF20826F7"""
+"""07718B1CD4BF0521_86606634396FD120_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=NC2=C(CC(C)(CC2)C)S3""",21,"""B864DAFFF20826F7"""
+"""AD788062A1F708D7_B7F25D9660D857A1_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C2=CN=C3N=CC=C[N]23""",21,"""B864DAFFF20826F7"""
+"""6F2FDE6C17E2B06F_BE533AFC47F41439_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=C[N](C)N=C2C(F)F)=O""",21,"""B864DAFFF20826F7"""
+"""EDD76EC78CE6C6B2_15A7983B4DD4DA25_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C3=CC2=C(C=CC=C2)S3""",21,"""B864DAFFF20826F7"""
+"""15AB58AAE115CDE5_014388392FB4A679_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C2=CN=C3[N]2C=CC=C3""",21,"""B864DAFFF20826F7"""
+"""1FBA40631EAFD47B_79501497B2DE897C_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NN=C([N]2C)C3=CC=CS3""",21,"""B864DAFFF20826F7"""
+"""57B89149748E2EAF_4825B55D3E6EA711_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C2=CC3=C(C=C2)OCO3""",21,"""B864DAFFF20826F7"""
+"""EEF3A2376A1D1481_ED44DC0B2E1A9844_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=C(C(OC)=O)N=C2)F""",21,"""B864DAFFF20826F7"""
+"""6E08F282A4657683_53F7CB513071C189_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2=CSC(=C2)C(OC)=O)=O""",21,"""B864DAFFF20826F7"""
+"""C8E7C4B3A820135E_59A5D061C16DB3F7_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=CC3=C2OC(C)(C)C3""",21,"""B864DAFFF20826F7"""
+"""62768FB43060F1D1_96C8DD127EDA990B_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=C(C=C2)C)C(OC)=O""",21,"""B864DAFFF20826F7"""
+"""7AD966A533749A48_A622C3A2AAFC66AC_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NC=N[N]2C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
+"""FDE5C0741689E419_B5FD63FC2D1BCB48_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=NC2=C(C=C(OC)C=C2)S3""",21,"""B864DAFFF20826F7"""
+"""0D7ADCC80C4223AD_20EAEED376CBC483_6039_UN""","""O(C1CCC=C(C1)C#N)CCC(C)OCC2=CC=CC=C2""",21,"""B864DAFFF20826F7"""
+"""E273650BF1B938F4_CC00A42CCD325AE5_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NN=C[N]2C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
+"""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"""
+"""4F1AC35422639A09_D15B37EDA8B61341_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C=CC(=C2)F)C(F)(F)F""",21,"""B864DAFFF20826F7"""
+"""0DB76D1AECE970D8_922DB963216DD3E0_6039_UN""","""O(C1CCC=C(C1)C#N)CCC2=CC=C(NC(C)=O)C=C2""",21,"""B864DAFFF20826F7"""
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+"""C66B6DAB40AFAE98_C9366F4EFEBC8731_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=C(CNC(C)=O)C=C2""",21,"""B864DAFFF20826F7"""
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+"""E02118B17F15726D_0BAA0BD856C2A9A1_6039_UN""","""O(C1CCC=C(C1)C#N)CCC2=NOC3=C2C=CC(=C3)F""",21,"""B864DAFFF20826F7"""
+"""4C54D00D1D5CDC52_503E4DCBC0EC08BD_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)N3CC2=C(C=CC=C2)C3""",21,"""B864DAFFF20826F7"""
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+"""2451C4320EFB9D56_5B1E646CA17C4FF8_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=NC(=N2)CC3CC3)C""",21,"""B864DAFFF20826F7"""
+"""424F7C7AFF2C3E0B_6021F20923A98161_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=NC(=N2)C3CCC3)C""",21,"""B864DAFFF20826F7"""
+"""2459CCD0DA0636F9_2D96A6EBFFDACBFD_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=NC(=N2)C(F)(F)F)C""",21,"""B864DAFFF20826F7"""
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+"""4BAD4C2AC2D28B6B_1D5CDAF89255CB94_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C(CC(OCC)=O)(C)C)=O""",21,"""B864DAFFF20826F7"""
+"""6875257B003F7271_87B998DEA27369E9_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C(OCC)=O)C=N[N]2C""",21,"""B864DAFFF20826F7"""
+"""BA40CA3BE1FEA978_0845B49C54713AF8_6039_UN""","""O(C1CCC=C(C1)C#N)CC[N]2N=C(C(OC)=O)C=C2C""",21,"""B864DAFFF20826F7"""
+"""4D00129E8AA6871F_F446AB4DAAF36FA5_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C2CCCC3=C2C=CS3""",21,"""B864DAFFF20826F7"""
+"""BB280A7A799B79EA_79A6C5B81ADA67ED_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NC=C(O2)C3CCCCC3""",21,"""B864DAFFF20826F7"""
+"""E6706BF9A658263E_0B96071C0B5D943A_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=NC3=C([N]2CC)C=CC=C3""",21,"""B864DAFFF20826F7"""
+"""3B3F6DE9BFB5018A_8E66EE2B6CC193F0_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C)C=C(C=C2)CC(=O)O""",21,"""B864DAFFF20826F7"""
+"""1BBF9C691C2A8A4A_CB0C8F313935D8A0_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC(=NC(=N2)C3CC3C)C""",21,"""B864DAFFF20826F7"""
+"""B3C19602BCF390BF_9D8DA6C40327DCE4_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(CC)C=CC(=C2)[N](=O)=O""",21,"""B864DAFFF20826F7"""
+"""AC5F33542742A424_E2E601CE3C6A8E20_6039_UN""","""O(C1CCC=C(C1)C#N)CC(C2CCCN(C(C)=O)C2)=O""",21,"""B864DAFFF20826F7"""
+"""384AE0C4F96C4967_CAA364EF2A7DEB94_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(F)C=CC3=C2N=CC=C3""",21,"""B864DAFFF20826F7"""
+"""0C038EE926640518_85F7BCFD1A7A13BB_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CSC(=N2)COC3CCC3""",21,"""B864DAFFF20826F7"""
+"""E02F53708B6819A0_DB44FCB15B522607_6039_UN""","""O(C1CCC=C(C1)C#N)CC3=NC2=C(C(=CC(=C2)F)F)[NH]3""",21,"""B864DAFFF20826F7"""
+"""15AB58AAE115CDE5_BFBBD80C0C0B7B1B_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)C2=CN=C3C=CC=C[N]23""",21,"""B864DAFFF20826F7"""
+"""A689EF25211B3DD6_DCD0D6B930A48E89_6039_UN""","""O(C1CCC=C(C1)C#N)CC(F)(F)C(=O)C2=CC=CC=C2""",21,"""B864DAFFF20826F7"""
+"""C8805565E8CA0913_B982DB06FAD2B623_6039_UN""","""O(C1CCC=C(C1)C#N)CC(CC2=C(OC)C=CC=C2)=O""",21,"""B864DAFFF20826F7"""
+"""58CD233CAA356BD2_8B7A01D062DE2DDF_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CN=C(C=C2)[N]3C=CC=N3""",21,"""B864DAFFF20826F7"""
+"""3F0F1AE08A13FD5D_7C9938E71E201FF0_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NC2(C)CC[S](=O)(=O)C2)=O""",21,"""B864DAFFF20826F7"""
+"""EBB2E455E57CC0BC_952B5C613EE1149E_6039_UN""","""O(C1CCC=C(C1)C#N)CCC(C2=CC=C(CC)C=C2)=O""",21,"""B864DAFFF20826F7"""
+"""18F0E38C5D026481_9C2797085A11DBA2_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=N[S](=O)(=O)C3=C2C=CC=C3""",21,"""B864DAFFF20826F7"""
+"""9CCFC9C20F780299_240D53DC52546434_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)NC2CCCCNC2=O""",21,"""B864DAFFF20826F7"""
+"""5352D0F7DF20E766_1844F9D268836868_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NC2=CC(=C(C)C=C2)F)=O""",21,"""B864DAFFF20826F7"""
+"""B858930416FA6494_15ACB2F4C4D5239E_6039_UN""","""O(C1CCC=C(C1)C#N)CC(NC2=NC=C([N](=O)=O)S2)=O""",21,"""B864DAFFF20826F7"""
+"""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"""
+"""F605E03FFE6EAA31_35992F95C7EE8534_6039_UN""","""O(C1CCC=C(C1)C#N)CCCCC[N]2N=C(C)N=C2C""",21,"""B864DAFFF20826F7"""
+"""8E2404BF59C3A8B1_679D30A2FC05A771_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C=C([N](=O)=O)C=C2F)F""",21,"""B864DAFFF20826F7"""
+"""26C921E880024D70_B152D6281A3CAA12_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CN=C([NH]2)C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
+"""1033B17331821D88_E754562B83EAC26C_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CSC(=N2)C3=C[N](C)N=C3""",21,"""B864DAFFF20826F7"""
+"""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"""
+"""FA0E3E8AC90FF8B7_E7A30632E59F6461_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=CC=CC(=C2)SC(F)(F)F""",21,"""B864DAFFF20826F7"""
+"""27E21D05E81DAFE4_5A502BE5C40E8F30_6039_UN""","""O(C1CCC=C(C1)C#N)CC(OC)CC2=CC=C(C=C2)F""",21,"""B864DAFFF20826F7"""
+"""EA8CF2A1F0A1CB39_89B6B337DFD65AB8_6039_UN""","""O(C1CCC=C(C1)C#N)CC2=C(C(C)(C)C#N)C=CC=C2""",21,"""B864DAFFF20826F7"""
+"""D97E92FED36B8DB6_B6930C562C5E136C_6039_UN""","""O(C1CCC=C(C1)C#N)CC(N(C)C2=CC=C(C=C2)C)=O""",21,"""B864DAFFF20826F7"""
+"""1CFB97673A82B25E_06C4B272F6A0A1EF_6039_UN""","""O(C1CCC=C(C1)C#N)CC(=O)[C@@H]2C[C@H]2C3=CC=CC=C3""",21,"""B864DAFFF20826F7"""
+"""B063A97E035030C0_BFA4B17CB61E2C27_6039_UN""","""O(C1CCC=C(C1)C#N)CCCCCCCCCN=[N]#N""",21,"""B864DAFFF20826F7"""
+"""D45DE05AE30957CA_55474A610BBF2DA5_6039_DP""","""CCOC(=O)CC(OCC1=CC=C(C(N)=O)C=C1)[C@@H](C)N""",21,"""E733131475C656A8"""
+"""9E391FA6B041269E_E82C6A8437273DF9_6039_DP""","""CCOC(=O)CC(OCC1=C(F)C=CC(=C1)C#N)[C@@H](C)N""",21,"""E733131475C656A8"""
+"""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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+"""80C8C3371573478B_AF9A2D24059C2F79_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCCC(N(C)C)=O""",21,"""FED139B8B8BC70B5"""
+"""4FD9C3224A79EA36_3A26F31CD42B7EC6_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(=O)NCC2CCC2""",21,"""FED139B8B8BC70B5"""
+"""A69A6B1DA36AAF40_ECAB232CBB873933_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(C2=C[N](C)N=C2)=O""",21,"""FED139B8B8BC70B5"""
+"""C8BCA0C525AB0402_647A1D582F1120A2_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC[S](N(C)C)(=O)=O""",21,"""FED139B8B8BC70B5"""
+"""AEE9EA67C30FF90C_480A4E7161262386_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=N[N](C(C)C)C=C2""",21,"""FED139B8B8BC70B5"""
+"""B38F9FFB6C06953E_320ED779C80CEE3E_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(C)C=CC=C2C""",21,"""FED139B8B8BC70B5"""
+"""F4805493E8502905_B0963D971686E79B_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC=CC(=N2)OC""",21,"""FED139B8B8BC70B5"""
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+"""C789A62B2E03E8D2_F8BD4F2DFD937C96_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CN=C(OC)C=C2""",21,"""FED139B8B8BC70B5"""
+"""DDDACCB27340B5D3_255C0E6C94541ADB_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2ON=C(C(C)C)C2""",21,"""FED139B8B8BC70B5"""
+"""79F5EE9B222AD6E2_DF8CC11C7CE602FB_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2COC(C)(C)O2""",21,"""FED139B8B8BC70B5"""
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+"""E6A0268847987926_E5011207A7FE438A_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(OC)N=CC=C2""",21,"""FED139B8B8BC70B5"""
+"""D6963D7F7BBDB5D8_E6882E524AC952BD_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCOCC2CCCO2""",21,"""FED139B8B8BC70B5"""
+"""CDDE6F452BFB5627_B1CF3B942ADE7B03_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCC2=C(C)N=CS2""",21,"""FED139B8B8BC70B5"""
+"""8C5D240F4C8C9C5C_97E16D732F211931_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCN2CCC(C)CC2""",21,"""FED139B8B8BC70B5"""
+"""A9E7CF66CA1AC7E6_ECF269AE02D4D8A0_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC[S](C(C)C)(=O)=O""",21,"""FED139B8B8BC70B5"""
+"""B5E5C6DDE2E5C779_E47DA05FFC750C11_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NN=C([N]2CC)C""",21,"""FED139B8B8BC70B5"""
+"""FD5220BC161BF542_89B5046045BDFC98_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(=O)C2CCOCC2""",21,"""FED139B8B8BC70B5"""
+"""9A3CA7948A13ACE9_4124E5E924A3F3DE_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCN2CCCCC2""",21,"""FED139B8B8BC70B5"""
+"""F1615E9FA220136F_F6B43954BDB0AC3D_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCC2=NN=C(C)O2""",21,"""FED139B8B8BC70B5"""
+"""06FC58BBA1FF2C3C_429E647ABA0D8775_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCCN(CC)CC""",21,"""FED139B8B8BC70B5"""
+"""DD7A6EA7C03756A9_14373BEDF88BFE77_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCN2CCC[S]2(=O)=O""",21,"""FED139B8B8BC70B5"""
+"""1F42DF18C72F0A77_AE3FE4CAE1761917_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(N(C)CC2CC2)=O""",21,"""FED139B8B8BC70B5"""
+"""851D7E3D2177927C_A7670D56403830A7_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(C2=CC=C[N]2C)=O""",21,"""FED139B8B8BC70B5"""
+"""F738081846442BDA_DD8EE04FA470FF96_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC(NC(NC)=O)=O""",21,"""FED139B8B8BC70B5"""
+"""35F74EA58B68AAF5_C68B5659B378F413_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NC=C(C(C)C)O2""",21,"""FED139B8B8BC70B5"""
+"""20D211525419CF1A_C6FB89DACFAF4F35_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(ON=C2)C3CC3""",21,"""FED139B8B8BC70B5"""
+"""417FE4A2D9A9AE0B_185965FD3AC2C79A_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(N2CCNCC2)=O""",21,"""FED139B8B8BC70B5"""
+"""778F753993DCBEB3_4FAF2D7D5E7F65A9_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OC[C@H]2NC(O[C@@H]2C)(C)C""",21,"""FED139B8B8BC70B5"""
+"""97D115BE9E1AAF63_F49BA4E75C2B4362_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(NCCCCC)=O""",21,"""FED139B8B8BC70B5"""
+"""D9849D5FED5230E8_49987101D866182B_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(C2=C[N](C)C=C2)=O""",21,"""FED139B8B8BC70B5"""
+"""15EF76FFD123792E_22FDFFAEEA5BC7E6_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CSC(=N2)COC""",21,"""FED139B8B8BC70B5"""
+"""37590358D56D4ED1_6B231A15C97A1F27_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2=C(ON=C2C)C""",21,"""FED139B8B8BC70B5"""
+"""C6695618EA63BAC2_BCE07D555CE9B06B_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NN=C(O2)C3CC3""",21,"""FED139B8B8BC70B5"""
+"""D953C67356EA7D42_5645506BC090CFB2_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCN[S](CC)(=O)=O""",21,"""FED139B8B8BC70B5"""
+"""059E0E4C5EA8D39E_6EF9305105CB3D7E_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC(=C(F)C=C2)F""",21,"""FED139B8B8BC70B5"""
+"""41E9C272CD03DE49_875241DC117F2F97_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC[N]2C=CN=C2C""",21,"""FED139B8B8BC70B5"""
+"""1312B422C6B25D24_288743B3BB82FC9C_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(OC)C=CC=C2""",21,"""FED139B8B8BC70B5"""
+"""AE6E26DE0F53ED64_D915E38B71BBE8AC_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCOCC(OCC)=O""",21,"""FED139B8B8BC70B5"""
+"""B7F425B09E6350C4_B7451A0BEAF523BE_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC[N]2N=C(C)N=C2C""",21,"""FED139B8B8BC70B5"""
+"""34660A98290C97F6_04CB03199C5D8995_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(ON=C2CC)C""",21,"""FED139B8B8BC70B5"""
+"""DFC694237B7AE952_C33C867BD83E6E60_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(OC=N2)C3CC3""",21,"""FED139B8B8BC70B5"""
+"""B6C8464E847472A4_D522C06318D61991_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCN2CCN(C)CC2""",21,"""FED139B8B8BC70B5"""
+"""49FC756F1E1EDF72_1F33995FF85A4374_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(C(C)C)OC=N2""",21,"""FED139B8B8BC70B5"""
+"""B727A83FE5EC4DFC_31B00736163E111F_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCN2C(C=CC=C2)=O""",21,"""FED139B8B8BC70B5"""
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+"""B97A2DE311562E62_1BA234588C2913A2_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCC(C(OC)=O)=O""",21,"""FED139B8B8BC70B5"""
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+"""89F279C68D45B999_570DEC701B9018AA_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=N[N](CC)N=C2C""",21,"""FED139B8B8BC70B5"""
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+"""937030B3BB075196_C282077918134C61_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(C=CC(=C2)C)F""",21,"""FED139B8B8BC70B5"""
+"""C4F117A7A9709585_3ABDA1C0A9B58A69_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(C2=CN=N[N]2C)=O""",21,"""FED139B8B8BC70B5"""
+"""8B16414490005866_32EB35F88D411503_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NC=N[N]2CCC""",21,"""FED139B8B8BC70B5"""
+"""9F277F34FBBEED5E_5EA7834998B4B595_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCC2CCOCC2""",21,"""FED139B8B8BC70B5"""
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+"""2C85EDC64BD93239_B938E628E6933141_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(C=CC(=C2)C)C""",21,"""FED139B8B8BC70B5"""
+"""B8F62F88E60E9EBA_A38D22DE70646F8B_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=N[NH]C(=N2)C(C)C""",21,"""FED139B8B8BC70B5"""
+"""7534A3C478C2FD1C_FDD0F8866A293BD6_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2=C(F)C=CC=C2""",21,"""FED139B8B8BC70B5"""
+"""EE146E2024F1304A_D0306610BEE004D1_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC(=NC(=N2)C)C""",21,"""FED139B8B8BC70B5"""
+"""A0899C67B447D6D6_71B4EC0B64428ACE_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NC=CC(=C2)C#N""",21,"""FED139B8B8BC70B5"""
+"""9C30244B57A17163_13B41571A0963533_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC(=C(C)C=C2)F""",21,"""FED139B8B8BC70B5"""
+"""4AE1DFFA4076E4DC_D0751E860ED02731_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NC(=N[NH]2)C3CC3""",21,"""FED139B8B8BC70B5"""
+"""6873DDAFAA7F24C9_30D86C730CCD189C_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NSC(=N2)N(C)C""",21,"""FED139B8B8BC70B5"""
+"""9783BBD50C1191C9_3872CA2D62529911_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(=O)C2=CN=CC=C2""",21,"""FED139B8B8BC70B5"""
+"""C7D7CAA1074F4540_2789BD997C10F47D_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCCC(OCC)=O""",21,"""FED139B8B8BC70B5"""
+"""69688FC11ADC4327_237E95A9B29F76E0_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCC2=NC(=NO2)C""",21,"""FED139B8B8BC70B5"""
+"""2D5882EA485ADF6A_976AFAA9E8EEBE29_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NOC(=N2)C3CC3""",21,"""FED139B8B8BC70B5"""
+"""F30EA8A0E8DF425A_E35538D3DB7140D4_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCOC2CCCCO2""",21,"""FED139B8B8BC70B5"""
+"""36ABD49B7334F868_2D74296E3F978F79_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCSC2=CC=CC=C2""",21,"""FED139B8B8BC70B5"""
+"""A14C0B47CEF21659_824EDC6019F1FCB9_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(=O)CC2CCCO2""",21,"""FED139B8B8BC70B5"""
+"""E54D1642843FB2F6_B027C59AEA7FD480_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCOCC2CCCC2""",21,"""FED139B8B8BC70B5"""
+"""8578F87C1F834C21_E5632F6A847AD22C_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(N=N[N]2CC)C""",21,"""FED139B8B8BC70B5"""
+"""76C673DF576E5A0E_AC7BE5FE26E6E00B_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC=CC(=C2F)F""",21,"""FED139B8B8BC70B5"""
+"""C8D7DEE34EAA9271_38EE9882B7F853D6_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NC=C(C=N2)C#N""",21,"""FED139B8B8BC70B5"""
+"""967951F1B0FEE315_FC96BCAADC61475C_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCNC(NC(C)C)=O""",21,"""FED139B8B8BC70B5"""
+"""187A2A9CADB01DE7_4617B4ED5AC92989_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCC2=CN=C[N]2C""",21,"""FED139B8B8BC70B5"""
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+"""0C425D098CAE30BB_FF8F88D370DD184E_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(NC(C(C)C)C)=O""",21,"""FED139B8B8BC70B5"""
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+"""83950746E989C598_18A7548B43032491_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CSC(=N2)C(C)C""",21,"""FED139B8B8BC70B5"""
+"""437F6BE5804ED347_CF06D6DB89601BC6_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NC(=C(S2)C)OC""",21,"""FED139B8B8BC70B5"""
+"""D0099DCC488337F9_57648C1783B81EF9_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NC(=CC(=C2)C)C""",21,"""FED139B8B8BC70B5"""
+"""DE8B1528EF131BE3_E7EE5990E04C10E7_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C[N](CCF)N=C2""",21,"""FED139B8B8BC70B5"""
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+"""187CD6ABD8BCC7C3_14E41C6573F93FB0_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC(COC)COC""",21,"""FED139B8B8BC70B5"""
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+"""A226374F1D9033E0_35AAF3F64002C2C3_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCC2CCCCC2""",21,"""FED139B8B8BC70B5"""
+"""26BF39A5E0EE171F_F4F4D024DCA66A15_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2CC3CCC2C3""",21,"""FED139B8B8BC70B5"""
+"""5BA1C6D7EB6AED9D_8E9105A502B3E52B_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC3CCC2(COC2)O3""",21,"""FED139B8B8BC70B5"""
+"""E3314E92A5E42EA0_77D5EB0F004A2625_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(F)C=NC=C2F""",21,"""FED139B8B8BC70B5"""
+"""EB0D1FD188863614_242499145A68E244_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2(C(O)=O)CCC2""",21,"""FED139B8B8BC70B5"""
+"""BC8346477270FDD9_C8DA70496A9F7941_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(CF)C=CC=C2""",21,"""FED139B8B8BC70B5"""
+"""2892DF9839F4407D_4F352C9C03527912_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCOC2CCSCC2""",21,"""FED139B8B8BC70B5"""
+"""ABC5E303F893D44B_17CEE2CDC03C0EE1_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(C(OCC)=O)(F)F""",21,"""FED139B8B8BC70B5"""
+"""983279305CC29F10_4A9DF9643389C102_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CON=C2C(C)C""",21,"""FED139B8B8BC70B5"""
+"""E3A7C4B7758637A3_B10EB8E1A3F0B776_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CON=C2C3CC3""",21,"""FED139B8B8BC70B5"""
+"""711B8AA651179BDF_3B7E6BCCB0B967A4_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2=CN=CC(=C2)F""",21,"""FED139B8B8BC70B5"""
+"""7AB58F119B353EAF_1E23F49CE8DB67A2_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2OCCC23CCC3""",21,"""FED139B8B8BC70B5"""
+"""37CE115E1F139463_866EBCE5373FDFA0_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(C=C(C)C=C2)F""",21,"""FED139B8B8BC70B5"""
+"""614D7BC2E603E4BD_C4BB3344CA47EBD0_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(=O)C2CCCCO2""",21,"""FED139B8B8BC70B5"""
+"""B00C7C4F0AB79DF9_5D4F9A496C5EAFC2_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(=O)C2=CC=NC=C2""",21,"""FED139B8B8BC70B5"""
+"""12EF7C9CCCDE2567_DE00BD3E0A2A233A_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2N(C)[S](CC2)(=O)=O""",21,"""FED139B8B8BC70B5"""
+"""FF1A83216558C4D6_0ADD3438B910A982_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCOC2(CCC2)C#N""",21,"""FED139B8B8BC70B5"""
+"""40C3065C05CE433A_8BA584C9C935E90F_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2NC(CC2(C)C)=O""",21,"""FED139B8B8BC70B5"""
+"""A1A37D050BD87004_1AB0D3353A485788_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2OCC3CCOC23""",21,"""FED139B8B8BC70B5"""
+"""A0EBCF0FC689150E_E5C531152266EEB9_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2COCC(C)(C)O2""",21,"""FED139B8B8BC70B5"""
+"""177EED615167E439_DB762900ABF2405D_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2OCCC23CNC3""",21,"""FED139B8B8BC70B5"""
+"""BC717F2256887C74_69506AA8EED3EDCA_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OC[C@@H]3C[C@H]2COC[C@H]2O3""",21,"""FED139B8B8BC70B5"""
+"""5969A1A60C6D5338_E7344FC9C792F7CF_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC#CC2CCCCC2""",21,"""FED139B8B8BC70B5"""
+"""DDB8A38C565F03E9_721E8748077D309A_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCSC2CCOCC2""",21,"""FED139B8B8BC70B5"""
+"""EA8E12EC7B34AC71_BB1FDB1B2F1E10C6_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NC=C[N]2C(C)C""",21,"""FED139B8B8BC70B5"""
+"""0E1B7DC0DC0F3F28_3B63D20A1E78D96D_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC(OCC)OCC""",21,"""FED139B8B8BC70B5"""
+"""E98F02F5135E50B1_A212D29604B8E8AB_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2CCCC(C)C2""",21,"""FED139B8B8BC70B5"""
+"""4DC25DD768D8FAEB_2B05411C4D8826A7_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NC=C(O2)C3CC3""",21,"""FED139B8B8BC70B5"""
+"""3F228FD1F640B866_EFC0266023B6FC04_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC(=NC=C2)OC""",21,"""FED139B8B8BC70B5"""
+"""45D475C7FC647CA9_ACEB65EA81823EE8_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NN=C(CC)[N]2C""",21,"""FED139B8B8BC70B5"""
+"""36712D9335F4F029_7B1E4310B50C1342_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CN=C(N(C)C)S2""",21,"""FED139B8B8BC70B5"""
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+"""C9591905C2CA55A5_828503128BF32994_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2=C[N](CC)N=C2""",21,"""FED139B8B8BC70B5"""
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+"""252F97E106ABE655_AB1C6A261D772151_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCCC[S](Cl)(=O)=O""",21,"""FED139B8B8BC70B5"""
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+"""EC99200C5868CECC_5E74DDB8CB7AF098_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CN=C(C(C)C)S2""",21,"""FED139B8B8BC70B5"""
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+"""20AE37095BFE6C76_4DF0B07D799B638F_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC(=C(C=C2)F)C""",21,"""FED139B8B8BC70B5"""
+"""2D08DF61D9841586_0F59E5E8654447FE_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2N(C)CC(C2)(C)C""",21,"""FED139B8B8BC70B5"""
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+"""81A361E775BE78D8_519F22BE368EC498_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC(=O)N2CCCC2""",21,"""FED139B8B8BC70B5"""
+"""B00BA0A0CE250654_31F676DA6C3C5CBE_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC(=CC=C2)C#C""",21,"""FED139B8B8BC70B5"""
+"""5F9BADF69D2933E2_9CCAF97689E53BA9_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC([C@@H](N)C(C)(C)C)=O""",21,"""FED139B8B8BC70B5"""
+"""98515F03F1158C23_2130A28572773375_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCN2CCNCC2""",21,"""FED139B8B8BC70B5"""
+"""D24579E541A6D152_A320068D38669732_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NOC(=C2)COC""",21,"""FED139B8B8BC70B5"""
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+"""BB38EBEE0303B224_9F30EFA55F2FCF4C_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2(CC2)[S](=O)(=O)Cl""",21,"""FED139B8B8BC70B5"""
+"""9EEF9E562FF02824_A0232F19C3C932BE_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCOC2CCNCC2""",21,"""FED139B8B8BC70B5"""
+"""BAC8BDB380B928FE_A66ECA8C7C9EAB9B_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC(N(CC)CC)=O""",21,"""FED139B8B8BC70B5"""
+"""868514B5B0F7C8E2_F98766BA71CBFF54_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(NC(CC)(C)C)=O""",21,"""FED139B8B8BC70B5"""
+"""C1F152D0DF235FC5_768F6780541D8322_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2=C[N](CC)N=N2""",21,"""FED139B8B8BC70B5"""
+"""864DC82F986729E7_BEDBE1D87206D6EE_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2=CC=CC(=C2)C""",21,"""FED139B8B8BC70B5"""
+"""10A101E5B02EC391_3B86667EEFA926F5_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCN(C)CC(F)(F)F""",21,"""FED139B8B8BC70B5"""
+"""106D6AC2A3F2FE52_FDEA8A0BB2397029_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCN2CC(C(C)C2)C""",21,"""FED139B8B8BC70B5"""
+"""DFE85D0464C06B39_EF4B2BB324262283_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=N[NH]C(=C2)C(C)C""",21,"""FED139B8B8BC70B5"""
+"""C0B096AE528B8D6A_335E1C58E70B3654_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCN2C[C@H]([C@@H](C)C2)C""",21,"""FED139B8B8BC70B5"""
+"""8CA8C3C6D3E413D6_8808E062730A9C59_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(C2=C[N](C)C=N2)=O""",21,"""FED139B8B8BC70B5"""
+"""E1CB1C7DD660E138_0B89637423254367_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(OC)C=CC=N2""",21,"""FED139B8B8BC70B5"""
+"""AF26D281EB249F11_C3944F92EC4C1B2D_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(N=CC(=C2)C)F""",21,"""FED139B8B8BC70B5"""
+"""0D5A37A849EBCAEC_FF30A30E0386222E_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCN2CC(F)(CC2)F""",21,"""FED139B8B8BC70B5"""
+"""A8DF9DEBE4BD3C00_FE69083DD2F66EC9_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC(=NC=C2)C#N""",21,"""FED139B8B8BC70B5"""
+"""EE5E52D005C46FF6_CB74C5DBC7945851_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCOC(C)(C)C(=O)O""",21,"""FED139B8B8BC70B5"""
+"""E73EBFE0D3C588CE_F710466DF0D29A48_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC3CC2OCCC2O3""",21,"""FED139B8B8BC70B5"""
+"""0D76A831922CB67E_629A16769096690D_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(C2=CC=C(C)O2)=O""",21,"""FED139B8B8BC70B5"""
+"""6FBE09DD82BD9AD4_0435728629FC89ED_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCCC2(C(O)=O)CC2""",21,"""FED139B8B8BC70B5"""
+"""F75035502183F7D1_CFD0FC5E0ADA006B_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(COC)OC=N2""",21,"""FED139B8B8BC70B5"""
+"""EDB113D9B339F54E_B919A34FB57EA9B6_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2CC(C)(C)OC2""",21,"""FED139B8B8BC70B5"""
+"""0177355C1D51D136_B3C23C9101D39DAC_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2NC(=O)NC2=O""",21,"""FED139B8B8BC70B5"""
+"""8B3A8254CA44AABC_7B35E104D1BB8A4E_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NO[C@@H]3COC[C@H]23""",21,"""FED139B8B8BC70B5"""
+"""ADE8299BFAB8C2F9_4F7971F460C4EE2D_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(C2CCCNC2)=O""",21,"""FED139B8B8BC70B5"""
+"""4CB1092694B23C1A_DC0EABD215916B2E_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC(=NO2)COC""",21,"""FED139B8B8BC70B5"""
+"""A7F477E0084FFA5B_BA3F46286AB4C6C7_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NOC(C(O)=O)C2""",21,"""FED139B8B8BC70B5"""
+"""180A1FB03103C7C9_8B05CCA0B7EA80D0_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC(=NC=N2)OC""",21,"""FED139B8B8BC70B5"""
+"""839C05AA9964253C_BD78C942AEE3329E_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(CCN)OC=N2""",21,"""FED139B8B8BC70B5"""
+"""AACD17CE61BE6307_D8663AB426CB197D_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCCC2=CN=C(C)C=C2""",21,"""FED139B8B8BC70B5"""
+"""4DE5F278B508A3DA_2EC9FEFCD5ED7025_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=C(C)C=C(N=C2)F""",21,"""FED139B8B8BC70B5"""
+"""75BC6487A5F5325A_F6396300728A9DC2_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2CNC(CO2)(C)C""",21,"""FED139B8B8BC70B5"""
+"""E2F9B5D7BCEDD915_677C4C1EA16B172B_6039_DP""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC(C2CCNCC2)F""",21,"""FED139B8B8BC70B5"""
+"""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"""
+"""22273298A198B2CF_DC7F5B5B62B8D3C7_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=CC=NC(=N2)OC""",21,"""FED139B8B8BC70B5"""
+"""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"""
+"""9AB1187915A07D99_32080C073893DB92_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=NNC(=O)NC2=O""",21,"""FED139B8B8BC70B5"""
+"""4E2742E1738EB591_D14C962CB9B4D219_6039_UN""","""CC1=CC(=C(C=C1)C(F)(F)F)OCC2=N[NH]C3=C2CCC3""",21,"""FED139B8B8BC70B5"""
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+"""E6AA41A6CAB6E7B9_B94919DA69EF9BE8_6039_UN""","""C[N]2C=C(COCCC(=O)NC1CCCC1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
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+"""9A43CD3C65996F27_9826B2382A77C200_6039_UN""","""C[N]2C=C(COCC(C1=C(C)[NH]C(=C1)C)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""DD94748212013D5D_DE32CAF2BB188FC3_6039_UN""","""C[N]2C=C(COCCSC1=CC=C(C)C=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
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+"""325F4108014E3EC7_D7CAF937409C05F7_6039_UN""","""C[N]1C=C(COCC(N(C)C(C)(C)C#N)=O)C(=N1)[N](=O)=O""",21,"""2895F16254D783B0"""
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+"""30122CD5EB975CFC_84C1C7E861F52F3A_6039_UN""","""C[N]2C=C(COCCCOC1CCCCC1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
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+"""0F707354017E997E_749EE1ABFA643828_6039_UN""","""C[N]2C=C(COCC(=O)NCC1CCOC1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""26D967B9500E55EA_B3A5FBC9C481F862_6039_UN""","""C[N]2C=C(COCC(N(C)C1=NC=CS1)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""5092CBDDC607A837_CDB5323BC4E3EF5C_6039_UN""","""C[N]1C=C(COCC(NCCC(C)(C)C)=O)C(=N1)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""17AEB29966C44385_CF0986014933E5AB_6039_UN""","""C[N]2C=C(COCC1=CC=C(N(C)C)C=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""8691C876D3F88DA3_30CF273696C05BA5_6039_UN""","""C[N]2C=C(COCC1=NOC(=N1)CCCC)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""F45C54E83238274D_BEA46EE5ADF45B72_6039_UN""","""C[N]2C=C(COCC1=CC(=NO1)C(OC)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""29D962947DE6A622_DFE45891A2F19067_6039_UN""","""C[N]2C=C(COCC[N]1C=C([N](=O)=O)C=N1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""B9520CB4597E1DBF_B738B8129E813110_6039_UN""","""C[N]2C=C(COCC1=NC(=NO1)CCOC)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""768D052697F7F09B_C78588C378610195_6039_UN""","""C[N]2C=C(COCC(=O)NC1CCOCC1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
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+"""B114DB2F9CED14D9_BDB4F39DA43671E3_6039_UN""","""C[N]3C=C(COCC1=NOC2=C1CCCC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""18A26153131B7F69_AFF23D73F79E263F_6039_UN""","""C[N]1C=C(COCCC(NCC(OC)=O)=O)C(=N1)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""35D20ADEE993BD73_E563F08DBB40928D_6039_UN""","""C[N]2C=C(COCC1=C(C(OC)=O)SC=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""F9AB61D11F8EDDD0_8539C20206552607_6039_UN""","""C[N]2C=C(COCC[N]1N=C([N](=O)=O)C=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""DC05DA569EDCA5E1_5247B17D9BF5AD49_6039_UN""","""C[N]2C=C(COCCCCC[N]1N=CC=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""F8003DE08B006E92_EFDD1A02397D3EC3_6039_UN""","""C[N]1C=C(COCC(C(OC)=O)NC(=O)C)C(=N1)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""9CA2098A3DBD1F6C_3A9BF62867A1B853_6039_UN""","""C[N]2C=C(COCC(=O)NNC(=O)C1CC1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""09B4E242FCB80470_0FB105BC2E1EF49B_6039_UN""","""C[N]2C=C(COCC(C1=C[N](N=C1C)C)=O)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""AC858496B638C9D3_A99EED6C03290D68_6039_UN""","""C[N]2C=C(COCC(=O)NC1=CC=NC=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""B31C521DB35FDEC9_8F9D545DAE84409E_6039_UN""","""C[N]2C=C(COCCC1=CC=C(CC)C=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""38B8B55D5258E3A6_C1FEF75EDB326703_6039_UN""","""C[N]3C=C(COCC1=CC2=C(C=C1)CCC2)C(=N3)[N](=O)=O""",21,"""2895F16254D783B0"""
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+"""242071F4A2AF076F_7FC73E3E1CF31AE4_6039_UN""","""C[N]2C=C(COCCC1=C(CC)C=CC=C1)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
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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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+"""DC6A680E0D40221A_3C2A2F86D71573FD_6039_UN""","""C[N]1C=C(COCC[P](N(C)C)(=O)N(C)C)C(=N1)[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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+"""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"""
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+"""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"""
+"""A173BF0C82199C67_D5A829FAFBFBF7DA_6039_UN""","""C[N]2C=C(COCC1=CC(=NC(=N1)OC)C)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""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"""
+"""EC6BFB3D91C9B816_4A61DB54E238764B_6039_UN""","""C[N]2C=C(COCCC1=C([N](N=C1C)C)C)C(=N2)[N](=O)=O""",21,"""2895F16254D783B0"""
+"""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"""
+"""B2AD88095D2C9112_6AFC385BAE0D676E_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCOCCN(C)C""",21,"""55F494B59E408B31"""
+"""4331A5E5297BC408_C0BF51B9D587D876_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=C(C)C=CN=C3""",21,"""55F494B59E408B31"""
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+"""F1F340A4F4ADFC53_ECDD4A859C185BE0_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(=O)C3=CC=CS3""",21,"""55F494B59E408B31"""
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+"""817DBE0691CD15C4_DC6B5577EECA3C7D_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=C(C)C=N[N]3C""",21,"""55F494B59E408B31"""
+"""375340F59E0BA86D_86DDBAA88417835B_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCOCCC(O)=O""",21,"""55F494B59E408B31"""
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+"""36BC87C9F622FCCB_57EAE6787C267258_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3CCCCCO3""",21,"""55F494B59E408B31"""
+"""2ED5C94FEE8EC2C4_5DE039D823936CA6_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3CCC(C)(C)O3""",21,"""55F494B59E408B31"""
+"""828BCFA842946972_86534F5F8DABCF2C_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC[N]3N=CC=C3C""",21,"""55F494B59E408B31"""
+"""309D9D3110A57A08_80584B8A974B73C0_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NOC(=N3)CN""",21,"""55F494B59E408B31"""
+"""D65E619140FB8E2F_4A3D223EE03F94DD_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NC=CC(=C3)C""",21,"""55F494B59E408B31"""
+"""7E651B00DD1B7B9C_EF85E9E6B3CF3CAD_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3OCCNC3""",21,"""55F494B59E408B31"""
+"""33289CE90177049F_CD953E7EA7B14B58_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=C(F)N=CC=C3""",21,"""55F494B59E408B31"""
+"""02306651F45FA338_789704F552A907D5_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=CC(=N[N]3C)C""",21,"""55F494B59E408B31"""
+"""3A23B73F06ECA71F_C9383FAA8A91696A_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC=C3CCOCC3""",21,"""55F494B59E408B31"""
+"""DEB95D5E8C4F851A_77B2BBCC8A08AF8D_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3CCCOC3""",21,"""55F494B59E408B31"""
+"""1D23483F5DE14FE1_6D3E911AC1EBD7DB_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3COCCO3""",21,"""55F494B59E408B31"""
+"""9B06B95403811D2C_19153339B1338084_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NOC(=C3)CN""",21,"""55F494B59E408B31"""
+"""2E0BD8A4F250792C_58AAFAC27A7FA15A_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NC(C)(C)CO3""",21,"""55F494B59E408B31"""
+"""235D9D94DF19EE4A_07A70AB8CC1E490B_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC#CC3=CN=CS3""",21,"""55F494B59E408B31"""
+"""E4FF2CCB035831C0_7404667C512D35B1_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NC(=CS3)CC""",21,"""55F494B59E408B31"""
+"""222A62FBA0A01758_475F769BD7D9E4F3_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC(C(OC)=O)N""",21,"""55F494B59E408B31"""
+"""F463B027B7BDFA2F_D99F49F5A42BF898_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCC3=NN=CO3""",21,"""55F494B59E408B31"""
+"""DC438893A460B67D_408B74282BF0AC05_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCOCC3CC3""",21,"""55F494B59E408B31"""
+"""C40B244D98B0E69C_0BBC6A4FDE8D1117_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3N(C)CCCC3""",21,"""55F494B59E408B31"""
+"""8030607C24ADBBF6_67119F0FFD0C53DD_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCN(CCC)CC""",21,"""55F494B59E408B31"""
+"""408FC21E702B67BB_AC367DAFD367AD72_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCC[S](N)(=O)=O""",21,"""55F494B59E408B31"""
+"""55DE4886F6A3611A_BC8B0BC419F7E5D0_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(CCC(O)=O)=O""",21,"""55F494B59E408B31"""
+"""EB83C0C8DAC54975_755EA8C75EE9BE90_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCOC(OCC)=O""",21,"""55F494B59E408B31"""
+"""082412E2537CE859_9E51EC9E7F9C00D7_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCCCCCO""",21,"""55F494B59E408B31"""
+"""F757B8BA87276C7B_73DC641511C01A35_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NC(=C[N]3C)C""",21,"""55F494B59E408B31"""
+"""BD681868D87E7508_CA32718894984F3C_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NC(=NS3)CC""",21,"""55F494B59E408B31"""
+"""46FEEB9AFDD9C6DD_B943A820863B58DB_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(CC(O)=O)(F)F""",21,"""55F494B59E408B31"""
+"""58B8892DE73F7349_7E84228310B2BEB3_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3OCCC3C""",21,"""55F494B59E408B31"""
+"""6DACB5BEE94C9A94_0BE3F5042A631BA8_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NCC(C)(C)O3""",21,"""55F494B59E408B31"""
+"""991D85952FBA0CAC_4F7A7764BA4D760D_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=C(C)OC(=N3)C""",21,"""55F494B59E408B31"""
+"""0D2ADBF68B67ECA9_B7C97FABE8C48FD1_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCSCCCCC""",21,"""55F494B59E408B31"""
+"""C23C7471D1459F16_97395AE7165CFB9F_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCC3CCC(C)O3""",21,"""55F494B59E408B31"""
+"""BA0131B143465445_17D44F271AD0C2AB_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCN3C(C)CCC3""",21,"""55F494B59E408B31"""
+"""93362C8FEC4D99D9_160CBCE629EEBD8A_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NOC(C)(C)C3""",21,"""55F494B59E408B31"""
+"""DDCF5EFDBF6B2274_81A9423D54E57290_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(C(C)(F)F)(F)F""",21,"""55F494B59E408B31"""
+"""1F90166F805BE9B8_34AF6ACA2405B37F_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3CCC(C)CO3""",21,"""55F494B59E408B31"""
+"""22CAD8D0AE01D444_B5B3FECB38BEAD63_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCOC(C)(C)C#N""",21,"""55F494B59E408B31"""
+"""3ED3E38640FF19FF_A9D4D13C5B78DBD7_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=CN=C(CC)S3""",21,"""55F494B59E408B31"""
+"""80AB7AC33A571DE2_8BCB0C9E5F096513_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC4=NC3(CC3)CO4""",21,"""55F494B59E408B31"""
+"""FF89DC2033FDE8AC_AABC2A030EC7396A_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCCC(OC)=N""",21,"""55F494B59E408B31"""
+"""8DC6CC117603C71C_25E1721D40A2E939_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC[C@]34C[C@H]3CCC4""",21,"""55F494B59E408B31"""
+"""8F0587F5E1D86A30_F598EF362303DC59_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(C3(N)CCC3)=O""",21,"""55F494B59E408B31"""
+"""7830CCDF40906103_E44AB586CCEF255D_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3CN3C4CCC4""",21,"""55F494B59E408B31"""
+"""10123923DB7002D5_A5CAD639C4871600_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(N(CC)CC)C""",21,"""55F494B59E408B31"""
+"""12886924C20437AA_6DC916AD17C35FCE_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC([C@@H]3CCCN3)=O""",21,"""55F494B59E408B31"""
+"""145B1D9F094DCE29_8EBCD7A73FAFAB6F_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NOC(=C3)CC""",21,"""55F494B59E408B31"""
+"""F8C7C6CFAD8761FB_0C0E803DCB98C25E_6039_DP""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC([C@H]3CCCN3)=O""",21,"""55F494B59E408B31"""
+"""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"""
+"""72DD7B535C54991A_999DAFF03286D4C3_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=CC=C[N](=C3)=O""",21,"""55F494B59E408B31"""
+"""5FC9B4F20D82FAEF_42A0C662714A0FCE_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NC=C(C)C=C3""",21,"""55F494B59E408B31"""
+"""A5537DD67CC98397_C927F9C8C4752CEF_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCN[S](C)(=O)=O""",21,"""55F494B59E408B31"""
+"""1EDA9325D00D4C82_65CF22E91A761B1A_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC(C(C)=NO)=NO""",21,"""55F494B59E408B31"""
+"""38E941374BA99294_A3F4BC1359F6C9DE_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=NN(C)C(N3)=O""",21,"""55F494B59E408B31"""
+"""575EBF93CD3BD0C0_4845CD24C985D504_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCCC3=CSC=C3""",21,"""55F494B59E408B31"""
+"""0C60D3E3A001BE2F_0BC0CEEB4E06F95C_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC3=CN=C(F)C=C3""",21,"""55F494B59E408B31"""
+"""6FB0366C550C7A9E_8EDE2C9DE2779CF8_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CCOCCC3CC3""",21,"""55F494B59E408B31"""
+"""43494E7C89423DF8_99B510C51B6CC44A_6039_UN""","""O(CC1CC(=O)NC2=C1C=CC=C2)CC#CCOCOC""",21,"""55F494B59E408B31"""
+"""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"""
+"""9B01E44E7093AC16_C936F2195FBF67B3_6039_UN""","""C[C@@H]([C@H](OCC(C(O)=O)=O)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
+"""8E47D3E1D2814342_8C7C8A904DCA4CC6_6039_UN""","""C[C@@H]([C@H](OCCOC(C)C)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
+"""DD6F2C336DD3FEB3_0A4BD37600335CDF_6039_UN""","""C[C@@H]([C@H](OCC1OCCO1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
+"""07AA6D684C5D6B5C_A2DCF2DDBA0A5128_6039_UN""","""C[C@@H]([C@H](OCC1CCCO1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
+"""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"""
+"""80899FF8E786E769_16C9D82A27D4ED7A_6039_UN""","""C[C@@H]([C@H](OCC(=O)C1CC1)C2=CC=CC=C2)N3CCCC3""",21,"""74B18426BE993748"""
+"""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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+"""1D37B3BB69E8C89A_783F6EE31F007DC5_6039_UN""","""C[C@@H]([C@H](OCC(OCC)=N)C1=CC=CC=C1)N2CCCC2""",21,"""74B18426BE993748"""
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+"""E6AE4DEF433C0937_9596E7FCD00F2D56_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(N(CC)CC2=CC=CC=C2)=O""",21,"""51FDEB95E816E7B6"""
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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"""
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+"""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"""
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+"""B27EEA51E1CF6BCD_E1D9A48799595FD6_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=N2)C3=C(C)C=CC=C3""",21,"""51FDEB95E816E7B6"""
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+"""EE2806DF633EBC0D_FC37E4EB3CD119F9_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(NC2=NN=C(C(C)(C)C)S2)=O""",21,"""51FDEB95E816E7B6"""
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+"""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"""
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+"""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"""
+"""DA20320809BBC795_B618DC4FB04FB4BF_6039_UN""","""O(CCC1CC1(Cl)Cl)CCN3C=NC2=C(C=CC=C2)C3=O""",21,"""51FDEB95E816E7B6"""
+"""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"""
+"""BA77D6AFE70AAB29_C466D4D5B09F4EF6_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=C(C=C(C(OC)=O)C=C2)OC""",21,"""51FDEB95E816E7B6"""
+"""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"""
+"""85C3FD2832A20A5B_F2AC4407F3270479_6039_UN""","""O(CCC1CC1(Cl)Cl)CCC[S](C2=CC=C(C)C=C2)(=O)=O""",21,"""51FDEB95E816E7B6"""
+"""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"""
+"""831F485F3EE01FD1_8B060F6EAEEE1251_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C3=CC2=C(C=CC(=C2)C)O3)=O""",21,"""51FDEB95E816E7B6"""
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+"""7B093D2DBA11B94E_1B36965E2BE320B1_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NOC(=N2)C(OCC)OCC""",21,"""51FDEB95E816E7B6"""
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+"""DE9F7EB5CB7E494A_547102B908611709_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3OC(=O)C2(CCC2)C34CCC4""",21,"""51FDEB95E816E7B6"""
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+"""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"""
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+"""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"""
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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"""
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+"""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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+"""F0AC9260E400B463_82513E44B8363788_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=N[N](C)C3=C2C=CC=C3)=O""",21,"""51FDEB95E816E7B6"""
+"""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"""
+"""0BB1349B555D277A_FF7D507D9FC771D7_6039_UN""","""O(CCC1CC1(Cl)Cl)CCCC2=CC(=C(OC)C=C2)OC""",21,"""51FDEB95E816E7B6"""
+"""B9F78990669C2548_0F52B41710BC107A_6039_UN""","""O(CCC1CC1(Cl)Cl)CC3=C(OC)N=C2C=CC=CC2=C3""",21,"""51FDEB95E816E7B6"""
+"""6807487ED0C303DF_1F6885BE01781B5D_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=NC(=CS2)C3=CC=C(F)C=C3""",21,"""51FDEB95E816E7B6"""
+"""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"""
+"""7AB76AA7AF99AED2_CF2BB09D3450CA59_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=C(C)[N](C(=C2)C)CC#C)=O""",21,"""51FDEB95E816E7B6"""
+"""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"""
+"""1C8FF22E48B5F808_054FE2FA4BA5EFA3_6039_UN""","""O(CCC1CC1(Cl)Cl)CC(C2=CC=C(C(F)(F)F)C=C2)=O""",21,"""51FDEB95E816E7B6"""
+"""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"""
+"""36DCF2413DC6C786_59BCF228288E8844_6039_UN""","""O(CCC1CC1(Cl)Cl)CC2=CSC(=N2)C3=CC=C(C)C=C3""",21,"""51FDEB95E816E7B6"""
+"""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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+"""5E5E90EB36831BF9_71C0CA67EFA3AEC8_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(C2=C(C)[NH]C(=C2)C)=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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+"""5BA300CF1A33BD2D_B0451404A1C0D73E_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC3COC2(CCCC2)O3""",21,"""C173893D9103EF78"""
+"""02047DECEA7FB87F_6D27BFB7A42143F2_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCCOC2CCCCC2""",21,"""C173893D9103EF78"""
+"""517B464AC18CD5C6_52777BC28E24122A_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NN=C(C(C)(C)C)O2""",21,"""C173893D9103EF78"""
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+"""AE3F5704E7FCE228_DEEFBD040A42595C_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(C2=CC=CC(=C2)C)=O""",21,"""C173893D9103EF78"""
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+"""E63B743D19DC9C16_D9295F695314376D_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NOC(=N2)CCCC""",21,"""C173893D9103EF78"""
+"""9CE39F7E1ED0C35D_574216BA682037BA_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC(=NO2)C(OC)=O""",21,"""C173893D9103EF78"""
+"""9D32001F8468F715_360220CE6725FCAF_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC[N]2C=C([N](=O)=O)C=N2""",21,"""C173893D9103EF78"""
+"""A0DD7E0A88D067B5_5EDEC04D5B555DD8_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NC(=NO2)CCOC""",21,"""C173893D9103EF78"""
+"""144F642F39B3E97E_2E63F09CBDB56D5D_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(=O)NC2CCOCC2""",21,"""C173893D9103EF78"""
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+"""C83080F59CE89568_54528BC261E21D2B_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NOC3=C2CCCC3""",21,"""C173893D9103EF78"""
+"""9B374100D27CCA5A_4614452C324A4AF7_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCC(NCC(OC)=O)=O""",21,"""C173893D9103EF78"""
+"""92C6AA48A64D68C9_0C8588D27E94FE45_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=C(C(OC)=O)SC=C2""",21,"""C173893D9103EF78"""
+"""2F37AC1A389D3E20_6CDFBA5DC3814ACF_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC[N]2N=C([N](=O)=O)C=C2""",21,"""C173893D9103EF78"""
+"""48522B38AD673B20_BBA1C9225E21C181_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCCCC[N]2N=CC=C2""",21,"""C173893D9103EF78"""
+"""F3DA2512920E0DD6_063B625DFCA9520B_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(C(OC)=O)NC(=O)C""",21,"""C173893D9103EF78"""
+"""05D92DB28EAEF3BF_D37D8E77A275D49B_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(=O)NNC(=O)C2CC2""",21,"""C173893D9103EF78"""
+"""136F3E109C5220CE_E6577DE3EBCA9853_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(C2=C[N](N=C2C)C)=O""",21,"""C173893D9103EF78"""
+"""06F51A7D0F714858_40789533C6FD61A0_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(=O)NC2=CC=NC=C2""",21,"""C173893D9103EF78"""
+"""CC77B819FF594F5B_667B2C026B502C56_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCC2=CC=C(CC)C=C2""",21,"""C173893D9103EF78"""
+"""918083EDEABADEF6_28188F011EE60BCB_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC3=C(C=C2)CCC3""",21,"""C173893D9103EF78"""
+"""6A13DF41D983FBCA_5E58DA56E71A1446_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCOCC2CCCCO2""",21,"""C173893D9103EF78"""
+"""9A9300F29146138C_78A0CD0A742DCD5F_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2OCCN(C(C)C)C2""",21,"""C173893D9103EF78"""
+"""B7E1FE46253ADEB3_65EDA705D666040F_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=C[N](C)N=C2[N](=O)=O""",21,"""C173893D9103EF78"""
+"""D62BCAB985935911_5BEC2F78868F3B83_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCCOC2=CC=CC=C2""",21,"""C173893D9103EF78"""
+"""EFD0E4BD13B2D438_C50CA02407B8E5F0_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC=CC(=C2)N(C)C""",21,"""C173893D9103EF78"""
+"""2B79419237CB3ADA_D4C6D494D8427F4E_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCOC2CCCCCC2""",21,"""C173893D9103EF78"""
+"""A216CCD4A7360197_AE9078FF03A9409D_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=C(N=C[N]2C)[N](=O)=O""",21,"""C173893D9103EF78"""
+"""26AC4665C1467837_C79CD6B31DEADEE3_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC3=NC2=C(C=CC=C2)S3""",21,"""C173893D9103EF78"""
+"""FD60397A040F02F1_99029E5F5F7C1F3D_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCN(C)C2=CC=CC=C2""",21,"""C173893D9103EF78"""
+"""06B9791137607FB3_E466045297923992_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC=CC(=N2)OCC""",21,"""C173893D9103EF78"""
+"""A7C4D1308EC4A914_D0D962DB6D73ECA5_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NC(=NO2)C(OC)C""",21,"""C173893D9103EF78"""
+"""CD67782A1B5DB11D_DD2EF25940EE4BE2_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC[P](OCC)(=O)OCC""",21,"""C173893D9103EF78"""
+"""AF1CAB808906EDCF_FA8D71D3EDF421F6_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2ON=C(C(OC)=O)C2""",21,"""C173893D9103EF78"""
+"""AF06F6126D8BE73E_885BFE1DECC4B998_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NC(=CS2)C(C)(C)C""",21,"""C173893D9103EF78"""
+"""F94E566FCF9C0DBE_082379E0EE693058_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC3=NC2=C(N=CC=C2)[NH]3""",21,"""C173893D9103EF78"""
+"""6761A4FECC7DF3A7_04B9BA33155EE740_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC[N]2C=C(C(O)=O)C=N2""",21,"""C173893D9103EF78"""
+"""4ED325247EAF5143_75C446AA2DF7BA0D_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCCNC(C(F)(F)F)=O""",21,"""C173893D9103EF78"""
+"""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"""
+"""0E8A01C44C0C06EB_EE11390D2776A6F3_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCC2=CC(=C(F)C=C2)F""",21,"""C173893D9103EF78"""
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+"""872512DCFFDA295D_9618E59A248BA010_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC=C(COC)C=C2""",21,"""C173893D9103EF78"""
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+"""6F470CC7F1178839_DE6C21E622854F44_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(=O)C2CC[S](=O)(=O)C2""",21,"""C173893D9103EF78"""
+"""9D9EAE7BBE784720_4D36D4E196D25CB6_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(=O)NCC2CCCO2""",21,"""C173893D9103EF78"""
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+"""BE0925BA4B6A3EF2_4D3BFC14A3D79261_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=C([N](=O)=O)N=CC=C2""",21,"""C173893D9103EF78"""
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+"""DA1891BF35F1C198_04368821E369DD65_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC3CCC2(CCC2)CO3""",21,"""C173893D9103EF78"""
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+"""7B90986E0BAA3DB3_D962B7C544CB78DD_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC3=NC2=C(COCC2)S3""",21,"""C173893D9103EF78"""
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+"""38BD41BB3DE04D39_0917FC59C2BFEB0A_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(N(C)C2CCCC2)=O""",21,"""C173893D9103EF78"""
+"""DD57E5651281F882_17BE52B559AC1017_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=C(C=CC(=C2)OC)F""",21,"""C173893D9103EF78"""
+"""D5E33584EC48FAE6_4750AD50B153CE9C_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NC=C(C(O)=O)C=C2""",21,"""C173893D9103EF78"""
+"""323041E1E60AF1A7_BF31F218777BB788_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(C2C(C)(C)C2(C)C)=O""",21,"""C173893D9103EF78"""
+"""F8C16F0A8FAC778E_4FC39545341E902D_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC(=CC=C2)CC=C""",21,"""C173893D9103EF78"""
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+"""248C39290583D6D8_9C3A9DCDE9B2A5CA_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=C(C(F)(F)F)SC=C2""",21,"""C173893D9103EF78"""
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+"""9A8F149A1DEDC9BA_35262B9C0EEE74C6_6039_DP""","""CC(C)[N]1C=C(N=N1)C(C)OCC2CNC3(CO2)CCC3""",21,"""C173893D9103EF78"""
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+"""0A6081848401C834_9B8354EF8A9228F6_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCC(C(OCC)=O)(F)F""",21,"""C173893D9103EF78"""
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+"""7494B3A53724DE08_F83533E876B708FE_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NOC(=C2)CC3CC3""",21,"""C173893D9103EF78"""
+"""EB1269CE0CACCECC_B9F2DC73767B3A3D_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC3=C(C=C2)OCO3""",21,"""C173893D9103EF78"""
+"""F49C43E1BB3BD542_D27BB83EA15E9FC7_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NC(=C[NH]2)C(F)(F)F""",21,"""C173893D9103EF78"""
+"""B820772634CAE763_AB7A33F2586BC268_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NO[C@@H]3CCCC[C@H]23""",21,"""C173893D9103EF78"""
+"""CB1797FDA36743C3_2673B08F14638A72_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC=NC(=N2)COC""",21,"""C173893D9103EF78"""
+"""8B0C790F3031AAAD_B266ACCCA56D789D_6039_DP""","""CC(C)[N]1C=C(N=N1)C(C)OCCC3CC2CCC(N2)C3""",21,"""C173893D9103EF78"""
+"""3A1DEA2C367C43F1_1278BAE83EF51C2C_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC=CC(=C2)C(N)=O""",21,"""C173893D9103EF78"""
+"""7718A6684B6F6880_D7101D7FCE4E2457_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC=C(C(OC)=O)S2""",21,"""C173893D9103EF78"""
+"""CD7E44EEFCB76EE6_CFC0CA6958601B47_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(NCCCC(O)=O)=O""",21,"""C173893D9103EF78"""
+"""F38AA20A78CE1FD0_A7801E14161A5121_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(=O)NCC2=CC=CS2""",21,"""C173893D9103EF78"""
+"""73681A23AB9A2B94_EDCCC6A3C918D6E9_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC=CC3=NON=C23""",21,"""C173893D9103EF78"""
+"""68415676B4A0F818_FD24C7FDA8DD64C9_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC3=C[N]2C=CC=NC2=N3""",21,"""C173893D9103EF78"""
+"""28D241F3B6E0B4CA_62B6B93D647B004C_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCOC2CCCCC2C""",21,"""C173893D9103EF78"""
+"""39D284D3D71F8FE5_B00819C8961FAEE6_6039_DP""","""CC(C)[N]1C=C(N=N1)C(C)OCC3=CC2=C(C=C[NH]2)C=C3""",21,"""C173893D9103EF78"""
+"""54D463A97550E1EC_3772372EF4E4E031_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=C(C(=NO2)C)[N](=O)=O""",21,"""C173893D9103EF78"""
+"""B405133A67B1FE3E_D17A5CB4C148616A_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCOC2=CC=C(C)C=C2""",21,"""C173893D9103EF78"""
+"""2155DD1511F3EF42_DAF8ED1B08B37C71_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCCOCC(C(F)F)(F)F""",21,"""C173893D9103EF78"""
+"""9506F0DBEF04D300_3C1C9A0077FF9719_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC(NC(NCCC)=O)=O""",21,"""C173893D9103EF78"""
+"""60B944F23A81EAD5_9A0FFC4ABD0F0BCF_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NN=C([N]2C)C3CC3""",21,"""C173893D9103EF78"""
+"""8EECD09C51CEA2D2_CD65B18A486E3F40_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=NN=C(S2)C3CCC3""",21,"""C173893D9103EF78"""
+"""17EFABE22631CFA8_065018FA0DE53562_6039_UN""","""CC(C)[N]1C=C(N=N1)C(C)OCC2=CC=CC(=C2)C(F)F""",21,"""C173893D9103EF78"""
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+"""C6B131A2C1B149FB_6DF015E9CE92E3F7_6039_UN""","""CC1(C)C[C@@H]1COCCON3C(=O)C2=C(C=CC=C2)C3=O""",21,"""94D5B4ED6C2B4F79"""
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+"""68FE487F21398F91_C78C50A26E3120B3_6039_UN""","""CC1(C)C[C@@H]1COCC(NC(C(C)(C)C)C2=CC=CS2)=O""",21,"""94D5B4ED6C2B4F79"""
+"""8238B563188D70A0_40FE7BB6614841BA_6039_UN""","""CC1(C)C[C@@H]1COCC(NC(C)CC2=C(C=CC=C2)C)=O""",21,"""94D5B4ED6C2B4F79"""
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+"""718C09C6E0E43D58_89A52001D705422C_6039_UN""","""CC(C)(COCC2=C[N]1C=CC=C(C)C1=N2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
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+"""E2FF787D3F163D63_9962E7F6B417D2B4_6039_UN""","""CC(C)(COCC(C1=C(C=C(F)C=C1)F)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""81284205F72A4584_01D7437992C5A6C0_6039_UN""","""CC(C)(COCC(C1=C(C=CC(=C1)C)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""F562AAC860DB8459_829AABF750201C46_6039_UN""","""CC(C)(COCC2=C1N=CC=CC1=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
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+"""E4396C091DEDD606_EC8F20F133CAB11C_6039_UN""","""CC(C)(COCC(=O)OCC1=CC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""DC74F285C0B5CEED_BBE43314A8037F6C_6039_UN""","""CC(C)(COCC(NCCCC(OC)=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
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+"""7F82FBBB078300D4_363CD248D1D631C8_6039_UN""","""CC(C)(COCC(C1=C(F)C=CC=C1F)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""B6CB6986BBF4E998_27D98F210399481A_6039_UN""","""CC(C)(COCC(NC(C(C)C)C(=O)C)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
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+"""E62DBEA95D499271_FB8D455ECA3E9D29_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)OC(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F484F630F3867F0A_4A158C4430AE03BF_6039_UN""","""CC(C)(COCC1=CC=C(C(OCC)=O)O1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""659277C594284A2A_4426316D69DD8D7C_6039_UN""","""CC(C)(COCCOC1=C(OC)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""6889EECE45D4741D_4910D8272EB683D1_6039_UN""","""CC(C)(COCC(=O)NNC1=NC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""2C19B7E8F9B32F40_B0DC8E326C0655F8_6039_UN""","""CC(C)(COCC(N=C1N=C(SC)NS1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D0A568C92B1A4488_5885FCDDFC0524D7_6039_UN""","""CC(C)(COCC1=CC=CC(=C1C)[N](=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F100CB8E08B58460_FAD67AAEB6407F1E_6039_UN""","""CC(C)(COCC(=O)NC1(CCCC1)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""85538645F5BEBCD9_866168CD29ACF463_6039_UN""","""CC(C)(COCC1=NC=C(C(=C1C)OC)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""2D71C416E5C1DFD4_B290D0F5B9B25EB6_6039_UN""","""CC(C)(COCC1=CC(=C(C(OC)=O)O1)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""9E8100B02479809A_C8421E941179E153_6039_UN""","""CC(C)(COCCSC1=CC(=C(C)C=C1)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""ABC3C44AB6DECE0E_BA7DF92C92509036_6039_UN""","""CC(C)(COCC(=O)NC(=O)C1=CC=CO1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""6EB83F86E67E868E_43D2DD2B7B0282E6_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)OC(C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""63B770EE047EB9F3_99FABAC0CA187099_6039_UN""","""CC(C)(COCC(NCC1=C(C)C=CS1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""7E5A7F8CD2031B90_6374471F8B742211_6039_UN""","""CC(C)(COCC(NCC1=CC=C(C)S1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""2E7D6557D7C487D9_FAE600881F9FBB10_6039_UN""","""CC(C)(COCC(N(CC(C)C)C1CC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""C51A600B01C3487B_CDA73294C778DF09_6039_UN""","""CC(C)(COCC(N(CC)CC(C)C#N)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""AE256B7FF08008A7_9796353A5BE1884A_6039_UN""","""CC(C)(COCC(=O)NCCC1=CSC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""DECEF328907961CB_E298BCDC510B373A_6039_UN""","""CC(C)(COCC(NC(C)C(=O)N(C)C)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""3BAA9785B441BEB2_0B8675DE967340F5_6039_UN""","""CC(C)(COCCNC(OCC(F)(F)F)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""98F42AF1DF9C590F_6A39CBF40BDCABA3_6039_UN""","""CC(C)(COCC1=C(C(OC)=O)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""2D1C5F0D694EB10A_3EF1582AB1E91A36_6039_UN""","""CC(C)(COCC1=CSC(=N1)CCC(C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""B5F2AE2F50118410_A17F9B240A2CCB5B_6039_UN""","""CC(C)(COCC1=CSC(=N1)N(C)C(=O)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""573311721BBA6D76_6D5C2E15412F7CFB_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)OCCO2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""B94ECC36210F23C6_835D1E1ECA52A5D3_6039_UN""","""CC(C)(COCC1=C(OC(C)C)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""B082427A514D8B39_1F1ADDEAED3A95AA_6039_UN""","""CC(C)(COCC1=CSC(=N1)C2=CSC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""4980AD22C5B1E3C6_67917206E81D3E93_6039_UN""","""CC(C)(COCC2=NC1=C(F)C=CC=C1[NH]2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""FF8DD81B8D629C15_2EFFF00AA785B02E_6039_UN""","""CC(C)(COCC(C1=CC(=CO1)C(O)=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""62A53613ADF706F4_2E4032B7B29060E1_6039_UN""","""CC(C)(COCC(C1=CC(=CO1)C(N)=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""C7DFEC22DA46EAD6_74313166EDC3B904_6039_UN""","""CC(C)(COCCCCC[N]1C=C(C)C=N1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""E085A04D0A87B90D_E392D37CD04FC583_6039_UN""","""CC(C)(COCCC(N(CC(OC)=O)C)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""4FF96AC4D2B6E54D_02E979CE5D6B7E7A_6039_UN""","""CC(C)(COCCC[N]1N=C([N](=O)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""467A2B7F8D3E9994_55EF26ADA970B733_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2=COC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
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+"""91E0316AC1A35534_3DA5C2BA774C502D_6039_UN""","""CC(C)(COCC2=C[N]1C(=CC=CC1=N2)C)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""37300AC0CB9D03E8_E2D307263F06C1E6_6039_UN""","""CC(C)(COCC(C1=CC(=CS1)C(C)=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""A094EFD91A38A65C_5EE5B832ECC5130E_6039_UN""","""CC(C)(COCC1=NC=C[N]1CC(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""FA14E9E89615EB61_DABB510420D71FC3_6039_UN""","""CC(C)(COCC(N(CC(OCC)=O)C)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""FBCBA6C8643A933C_4659B8A07C255033_6039_UN""","""CC(C)(COCC1=CC(=C(C=C1)SC)OC)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F807207801E2ED94_AA242D00732B92B8_6039_UN""","""CC(C)(COCC1OCCC2=C1C=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""B695ECE6CF8A003E_10820B65C3ACDBCA_6039_UN""","""CC(C)(COCC1=CSC(=N1)C(OCC)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""ACBF6ECF4AF9669A_C9D659D3021C2455_6039_UN""","""CC(C)(COCC1=N[N](C(CC)CC)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""5AD8BFD468B5F996_2AC54ADF0C6DC199_6039_UN""","""CC(C)(COCCCC1=CC=CC(=C1)OC)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""4557FE9FB5BAF52B_83E2DB282B8098FE_6039_UN""","""CC(C)(COCCC1=CC2=C(C=C1)OCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""3D56604EABCA192D_FF07EC723E7E9739_6039_UN""","""CC(C)(COCCN1CCN(C(C)C)CC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0D76C2273B4DFA94_F0A18A87DDA4E515_6039_UN""","""CC(C)(COCC2=C1C=CC=CC1=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""1F9AA028A420D077_D25CFC0C456AC82F_6039_UN""","""CC(C)(COCC2=C1OCCOC1=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""F6E4547C3BF61589_D69B6D4527D21583_6039_UN""","""CC(C)(COCCOC1=CC=C(SC)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""4FC8F6DAF32F8F0D_6FEEE1D67C93B158_6039_UN""","""CC(C)(COCC1=CC=C(C=C1)OCC#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D342967BFCC9BA8F_A576CAB228474737_6039_UN""","""CC(C)(COCCN(CCCC)CCCC)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""1C0F76121A2AB221_BA6CCDE0F567F2AB_6039_UN""","""CC(C)(COCCC1=CC=C(C(O)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""75234C8266A40768_6867666912E61679_6039_UN""","""CC(C)(COCC1=NC(=NO1)C[S](C)(=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""573E4916D59E8C41_D16ED2E8119EBE4C_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2=N[NH]C=N2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""1E41D7FDA69B6FB9_C83DFC8C7650DAF2_6039_UN""","""CC(C)(COCC(C1=CC(=C(C=C1)F)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""2DF14A4135C69DFB_84897E0B5C453F03_6039_UN""","""CC(C)(COCC2=NC1=C(C=CS1)C(=O)N2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""CC74EB830DCC47BB_DD0775331AAB4709_6039_UN""","""CC(C)(COCCCNC(=O)C1CCCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""796A92B6756CF5E7_1C410B7E1B1D0D52_6039_UN""","""CC(C)(COCCN[S](CCCOC)(=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""16DBA7682BF0E93E_29775EF9F97C229F_6039_UN""","""CC(C)(COCC1=CC=C(OC(C)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F6EAA64D15884E10_D0995D3B3C75F38A_6039_UN""","""CC(C)(COCC(C1=CC(=CS1)C(O)=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""FB3A734194F4CDA7_F74BBA808BC66ADC_6039_UN""","""CC(C)(COCC1=NOC(=N1)C2=COC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""39BD0CFDE2032DAC_B1FFB852C9DFF1C3_6039_UN""","""CC(C)(COCC(C1=CC(=CS1)C(N)=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""DAC745826EA7AAB0_231ACD90AFB6BF51_6039_UN""","""CC(C)(COCC1=NC=C(O1)C2=CC=CS2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""9BFFFDD6B5EDBD3E_66270AFE0E5EB60C_6039_UN""","""CC(C)(COCC(=O)NCC1=CN=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""3AEC2D51AFC48751_FB5640EB8B910B29_6039_UN""","""CC(C)(COCC2=CC1=C([N](C)N=N1)C=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""3B641406CC6F8935_73BDBFEDF1264F1F_6039_UN""","""CC(C)(COCCNC(=O)C1=NC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0E72F191B78DE622_1E889F0ACE1B6AC0_6039_UN""","""CC(C)(COCC1=C([N](C)N=C1)C(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""1DF8295D6DE60DB8_1FEFEF749B3D522F_6039_UN""","""CC(C)(COCC1=NC(=NO1)CCC(C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""6DCC6DC2AFBD28FD_2D1312B1B4C64A70_6039_UN""","""CC(C)(COCC1=NC(=NO1)C(SCC)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""B8DEF1CEF052C502_F959D6DACFE1BB90_6039_UN""","""CC(C)(COCC1=C[NH]C(=N1)C2=CC=CS2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""8983938EC07A1A4D_691FB876B44DF93E_6039_UN""","""CC(C)(COCC1=C(OC)C=CC(=C1)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""68545D57DEF934D7_E86B497FEA6E8D10_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)NC(=O)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""2162D4A74E1FAFB3_C2B1E9B98961FE00_6039_UN""","""CC(C)(COCCOC1=CC=CC(=C1)OC)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D8714D2DC0C583EC_9E1FBA446ED6893D_6039_UN""","""CC(C)(COCC1=CC=C(C(OC)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""804828A1BF152A44_2A3082E575E095F0_6039_UN""","""CC(C)(COCC(NC(NCC(C)C)=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""25DD4678D7544FB7_88B677BB5E359C4E_6039_UN""","""CC(C)(COCC(NC1CCC(C)CC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""CEA1D9026358EBC2_6AA9DE7121BCD3A4_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2=CC=CO2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""4664B3CA1F7E4E7D_085285E287A50679_6039_UN""","""CC(C)(COCCOC1=C(C)C=CC=C1C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""037E992803CDE353_1BDD24FA1DD4DE87_6039_UN""","""CC(C)(COCC1=CSC(=N1)C2CCCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""D89C3F919030B9B8_9C8094BE22000FF5_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2CCCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""4DF905D5CC02F099_0D944BB196583D77_6039_UN""","""CC(C)(COCC(N(CC(C)C)C(C)C)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""90A5D60F2A667EDB_35B079A10215E898_6039_UN""","""CC(C)(COCC1=CC=C(CC(O)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""786B117BFA0A2B2C_AEC721BE526F6C11_6039_UN""","""CC(C)(COCC(NCCOCCCC)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""DC5039FFCD4541AD_5621B19C0288680F_6039_UN""","""CC(C)(COCC1=CSC(=N1)C(OCC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""DF40D373949515AC_20BB27426E1EA629_6039_UN""","""CC(C)(COCC1=NC(=NO1)C2=CC=CS2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""B1084A260ECF6051_8139D2269C475002_6039_UN""","""CC(C)(COCC(=O)NC(C1CC1)C2CC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""A960F67A0DC6B6D1_44FE75B5BBEEA31D_6039_UN""","""CC(C)(COCC2=NC1=C(SC=C1)C(=O)N2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""7E0202ADE65A5A59_75C2E9723032715C_6039_UN""","""CC(C)(COCC(=O)NCCC1=CC=CS1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F06E905C44F5151F_A91DE5124C4B274A_6039_UN""","""CC(C)(COCCN1C(NC(C)(C)C1=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""119BFA42939995FF_32333FC8D54E0A9E_6039_UN""","""CC(C)(COCC(NC(C)(C#N)C1CC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""CBF7B7DE32AD88C8_971EBC96D9284774_6039_UN""","""CC(C)(COCC2=NC1=C(C=CC(=C1)F)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""0136911BA64F7EF9_F4B89909E5D22173_6039_UN""","""CC(C)(COCC(NC(C(C)C)(C)C#N)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""4A81F25A2D095300_890D740DBB2EA56C_6039_UN""","""CC(C)(COCC1=C([N](=O)=O)C=CC(=C1)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""CA31E9A0E8BBA97A_087D634296CD18BC_6039_UN""","""CC(C)(COCC1=CSC(=N1)CC(NC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""43AAFCF620401D6A_D0B4F9E6AB756399_6039_UN""","""CC(C)(COCC1=CC=C(N(CC)C)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""7103EAAD13DF9AB6_6BADBCBE2AEA4D33_6039_UN""","""CC(C)(COCC1=CSC(=N1)N(C)C2CC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""BF080C1A84596858_2253D483D180F5DD_6039_UN""","""CC(C)(COCC1=NC(=N[NH]1)C2=CC=CS2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""7388FCFF54FE8A29_888600C2AA5B015A_6039_UN""","""CC(C)(COCC1=C(C)SC(=C1)C(OC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""BCF80C83BD022F52_3133204584BE80D0_6039_UN""","""CC(C)(COCC(=O)NNC(=O)C1CCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""54AC5BC0036FA7D1_1708A044DF4B41C6_6039_UN""","""CC(C)(COCCCOCC1CCCCO1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""A2F80AA6A8132AE9_09F0372262BF727B_6039_UN""","""CC(C)(COCC1=C(C=C([N](=O)=O)C=C1)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""8C1AC7FC4B93435F_1EDC305B487D8339_6039_UN""","""CC(C)(COCC1=C(OC)C=C(C=C1)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D89DED7EC9803712_9421A96BBAD5BBA0_6039_UN""","""CC(C)(COCC1=CSC(=N1)C2CCCO2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""98145F6329D16D24_C9C1719FE0719625_6039_UN""","""CC(C)(COCC(=O)NCC1=CC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""127CA52F11E9241C_6DC34B102A90E2E1_6039_UN""","""CC(C)(COCCCCCN1CCCCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""9700D19C008A49C2_D0F3993589C7F886_6039_UN""","""CC(C)(COCC1OC(=C(C(OC)=O)C1)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""237CEA4A868F813D_1618A3914422542B_6039_UN""","""CC(C)(COCC1=C(ON=C1)C2=CC=CO2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""072DA3AABEEAAFB1_450769F5A33135CA_6039_UN""","""CC(C)(COCC1=C2C(=CN=C1)C=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""29647F62051D649D_30BCB1F4639DEB99_6039_UN""","""CC(C)(COCC(N(C)C1=CC=CC=C1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""50BB6E5ABFBD4FF3_E3945625027ED219_6039_UN""","""CC(C)(COCC(NC1=CC=C(C)C=C1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""04DC1348205EBD08_132116D27E485D39_6039_UN""","""CC(C)(COCC(NC1=C(F)C=CC=C1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""25E8D3D1F43F2388_CF73A96384F01AD9_6039_UN""","""CC(C)(COCC(NC1=CC=C(F)C=C1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""712033F96FB38429_E6712837CE85581F_6039_UN""","""CC(C)(COCCC(C1=CC=C(C)C=C1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""9EA04C345EDE82E7_F6572B7EC828502C_6039_UN""","""CC(C)(COCCCOCC1=CC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""1B3E8BAF4C24EBA3_7A754E28B46F59CB_6039_UN""","""CC(C)(COCC(N1CC(C)OC(C1)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D08999BADF28CA3C_8E5985691F3E4108_6039_UN""","""CC(C)(COCC(NC1=CC=CC(=C1)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""78B3304D9D51FB43_18DE792E24EAC3A4_6039_UN""","""CC(C)(COCC1=CC=C(SC(C)C)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""BAC714B36D648999_F5CF3C64004131E9_6039_UN""","""CC(C)(COCC(C1=C(C=CC(=C1)F)F)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""5BBB0F4F06F954B9_D6AC095A764AF1E5_6039_UN""","""CC(C)(COCC1=NN=C([N]1C)C2CCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""D3D28F6F2FB5D6F0_69892DDE3CAB0887_6039_UN""","""CC(C)(COCC(NC1=C(C)C=CC=C1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D087174A66710481_994F8E736FD11BA1_6039_UN""","""CC(C)(COCC(NC(C(C)C)C(=O)O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""9C14F4BE5183426A_7B96658D0DB5E659_6039_UN""","""CC(C)(COCC2=NC1=C(C)C=CN=C1[NH]2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""4E5D132454F22D41_60CE7769C5679B7B_6039_UN""","""CC(C)(COCC1=C(N=C(C)S1)C(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""4F53BFC1B6327352_5ECB101D0C5F61B4_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)[NH]C(=N2)C)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""22942610FCD6506D_895AE850A141ADC3_6039_UN""","""CC(C)(COCC[N]1C=C(C(OC)=O)N=N1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""79B628428EA6002E_31E5045551F68773_6039_UN""","""CC(C)(COCC(NC1=CC=CC(=C1)F)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""528EF67D217329DD_5375D3BC1A7D5482_6039_UN""","""CC(C)(COCC(C1=CC=CC(=C1)OC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""4DE4A175550B3A39_8DB41ED01C6AF35F_6039_UN""","""CC(C)(COCC(NC1CCCCC1C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""BF55F8F1FC51D865_E3A8834959DBD4FD_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)N=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""ABE8E63C54D58DDE_FB16DAEA94AAD8C2_6039_UN""","""CC(C)(COCC(N1C(CCCC1C)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""FAE0F037529DC282_2076D0B78C289F75_6039_UN""","""CC(C)(COCCC2COC1(CCCC1)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""E156517BC5033018_1A493F7633D2317C_6039_UN""","""CC(C)(COCC1=CC(=C([N](=O)=O)C=C1)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""20755AD332E1E25C_D074913654DB5F19_6039_UN""","""CC(C)(COCC1=CC=C(C(NC)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D2669351FF9CEF8D_A2B08AC2F0A7B54F_6039_UN""","""CC(C)(COCC[N]1C(=CN=C1C)[N](=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""B39ADAB1E116F088_2E3BB8886B848B58_6039_UN""","""CC(C)(COCC1=NC=CC(=C1OC)OC)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""EAB5BC8D8644117E_0750EADD2F0C5E44_6039_UN""","""CC(C)(COCC1=CC(=C(OC)C(=C1)F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""4E4B765120ADC122_9E8E25EB8293B4B4_6039_UN""","""CC(C)(COCC2CCC1(CCCCC1)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""A6C30CB6B72D4879_8CE27A6F8AC9EFF9_6039_UN""","""CC(C)(COCC(C1CCC(F)(F)CC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""5ED3FC76EC7117E7_3FEBE162EEE48C89_6039_UN""","""CC(C)(COCC1=NC=C(C(F)(F)F)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""72D69D5E94A25B71_E6B2974B38202428_6039_UN""","""CC(C)(COCC1=CC=C([Si](C)(C)C)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""E52498608E123C1E_E1233FB706CF8C8B_6039_UN""","""CC(C)(COCC1=NN=N[N]1CC(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""84CA42FE5EB0C465_AAAC7AC3A659B5BB_6039_UN""","""CC(C)(COCC1=N[N](CC(F)(F)F)N=N1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""3241A0AAB9CE721B_18374283FB19D967_6039_UN""","""CC(C)(COCC1=CC=C(C=C1)C2CCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""8DFBDAF33350941A_904EB5D2F5F28FE8_6039_UN""","""CC(C)(COCC1=NN=C2[N]1CCCCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""01233E8E7ED026CC_BD3EE1ECD912DD44_6039_UN""","""CC(C)(COCC1=CC=CC(=N1)C(OC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""957058504C1D8BD0_4E49130DBF199D5F_6039_UN""","""CC(C)(COCC1=C([S](N)(=O)=O)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""9D467CD785E5C8D4_8446A6F64787FE0C_6039_UN""","""CC(C)(COCC(C(C(OCC)=O)(C)C)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""13CA2F6336D2D9C0_F38DB1BAAC5E0B36_6039_UN""","""CC(C)(COCC1=CC=C([S](Cl)(=O)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""5AFC692CC674D5BA_0FC6CAF477E8EA58_6039_UN""","""CC(C)(COCC1=CC2=C(N=C1)C=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""6256FC3ADD7B0D46_9BE19EFDFAEEB794_6039_UN""","""CC(C)(COCC1=CC=C([S](C)(=O)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""2804F3CCFC35185A_232FBC08FF951463_6039_UN""","""CC(C)(COCC1=C(C=CC=C1)[S](=O)(=O)Cl)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""22A7B90AA81886EF_13249B5A39786809_6039_UN""","""CC(C)(COCCCC1(CCOCC1)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""9A973F2A5C6DDD1F_5A415FF830721F2D_6039_UN""","""CC(C)(COCC1=C(OC)N=C(C=C1C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""44FCFEE7ABEA2D9D_48523AF3357A2316_6039_UN""","""CC(C)(COCC1=CC(=CC=C1)[S](=O)(=O)Cl)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""DB08278FA9C01503_C7C1E6C478CE1F99_6039_UN""","""CC(C)(COCC1=C(C(F)(F)F)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""040F789F3540DB21_0F04E2EC1C66750F_6039_UN""","""CC(C)(COCC(=O)COC1=CC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""83E2FB87D3F45C6E_1B12F09A948482D7_6039_UN""","""CC(C)(COCCC(CC(OCC)=O)(C)C)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""CA64F3CED6EC407B_2B195976A55E0900_6039_UN""","""CC(C)(COCC1=CC=C(NC(C)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""8CF7CE907D6B9587_53F8BBA038859FF0_6039_UN""","""CC(C)(COCC(C1=CC(=NC=C1)OC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""44FCFEE7ABEA2D9D_61ADA75630EC477F_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)[S](Cl)(=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""53F990A92735A82F_1B2930A7105B920F_6039_UN""","""CC(C)(COCC1=CC=C([S](F)(=O)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""6352CFF3BB8D1E12_9A76E6B23F9329C1_6039_UN""","""CC(C)(COCC(C1=CC=CC(=N1)OC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""413AC861531666F1_9EF4AA1A07822704_6039_UN""","""CC(C)(COCCN1C2=C(CC1)C=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""ED3187B8A3CC100C_4D2858211FD6B3BF_6039_UN""","""CC(C)(COCC1=C(N=C(C(C)C)C=C1)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""CE07C78A4FE053FA_48B7F8BFC9986357_6039_UN""","""CC(C)(COCC1=NC(=CS1)C(OCC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F16BE96F44BF5F1A_D65EC0CABA8E91B4_6039_UN""","""CC(C)(COCC1=N[N](CC(F)(F)F)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""77B972E176E1A740_EC4C29D64C1158E2_6039_UN""","""CC(C)(COCCN(C)CC1=CC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""3CD609FB37FEF515_517ED05ACE962DAC_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)[S](C)(=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""FFBA0B101FADC88D_152F3FC3A3F9D0BE_6039_UN""","""CC(C)(COCC1=C[N](CC(OC)=O)N=N1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""E0B7333FBFF2BA90_196E2FEE419BF095_6039_UN""","""CC(C)(COCC(N1CC(CC(C)C1)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""801D81AFF9B9129E_3D82CDFFE4872877_6039_UN""","""CC(C)(COCC(N1CCCCC1CC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0E0D7D698B1BC217_067C78063E9BC7E7_6039_UN""","""CC(C)(COCC1=CC=N[N]1C2CCCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""747ED6896BEB22F1_4380E5D9F7B1CCEB_6039_UN""","""CC(C)(COCC1=CC=N[N]1CC(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""BA57FB2F1BB09D37_B4467E451A2F3A48_6039_UN""","""CC(C)(COCC2COC1=C(C=CC=C1)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""5F570C7B40B51485_DC334C35A364508A_6039_UN""","""CC(C)(COCC(N(C)CC1=CC=CO1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""01641B685DD65732_EACDF8C50261BCA4_6039_UN""","""CC(C)(COCC(=O)CCC1CCCCO1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""277461BD2FD453F5_246D0F9EA2240573_6039_UN""","""CC(C)(COCCC(NC1=NOC(=C1)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""62F09F5843CD6006_3790AAB657BBBB99_6039_UN""","""CC(C)(COCC(=O)NC1=C(C=CS1)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""6ABC94ED4323750E_A889DA3228AD483B_6039_UN""","""CC(C)(COCC1=NOC(=C1)C2=CC=CS2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""4CDFD26524204C09_5D912F67973EB54F_6039_UN""","""CC(C)(COCC(OC)CC1=CC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D7520856EBE0FC09_29086D38C9AAC486_6039_UN""","""CC(C)(COCCOC1=C(C=CC=C1)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""ED7A1A2B4A5A16C2_D128802D8D6C2C62_6039_UN""","""CC(C)(COCC(NC(NCCCC)=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""0B0BD1D882AC6410_FC3D968CEFA8D778_6039_UN""","""CC(C)(COCC2=NC1=C(C=C(F)C=C1)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""036995AB76F3220E_8F0C2832176227B8_6039_UN""","""CC(C)(COCC1=C(ON=C1)C2=CC=CS2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""FEB1674271C1B176_BFD14851655366CD_6039_UN""","""CC(C)(COCC1=CSC(=N1)C[S](C)(=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""77DD98A08970D8CC_A02C47CED32481B5_6039_UN""","""CC(C)(COCCC(CC)(CC)C(=O)OC)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""2590D12129BF004F_305B04FF32DDAD58_6039_UN""","""CC(C)(COCC(C1=C(OC)N=CC=C1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0D3B2F308DBD9940_0043135A4446042C_6039_UN""","""CC(C)(COCC(C1=C(C=C(C)C=C1)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D541DB8BF98DC37E_DF6EBC0E7AA0B74F_6039_UN""","""CC(C)(COCC1=CC(=C(N(C)C)C=C1)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""4E350840CD5CB75D_67143D50B8362EE1_6039_DP""","""CC(C)(COCC(NCC1CCCNC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""CAA71078C5FB787B_E9140EDFB3443644_6039_UN""","""CC(C)(COCC1=CC(=N[N]1C)C(OC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""3BA93874299ED3FE_D41ED13C6E0E9E70_6039_UN""","""CC(C)(COCCOCC(C(F)(F)F)(F)F)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""ECB23E806E8029BA_C255A9C7994F068F_6039_UN""","""CC(C)(COCCCC1=C(OC)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""41CCD0AAACA30574_B6C3ACD5105778DA_6039_UN""","""CC(C)(COCC1=C(C(OC)=O)C=CC=N1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""14292D3A41038980_2BC77CC7C0F2C738_6039_UN""","""CC(C)(COCC1=NC(=CC(=N1)N(C)C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F7DA99C1CCEB454E_F5B088A34D780BA1_6039_UN""","""CC(C)(COCC(N(C)CC1=CC=CS1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""88CC24C3643C4351_CEC9F31753A14F6B_6039_UN""","""CC(C)(COCC1=NC(=NO1)C(OCC)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""4FDBC67769DE0E94_50A1E621E99673D8_6039_UN""","""CC(C)(COCC1=NC(=NO1)CC(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""6950EE8F52C9CCA7_F1287533394353C5_6039_UN""","""CC(C)(COCC(=O)C1=CC(=CC=C1)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D37C4C46E91E787E_C778B0B4B4BB71C0_6039_UN""","""CC(C)(COCC1=N[N](C=C1)C2CCCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""4B0719DADA80EA12_9B38387D9B1CCF32_6039_UN""","""CC(C)(COCCCSCC1=CC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0422E48A587C98E4_6ABE679C295EE326_6039_UN""","""CC(C)(COCC1=C(OC(F)F)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""AF3DD1C19828E143_5F817747F408CE2A_6039_UN""","""CC(C)(COCCCCOC1CCCCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""E008B9F64679D184_D39D17000855356D_6039_UN""","""CC(C)(COCC1=CC(=C(OC)C=C1)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""45E912C70008A6AE_EEA38745E38D2D22_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)NC(C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""5EF8539E874994AB_C6CF8E250AD422D7_6039_UN""","""CC(C)(COCC1=CC=C(OC(F)F)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""EAEB23C9E0B7D2D3_F33C0D2BD47039D0_6039_UN""","""CC(C)(COCC(C1=NC=C[N]1C(C)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D33DD5FD58AE8AD2_46FAFFC20948B6D7_6039_UN""","""CC(C)(COCC1=N[N](C)C(=C1)C(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""85DF91BC79EA789B_3222AE573921B7E2_6039_UN""","""CC(C)(COCC1=CC(=N[N]1C)C(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0DD9325B3A256972_BF5B5240A4F5E1C0_6039_UN""","""CC(C)(COCC(NC(CCCCC)C)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""3E368341E4E3DA73_8ECFAF2AC2DDF254_6039_UN""","""CC(C)(COCC1=C(C=CC=C1)OC2CC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""820D090E8AB4CB2E_A520B25B0EA60C4C_6039_UN""","""CC(C)(COCC(NC1=CC(=N[N]1C)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""61B24824BB2BE3F9_CA861738B0FBE92C_6039_UN""","""CC(C)(COCC(=O)CCC1=CC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""851E655398052B59_3913F858B57D893C_6039_UN""","""CC(C)(COCC(C1=N[N](CC)N=C1C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""8A2DAE696D0A8C3F_6D4725A7E6FB88A8_6039_UN""","""CC(C)(COCC1=NC(=NO1)CC(NC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D527F30961D80135_1583AE3892B4BAAB_6039_UN""","""CC(C)(COCC1CN1CC2=CC=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""76334EDE670A7389_DF4C48C92D15061D_6039_UN""","""CC(C)(COCCO[S](C[S](C)(=O)=O)(=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""540BF70A47D9511F_033AA0737038D2A5_6039_DP""","""CC(C)(COCC2=CC1=C(CCNC1)C=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""E370A3D32F8921D8_E1A0DD0561C6F591_6039_DP""","""CC(C)(COCC(N[C@@H](C(C)C)C(=O)O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""4E521A444829EB1B_6F7CEA81054C1FA0_6039_UN""","""CC(C)(COCC1=NC(=NO1)C(OCC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""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"""
+"""426C33C909C4A569_C3509629A361AE6F_6039_UN""","""CC(C)(COCC1=NC=CC(=C1)OC(C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""09CEB4424FCB05D5_661595E2E17F0377_6039_UN""","""CC(C)(COCC1=C(C=C(C(O)=O)C=C1)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""598537C74661B933_F69CBF17572C42F0_6039_UN""","""CC(C)(COCC1=NC2=C(N=C1)C=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
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+"""0721F27D9E167B6E_C53DE94322789A77_6039_UN""","""CC(C)(COCCSC1=C(C=C(F)C=C1)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""10C4255B24A488AA_412D982A38CBF686_6039_UN""","""CC(C)(COCCC1=N[N](C(C)(C)C)N=N1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""845E55413E5FED03_4A645FE5B28CEFA1_6039_UN""","""CC(C)(COCCC1CCC2=C1C=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""C99C1CFAD43B645A_066EAB635259BD28_6039_UN""","""CC(C)(COCCCC(CC(OCC)=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
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+"""6F0326ABB63D2754_C233256A20E8DC36_6039_UN""","""CC(C)(COCC2=NC1=C(C=CC(=C1)C)S2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""C289C29C1D0F8714_9CC39F19762DDF7A_6039_UN""","""CC(C)(COCC1=C(C(F)(F)F)N=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""9F16E016688FD295_AB42BDF23947DB78_6039_UN""","""CC(C)(COCC1=CC(=NO1)C(OCC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""0EA0B1734A5C14D4_161AD45625DA332A_6039_UN""","""CC(C)(COCC(NC1CCN(C)CC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""3B5F0C7F99774C44_5908895512383551_6039_UN""","""CC(C)(COCC1=CC(=C(C)C=C1)[N](=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0FABE9FC00BB0F1A_D5B5784EB7B3218F_6039_UN""","""CC(C)(COCC1CC2(CO1)CCCCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""1036978D620CC859_5ED8A50A598A8F78_6039_UN""","""CC(C)(COCC1CC2(CO1)CCOCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""1C1C760C74423836_DE93161E2031BB7E_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)N=CC=N2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
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+"""E8B07BAB11083C46_FECB3AE6B2413692_6039_UN""","""CC(C)(COCC2CCC1(CCOCC1)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""EA9C99CC02B775E1_B3CCCB0AFD44036E_6039_DP""","""CC(C)(COCC2OCC1(CCNCC1)C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""F65904C320B808C9_50E5F4C4DA5D4DA3_6039_UN""","""CC(C)(COCC2COC1(CCCCC1)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""696A725931E40723_1E44BEF7F34ADDF2_6039_UN""","""CC(C)(COCC(N1CC(C)(C)OCC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D77059CA571541BE_A4F73D09CED79AC4_6039_UN""","""CC(C)(COCC(C1=CC=C(OC)C=C1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""88938F70829E64EA_95C44739616F7BA3_6039_UN""","""CC(C)(COCC(=O)N1CC2CCC(C1)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""5FBC000708131923_8E5779921AFAF7B7_6039_UN""","""CC(C)(COCC(C1=CC=C(F)C=C1)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""A08CB52C923E8FD5_A06166C513690122_6039_UN""","""CC(C)(COCC(=O)NC1CCCCCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""41547C2CF68EF985_FBC869F0C93C2A2C_6039_UN""","""CC(C)(COCCCOC1=CC=C(F)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""923730B1EDBD04A8_0A97B595F898C98F_6039_UN""","""CC(C)(COCCOC(=O)C1=CC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""3F7EB07502416166_4736B4A8F49EBEF3_6039_UN""","""CC(C)(COCCC[S](NC(C)(C)C)(=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""F0064B84BB2633FA_E17C5C9A25795E3D_6039_UN""","""CC(C)(COCC(C1=C(OC)C=CC=C1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""89751B596005852B_8D19727ACD0D52B2_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)C(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""88A71614FAB311AB_2D7FA0CC6BC3B603_6039_UN""","""CC(C)(COCC1=C(F)C=C(C(=C1)C#N)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D1C1640A215C4263_6B5D28D051C148F0_6039_UN""","""CC(C)(COCC1=C(CC(C)C)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0146FE6540048574_970C013DDD92DF95_6039_UN""","""CC(C)(COCC(=O)NCC1CCCCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""C134CEADFEF495F3_C715FFF8C1F1B39A_6039_UN""","""CC(C)(COCC(N(C)C1CCCCC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""7ABCB786A4F0CE1E_A2C8C94C980DDA39_6039_UN""","""CC(C)(COCC1=NC(=NO1)COC(C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""8407AFBEC482BF6A_FE82E71DBCCFED5C_6039_UN""","""CC(C)(COCC2COC1(CCOCC1)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""B83BF0F9F5C8E9B2_9A251F34307548DD_6039_UN""","""CC(C)(COCC1CCCC(C(F)(F)F)O1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""329C7C2BD63A69A6_6E320748DBC0EC26_6039_UN""","""CC(C)(COCC1=NSC(=N1)C(OCC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""09A7E713AABFB54A_0A5A3939D4B31855_6039_UN""","""CC(C)(COCCCCCCCCCCC)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""1CD96511846115A9_300F9A09FEF1BAB4_6039_UN""","""CC(C)(COCC1=NN=C2C(=O)NC=C[N]12)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""84C09E3F5108DD2F_BD8B8EA673B06FC5_6039_UN""","""CC(C)(COCC1=NC(=C(S1)C(C)(C)C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""1BC422DF9D08E71F_4FB254A5816DD834_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)C=NC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""3D7FCDC8B1DD5189_F2B90AB58EB73957_6039_UN""","""CC(C)(COCC1=C(C)C=C(C=C1C)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""AC5297DD8EA9E466_52E49AD2088B14F3_6039_UN""","""CC(C)(COCC1=CN=CC(=C1)C(OC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""925EA34364BD6F6A_2BE5AF894B0723A7_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)[S](F)(=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""50220488B4E48276_D6BF8C4E6CA0F997_6039_UN""","""CC(C)(COCC1=C(CC(C)=O)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""C2270D401653CA5F_B08B48230E44CA2A_6039_UN""","""CC(C)(COCC1=CC(=NN=C1C2CC2)C)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""C6EF815012CC09AD_AF14A5BED318BAE8_6039_UN""","""CC(C)(COCC1=CC=CC(=N1)C(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""223FD46A3048BEA9_99FD1C9E3608F5EF_6039_UN""","""CC(C)(COCCCN1CCC(F)(CC1)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0AF29BF925D21475_910CD88EE06C6BA9_6039_UN""","""CC(C)(COCC1=C(C)C=CC(=C1)[N](=O)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""52A3389CD4C9516D_6EB2939F043590FC_6039_UN""","""CC(C)(COCC1=C(C=CC(=C1)C(O)=O)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F5A55625A886DC37_C745607B5B00F51D_6039_UN""","""CC(C)(COCCNC(=O)C1CCOCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""4561B476E97CE3CA_6866CF02FC47CBBB_6039_UN""","""CC(C)(COCC1=NC=CC(=C1)C(OC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0BBE979ED68499BF_AE44045C82602250_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)COCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""FFBE79B50C980053_35B16B7A94E63782_6039_UN""","""CC(C)(COCCOC1CC[S](=O)(=O)CC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""1D9E145D8D77B9A3_6F5E59D5FBC33DA9_6039_UN""","""CC(C)(COCC1=NSC2=C1C=CC(=C2)F)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""160C753997175C62_C39EFD1524DFA356_6039_UN""","""CC(C)(COCCCNC(C(CC)CC)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""2F22B28DF591BFAD_F2227FDE4CAB6A55_6039_UN""","""CC(C)(COCC1=C(F)C=C(C=C1F)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""B2C1D6C7CA7CB1B9_135FC2DF9461C868_6039_UN""","""CC(C)(COCC1(F)OC(=O)CC12CCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""1B227DC7348F9AA7_3AC88D9844E775AE_6039_UN""","""CC(C)(COCC1=C([N](C)N=N1)C(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""1C4D3877B6F90461_84CE74E99FBD0861_6039_UN""","""CC(C)(COCC1=C[N](C)N=C1C(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""FC9A80E7776773FD_D29C886E56DC08C2_6039_UN""","""CC(C)(COCC1=CC(=C(OCC)C=C1)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F77322675EE6ECD8_34C376010BDD3913_6039_UN""","""CC(C)(COCC2=NC1=C(F)C=CC=C1O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""A1F80379F1F04B29_C54A2A0185F494AF_6039_DP""","""CC(C)(COCC1OCCC12CCNCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""CE8A334DFD03CD5E_2D5A1CC46930DD0F_6039_UN""","""CC(C)(COCC1=CC=C([S](N)(=O)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""EE35038E62BC59D5_55C75166F87F4BA4_6039_UN""","""CC(C)(COCC(C1=CC=C([N](=O)=O)O1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""3BEBE19348F77FE3_CE36C04ACFB1C58D_6039_UN""","""CC(C)(COCC1=C([S](C)(=O)=O)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F3EE3DCCED3E1032_D71A3DBBBF3550B6_6039_UN""","""CC(C)(COCC1=NC(=NO1)C(OC)(C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""E7F5C6A067EF886F_712E0182A651A772_6039_UN""","""CC(C)(COCC(NCCCOC(C)C)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""C093AF70AC0C60F5_CB37B74B16583403_6039_UN""","""CC(C)(COCC1=NCCC2=C1C=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""16E5D821F3D34D46_3F691656F3731A3E_6039_UN""","""CC(C)(COCC1=CC=C(SC(F)F)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""E9A5E33DCF180678_87B02432119E5F31_6039_UN""","""CC(C)(COCCC(=O)NC1=NC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""A28A4C6042D0C3D1_8DB6F2CF0E2A04EC_6039_UN""","""CC(C)(COCC1=C(C)OC(=C1)C(OC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""13CA2F6336D2D9C0_370A98DB88CEF8A6_6039_UN""","""CC(C)(COCC1=CC=C(C=C1)[S](=O)(=O)Cl)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F3BC3B03CC4DFA97_CC7E21F6958353AA_6039_UN""","""CC(C)(COCC1=CC=CC(=C1[N](=O)=O)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""4BBA8A455C140FF9_38862E0C1EC3CFF4_6039_UN""","""CC(C)(COCC1=CC2=C(C=C1)C=CC=N2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""4ACD514919DB61A3_18F88681BC3ACA42_6039_UN""","""CC(C)(COCCCOC1=C(F)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""6617B74A2D956EF7_46A7B1D892592211_6039_UN""","""CC(C)(COCC1=C(C=CC(=C1)[N](=O)=O)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""9BE1791D21797F58_23D992E2C07017EB_6039_UN""","""CC(C)(COCCCNC(CC(C)(C)C)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""7FD8124C8A752A45_D4A29C9A01C1573F_6039_UN""","""CC(C)(COCCC(=O)N1CCCCCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F6198378FD138B6C_3279C4CF6D5626B7_6039_UN""","""CC(C)(COCC2=NC1=C(CCCCC1)S2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""EBB9E9A522CC75B6_665379015FF6D53B_6039_UN""","""CC(C)(COCC1=CN=CC(=C1)C(C)(C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""7DCF0380B26AD0E5_A4A28A7939642429_6039_UN""","""CC(C)(COCC2CCCC1(CCOC1)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""EAC6BECBADDA7639_3745C9B77B429F6F_6039_UN""","""CC(C)(COCC(N(C)CC1=CSC=C1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""5C7E18A8CBD424EF_C9C3448FF56ECE01_6039_UN""","""CC(C)(COCC1CCCC(F)(F)C(N1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D8EDE1D90FE6B3CC_620D46986A6863A9_6039_UN""","""CC(C)(COCC1=NOC(=N1)N2CCCC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""D06DECC9B7C4164A_D9E0178D30F57BEF_6039_UN""","""CC(C)(COCC1=C(C)OC=C1C(F)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""FB2CF7EF53E7D0AA_54AD399B3123439D_6039_UN""","""CC(C)(COCC2=CC1=C(CN(C)C1)C=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""83CC1381DDDDBA08_96F73D7CE455D7CE_6039_UN""","""CC(C)(COCC1=C(C(OCC)=O)[NH]N=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""F1C3D19F7510B66E_0937A89CBCCFE3BF_6039_UN""","""CC(C)(COCC1=CC(=C(C)O1)[S](=O)(=O)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""021ADCBD30A7656E_EDBCCF82326F694A_6039_UN""","""CC(C)(COCC1=CC=CC2=C1N=C(C)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
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+"""FBC426C15FF38F1A_CC6E38473A36F59E_6039_UN""","""CC(C)(COCC1=CN=C2[N]1C=C(F)C=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""9738F8F1E658A599_AB916719C838228A_6039_UN""","""CC(C)(COCCCC(=O)N1CCCCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""2E6CB198DCCD37FB_19B023C707787967_6039_UN""","""CC(C)(COCC2CN1CC(CCC1=O)O2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
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+"""3200B9679AC7B1C1_E18002B6F6FE851A_6039_UN""","""CC(C)(COCC1=NOC(=C1)C(OCC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""FBCFA61B992E08F6_2D4AA04378C0E657_6039_UN""","""CC(C)(COC[C@@H](C(C)(C)C)N[S](=O)(=O)C)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""5769E0A039A28386_9299100505E6ADC4_6039_UN""","""CC(C)(COCC(=O)C1=CN=C2[N]1C=CS2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
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+"""E17FECAFEF5DCC88_62B1CCF042578612_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)SCCC)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""4A9D15E3B33CC63B_F8C4711C88C422D9_6039_UN""","""CC(C)(COCCCC1=C(F)C=CC=C1F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""0B01926F6D0D7F3E_A5D57F5A8B33BCE0_6039_UN""","""CC(C)(COCC1=CC=CC(=N1)C(C)(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""996A525F9F6831F6_9F7DEEA78671D2B0_6039_UN""","""CC(C)(COCC1=CC=CC2=C1OC(=N2)C)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""7DF589DAB1828DD7_45C3786E34D13BC6_6039_UN""","""CC(C)(COCC(NC(N=[S](C)(=O)C)=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""D95E7F24661C8E1C_7B6883729DAED064_6039_UN""","""CC(C)(COCC1=C(C(F)(F)F)N=CC=N1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""E1C9165E5620DB4A_209CE412A47264D9_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)[S](C)(=N)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""C1053946722BE963_CCF531ED8A43BCA9_6039_UN""","""CC(C)(COCC1=NOC(=N1)C(OCC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""E965C0D77C98DB96_DDCB37215443E65D_6039_UN""","""CC(C)(COCC1=N[N](C)C=C1[S](=O)(=O)Cl)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""5E7F08113A4B0DAD_E2AB3BCB399D2603_6039_UN""","""CC(C)(COCC1=CC(=N[NH]1)C(OCC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""8FEDEA0A2F05EC6E_87A359495D569472_6039_UN""","""CC(C)(COCC1=N[N](C)C=C1[S](=O)(=O)N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
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+"""F199CCA41E377A4C_E3FAF7CB65170B97_6039_UN""","""CC(C)(COCC(OC1CN(C)CCC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""C7BC10D5A891BC04_DC75A3806513D45A_6039_UN""","""CC(C)(COCC1=CC(=NC(=C1)OC)OC)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""D3207FF0817A5571_11464104271CE67C_6039_UN""","""CC(C)(COCCC1(C(O)=O)CCOCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""52677889E76E58F6_4B5DF76BF0AAB70E_6039_UN""","""CC(C)(COCC1=C(C(OCC)=O)C=NO1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""FB8D835824E25D53_7B20199C94BECF3B_6039_UN""","""CC(C)(COCC1=CC(=NC(=N1)C2CC2)C)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""DEF28690BFB1F3EB_882D100F15D8B092_6039_UN""","""CC(C)(COCC1=CC(=NC(=N1)OC)OC)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""AD8396409C663B9E_E6B96B7FA5139E63_6039_UN""","""CC(C)(COCC1=C(C(C)(C)F)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""9CF818833412131F_EA5DB44BEFE7ABA0_6039_UN""","""CC(C)(COCC1=C(C(OCC)=O)C=N[NH]1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""C9F808187CA5069E_5E355467ADA79F6F_6039_UN""","""CC(C)(COCCOC1(CCOCC1)C#N)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""309D499D6833B50D_CC0098C7C6807342_6039_UN""","""CC(C)(COCC#CC1=CC=CC(=C1)OC)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""A58267CEF3E9E2AC_A685C9FCCC3C8AF5_6039_UN""","""CC(C)(COCCCO[S](C(F)(F)F)(=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""6E99621BBD7F846C_37BB3E343CD4BE50_6039_UN""","""CC(C)(COCC[S](=O)(=O)C1=CC=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""9C3EF6E5734251BB_3C5725800A447566_6039_UN""","""CC(C)(COCC1=CN=C(OC)C=C1OC)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""6DE7CD50B139410B_B7CEC8ADB2E22346_6039_UN""","""CC(C)(COCC1=CN=C(C(OC)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""B4AB2460231EDC9C_11418B09621D5678_6039_UN""","""CC(C)(COCC1=C([S](F)(=O)=O)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""947BA4D2A2202C29_C9B157D97FB8B4F1_6039_UN""","""CC(C)(COCC1=NC=C(C(C)(F)F)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""6C7DB1BBE87931A8_6CE4CD4DF07156B2_6039_UN""","""CC(C)(COCC1CN1CC2=C[N](C)N=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""8C68116090004CE4_F8A6C069742A30B9_6039_UN""","""CC(C)(COCC1=NC(=C(C=C1)[N](=O)=O)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0B9088245286361E_861A9FEF205E0804_6039_UN""","""CC(C)(COCC1=CC=CC(=N1)OC(F)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""1548F94488F15E93_C10F54E8D83E353B_6039_UN""","""CC(C)(COCC2=C[N]1C=CC=C(F)C1=N2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""562C6B4EF4CACE9F_941F18269E4026DA_6039_UN""","""CC(C)(COCC1=NN=C(O1)C2=CC=CO2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""9E1D85156D794063_FCB91661E18E9F5D_6039_UN""","""CC(C)(COCC(=O)C1CC2=C1C=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""D0F0847A29325F61_D46BC318FABDF690_6039_UN""","""CC(C)(COCCN1CCN(CC1)C2CC2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""3D07B4CCE55A0532_F2A480CF17C8DE92_6039_UN""","""CC(C)(COCC(=O)N1CCCCCCC1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""7BA7DBCE81703BD3_B988150D5FD4C588_6039_UN""","""CC(C)(COCC(NNC(C(C)(C)C)=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""478253BF1BAA6557_1FF7765F5DECB1F3_6039_UN""","""CC(C)(COCC(C1=C(C)[N](C(=C1)C)C)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""5CFD9B063376BAB5_D24204A18F97489F_6039_UN""","""CC(C)(COCC1=C(SC(F)F)C=CC=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""5B89E3824D5ECD5E_BA90FB508E48E6DB_6039_UN""","""CC(C)(COCC1=CC(=C(O1)C)C(OC)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""A910DB90583F5C5A_118702374E44F681_6039_UN""","""CC(C)(COCCC1=CC=C([N](=O)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""068F676F6D313D21_7329E162AE263FC9_6039_UN""","""CC(C)(COCCCCC(N[S](C)(=O)=O)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""EF5F31C2E0A0B64D_86F140D28F1AE164_6039_UN""","""CC(C)(COCC(=O)NC(=O)C1=CC=C[NH]1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""A60C4F60638A4949_9B32FE68EE834E3C_6039_UN""","""CC(C)(COCCOC1=C(C=CC(=C1)C)C)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""0808A1F433A14995_F5E89C2B4BDFD0FF_6039_UN""","""CC(C)(COCC1=CC=CC(=C1)OCCC)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""9265FA9CC0D8295A_C6F5BEA36DD1522C_6039_UN""","""CC(C)(COCC1=C([N](=O)=O)C=CC=C1F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""38A77D5A3420E2B1_84E54D4ADEB6C4C7_6039_UN""","""CC(C)(COCCCN(CC)CC(F)(F)F)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""22296F434D82E742_F4AB287F10BE5852_6039_UN""","""CC(C)(COCC1=CN=C(C(C)(C)C)N=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""299E46DD06F3EF30_FCF5B13A7701E710_6039_UN""","""CC(C)(COCC1=NC=C(C(OC)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""708B8EF839445820_9E3FD072DBD665B1_6039_UN""","""CC(C)(COCC(N(C(CC(C)C)C)C)=O)[N]1C=CC=N1""",21,"""BFECF317E3173301"""
+"""0064E8954DF76303_6D133CF64BE45F9A_6039_UN""","""CC(C)(COCC(N1CC(CC)OCC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""86ABE349A4D90593_837B6EF74905215A_6039_UN""","""CC(C)(COCCC1=CC=C(C(N)=O)C=C1)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""CC02002BBE500BA9_2067D6DF5C0412CC_6039_UN""","""CC(C)(COCC(C12CC(C)(C1)OCC2)=O)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""D292076200333FB4_EE5F016FEA5E1EB1_6039_UN""","""CC(C)(COCC1=C2C(=CC=C1)N=CC=C2)[N]3C=CC=N3""",21,"""BFECF317E3173301"""
+"""A16DB7607E271814_04D5D0524EA27762_6039_UN""","""CC(C)(COCC(C1CCC(C)(C)CC1)=O)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""DE2E820AE2094D49_C99618E8E4F488CC_6039_UN""","""CC(C)(COCC1=C(C=C(C(N)=O)C=C1)F)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""84441D7683DE7778_EA7C0E133AA6BCDB_6039_UN""","""CC(C)(COCC1=C(C=N[N]1C)[S](=O)(=O)Cl)[N]2C=CC=N2""",21,"""BFECF317E3173301"""
+"""153963E5C3679DCB_678097A8C52037AE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C(N)=O)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""A3FDB16349721E35_DAEBB74DF9B827F2_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(F)C=CC(=C3)C#N""",21,"""D5F4CEDDBB594CA3"""
+"""2CA1CF10CBC6DB01_ED7814DC0DB36785_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N3C(C=C(C)O3)=O)=O""",21,"""D5F4CEDDBB594CA3"""
+"""F50CB2BD911A0758_04C893AE1EF9DFA3_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NC3=CC(=NO3)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""B40A184E0EDC730F_C3F2EF3CC2E49168_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NC3=NN=C(C)S3)=O""",21,"""D5F4CEDDBB594CA3"""
+"""4FF6206618EB35DB_9614D8251B62AC4B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(OCC)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""14895275D8A48D4A_61E80B87C1B85F65_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCCCCCCC""",21,"""D5F4CEDDBB594CA3"""
+"""6B3B9445FACC18E3_D983C29105ACA756_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=CC=C(F)C=C3)=O""",21,"""D5F4CEDDBB594CA3"""
+"""5C0FBD362F1B6EEB_4386C6FA974547D6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(OC)C=CC(=C3)C""",21,"""D5F4CEDDBB594CA3"""
+"""D4BE871F901E1C0C_1424BA690B8B10E4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC(=O)NCC=C""",21,"""D5F4CEDDBB594CA3"""
+"""AE7AF33F9F54EEF0_2C0758EAD4FBC2BD_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=CC=C(C)C=C3)=O""",21,"""D5F4CEDDBB594CA3"""
+"""97C63DCD4940E5E8_98C3E194BE7821EB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NC3=NOC(=C3)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""00A605B046565720_44282665866154FB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC(=O)NC3CCCC3""",21,"""D5F4CEDDBB594CA3"""
+"""79C1A622560BF1D0_CBBF2CB596E0AD9E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N(CCC)CCC)=O""",21,"""D5F4CEDDBB594CA3"""
+"""F67ED04990681DE4_A5438A37AA65F85F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C(O)=O)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""DBFFB218B23F25E5_4792CC2DF9376CDD_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N(C(C)C)C(C)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""C9E396AF35FA6EB0_7697E71DD2925181_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C[N]4C(=N3)C=CC=C4""",21,"""D5F4CEDDBB594CA3"""
+"""7540A0EA1B571432_65478D87C5F90D13_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C(C)[NH]C(=C3)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""426705D807F347DE_E46A5C6C904EA661_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCSC3=CC=C(F)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""21C7D41C11484027_6828152AFCE65D68_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N3CC(C)OCC3)=O""",21,"""D5F4CEDDBB594CA3"""
+"""31D3CA8B525B6FAB_2147849009B4B30B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NC3=NC(=CS3)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""BB020C3789D2AF60_E1F87929C3F49479_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=NO3)CCCC""",21,"""D5F4CEDDBB594CA3"""
+"""3357430781D9C553_B62F5E3811FF93AE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(OC)=O)C=CO3""",21,"""D5F4CEDDBB594CA3"""
+"""B3A5C62C0BED22B6_2AABC688AF12CAE4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N(C)C(C)(C)C#N)=O""",21,"""D5F4CEDDBB594CA3"""
+"""440B3819EC90B244_178778A95225AA45_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NCCC(OC)=O)=O""",21,"""D5F4CEDDBB594CA3"""
+"""AE819A007350D3E2_A4C253E48B9A74E5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4COC3(CCCC3)O4""",21,"""D5F4CEDDBB594CA3"""
+"""543FB888E600D0AB_79A0F8578E7BE029_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCOC3CCCCC3""",21,"""D5F4CEDDBB594CA3"""
+"""BB9B43EBCE4294AD_46F03C22A47EB1F1_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C(C(C)(C)C)O3""",21,"""D5F4CEDDBB594CA3"""
+"""6E6F15211F6A64BD_89FB616CDC962608_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(OC)=O)OC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""6A52F6F3373229DB_11EF190445CCE4F8_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC=C(C(C)(C)C)O3""",21,"""D5F4CEDDBB594CA3"""
+"""9439E850BE222428_CA68FAE42018FA87_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=CC=CC(=C3)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""FAD8483C3BF8D704_1FB26B3E216CF3A0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CSC(=N3)CCCC""",21,"""D5F4CEDDBB594CA3"""
+"""4AC0B70C968C1D58_89FFDE1415EAF73B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NCC3CCOC3""",21,"""D5F4CEDDBB594CA3"""
+"""F209DD26C101767F_4EC4C4762B0F3771_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N(C)C3=NC=CS3)=O""",21,"""D5F4CEDDBB594CA3"""
+"""5806586F709B32A1_30D40D842B6D204F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NCCC(C)(C)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""025A854B1415D2C6_3268B9BEA6BD2AB8_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(N(C)C)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""B942592B5936F395_CDAE1889794E94B6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC(=N3)CCCC""",21,"""D5F4CEDDBB594CA3"""
+"""3D448BDFE3FB32C7_43C5515A427A9461_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=NO3)C(OC)=O""",21,"""D5F4CEDDBB594CA3"""
+"""0A729DCFE5E6DF1B_2285672E4D7F5F74_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC[N]3C=C([N](=O)=O)C=N3""",21,"""D5F4CEDDBB594CA3"""
+"""AC4EB51FE7046CBD_4A5987AD710FFE03_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=NO3)CCOC""",21,"""D5F4CEDDBB594CA3"""
+"""0A5EDD1FE72935F9_3AE4B77C97EFCE86_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3CCOCC3""",21,"""D5F4CEDDBB594CA3"""
+"""EB418E0C55B06305_C8F7243B49672DBC_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC4=C(C=C3)OCC4""",21,"""D5F4CEDDBB594CA3"""
+"""3CF7C16776A645FD_40D5CC224BB8BEF0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC4=C3CCCC4""",21,"""D5F4CEDDBB594CA3"""
+"""FD2E0E24B2C3520E_529302CC1810E92C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC(NCC(OC)=O)=O""",21,"""D5F4CEDDBB594CA3"""
+"""113BD3F9AB92F9DA_1802CF3254CE5D9E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(OC)=O)SC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""74F42D6070228DCB_7858FDBDE9DBE914_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC[N]3N=C([N](=O)=O)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""C34CE31CFEC3271D_AF268EC2747B625A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCC[N]3N=CC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""AAA902E876A0F887_12BC25BDD6F3F1D0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C(OC)=O)NC(=O)C""",21,"""D5F4CEDDBB594CA3"""
+"""02DE7DE4455D83AA_C7FAC997882F7740_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NNC(=O)C3CC3""",21,"""D5F4CEDDBB594CA3"""
+"""A538CFB56FA1D9D3_F2D03A03C1903B88_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C[N](N=C3C)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""E3577A64D904EB3E_54FFD2D3ECA7C27B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3=CC=NC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""8D5B1549059529F7_72FC6BE2410A8F8D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3=CC=C(CC)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""2DE27EB1E873C4EE_716AE0E5FC3CA7D4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C[N](C)N=C3[N](=O)=O""",21,"""D5F4CEDDBB594CA3"""
+"""A5D7ECDA35A28523_4F6B6898ACD59858_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCOC3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""A044136914F8703D_D18BE7C42DE2462B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3)N(C)C""",21,"""D5F4CEDDBB594CA3"""
+"""0342A9B5EB37929F_C0419374F218DC95_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCOC3CCCCCC3""",21,"""D5F4CEDDBB594CA3"""
+"""011DC6ECEE448F56_BA173F1F29F3E346_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(N=C[N]3C)[N](=O)=O""",21,"""D5F4CEDDBB594CA3"""
+"""30CA854DCE5CE44F_D31B915337B07D38_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=NC3=C(C=CC=C3)S4""",21,"""D5F4CEDDBB594CA3"""
+"""747702EEAB54629C_8D85D9BF7526BCE6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN(C)C3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""99F5241DFADB2785_C9A9B5B96AB4E839_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC[P](OCC)(=O)OCC""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""BBE5A35C5714F92F_103EFDD33F04449B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC[N]3C=C(C(O)=O)C=N3""",21,"""D5F4CEDDBB594CA3"""
+"""D851FCE657729648_6143014A07AD19D6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCNC(C(F)(F)F)=O""",21,"""D5F4CEDDBB594CA3"""
+"""AE212494C4CD628A_F77245ED2FF7036A_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCNC(=O)C3CCCC3""",21,"""D5F4CEDDBB594CA3"""
+"""5F48F1732900D099_6AB6D6D4867A7D5E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC4=NSN=C34""",21,"""D5F4CEDDBB594CA3"""
+"""0E37C9F5739E7121_FA967EED0D2C0528_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3=CC(=C(F)C=C3)F""",21,"""D5F4CEDDBB594CA3"""
+"""7E7A992215A505EE_D5F293958174CD25_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC#CC3=CC=C(F)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""7D540F631A4E8B96_777D5803E4EAB2FE_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3)COC""",21,"""D5F4CEDDBB594CA3"""
+"""A3802EFE5225502F_71F43AFA78B4264F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3)C(O)=O""",21,"""D5F4CEDDBB594CA3"""
+"""4F96E148A3D95C94_59BDB6FD754D6E20_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3CCSC3=O""",21,"""D5F4CEDDBB594CA3"""
+"""DE2BFF7D16C76B08_4572E3A56AC2CD45_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C=C(F)C=C3)C#N""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""8AC7D7C03DDBEBA7_52B9D7550F43D157_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC(=O)N3CCOCC3""",21,"""D5F4CEDDBB594CA3"""
+"""EDF9501FD6F3BA3B_A703B862B57727E5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4=CC3=C(C=CC=C3)O4""",21,"""D5F4CEDDBB594CA3"""
+"""5A2C854CC4C0F599_D558240DFB0D154F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N(CC)CCC#N)=O""",21,"""D5F4CEDDBB594CA3"""
+"""B73EF7C4DE970109_4C86DA5941382D0B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=CS3)C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
+"""5245DFA9444A5D77_A101584C9A1E618F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC=C(OCC)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""FAEC8BB19350865A_82240B4330841E4C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C(C(C)C)[N]3C""",21,"""D5F4CEDDBB594CA3"""
+"""947B3B688C6B7233_F4F095D03DF005D7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=CC(=N3)OC)C""",21,"""D5F4CEDDBB594CA3"""
+"""768B30529980663E_7CA19B34CD540F19_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N3CCN(C)CC3)=O""",21,"""D5F4CEDDBB594CA3"""
+"""46C82BE3D60A5F4D_775E75C329803967_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCC3=CC=CC(=C3)C""",21,"""D5F4CEDDBB594CA3"""
+"""43DC788D5EB46734_F604517FAD10CCC0_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=NC=C3)N(C)C""",21,"""D5F4CEDDBB594CA3"""
+"""D96F86C74B6234C2_694248FF0FA36C3C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=CC(=C3)OC)C""",21,"""D5F4CEDDBB594CA3"""
+"""0E8935CDF251C414_0503233BDD60DCEB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(NCCCN(C)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""AEA21B166BC0B03D_389599ED411D1191_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCC3=CC=C(C)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""5A428C14B79C9C2A_D46326C0A38CED16_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C(F)F)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""ED8976B36D82E496_D99CC4F2098E9514_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NCC3=CC=CO3""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""6B40E1499F63CC04_17BF0BA01675D71B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)N(CC=C)CC=C""",21,"""D5F4CEDDBB594CA3"""
+"""3FF0AB048DB061E1_D0B436C025C61D57_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=N[N]3C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""34E2C58934E38132_28347D25E673E1D7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C[N](C)N=C3C(F)F""",21,"""D5F4CEDDBB594CA3"""
+"""3481AC7828430043_EE900F3D11A19D0C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCC3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""2CCECB8C8A302AE6_8D65D36A75A14D80_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N(CC)CC(=C)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""A0C3D6232F664BE0_EDD24DB4BA43387B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C)C=C(C=C3)C#N""",21,"""D5F4CEDDBB594CA3"""
+"""C71F07E67BE2D05C_55582E6266654D85_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3C#N)F""",21,"""D5F4CEDDBB594CA3"""
+"""5AA55AD76E76B7F1_2B02748F9E81CB50_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(F)(F)F)[NH]N=C3""",21,"""D5F4CEDDBB594CA3"""
+"""9F687DA5348B1515_DE33085EE1DE6A95_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCN3CC[S](CC3)(=O)=O""",21,"""D5F4CEDDBB594CA3"""
+"""F8D8718E3A548685_D559CB229E8B78A1_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C([S](C)(=O)=O)S3""",21,"""D5F4CEDDBB594CA3"""
+"""DC85D5C1B27079F8_556F4415ABB191E1_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N3CCCC3(C)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""3A2D81319990ED03_11693541D2342995_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3(CCC3)C#N""",21,"""D5F4CEDDBB594CA3"""
+"""1F0DB97C7ACAEFAB_A03E3AC1EA664D07_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CCC3(CCCC3)O4""",21,"""D5F4CEDDBB594CA3"""
+"""8DD77378B9D4348E_FC37867AFCA39E72_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(CCC(OCC)=O)=O""",21,"""D5F4CEDDBB594CA3"""
+"""81EA48745FBC98A8_080DAA335A69B01C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCC[S](CC)(=O)=O""",21,"""D5F4CEDDBB594CA3"""
+"""2C88EF3B7B036021_62444F406E7BCEEF_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)C3CC4CCC3C4""",21,"""D5F4CEDDBB594CA3"""
+"""61A543F1FEEFAE1E_3C7244DD13199FB2_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCN3CCOCC3""",21,"""D5F4CEDDBB594CA3"""
+"""ED6481F0F14F491B_8BDB141C252FAB17_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=C(C=C3)C#N)F""",21,"""D5F4CEDDBB594CA3"""
+"""16971430198A89D8_F21FD26CA57416E4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCC3(C)OCCO3""",21,"""D5F4CEDDBB594CA3"""
+"""7AB3E24B22A0363F_60B7F6C7F35C21AF_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CCC3(CC3)C(=O)O4""",21,"""D5F4CEDDBB594CA3"""
+"""C8080D0EECBE8C97_82A60181F37DD5F7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCC3=C(CC)C=CC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""C30326FE0422E50F_B8060F6B36AD0074_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC4CC3=C(C=CC=C3)O4""",21,"""D5F4CEDDBB594CA3"""
+"""DD6B4D80169BC9D7_423C516927D076A4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NN=C4[N]3CCCC4""",21,"""D5F4CEDDBB594CA3"""
+"""D3CEBFD8C6317A95_C51BCA8FD3674C92_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)C3CCCCCC3""",21,"""D5F4CEDDBB594CA3"""
+"""F26AA7C1417A56CA_47D337CF14DB21FC_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NOC(=C3)C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
+"""072D4C2D3A0A7FD0_B1C4CF26E05352C9_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N3CCC(C)CC3)=O""",21,"""D5F4CEDDBB594CA3"""
+"""B5A49C667F7B0602_075E71C4B9D3AF51_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(N=C(OC)N=C3)C""",21,"""D5F4CEDDBB594CA3"""
+"""97B36DE59E2C95A8_DDB5C5EEAA863564_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC=N[N]3C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
+"""A82C487BB543E01D_E3F94EB1DFB9FA6C_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3N(C(C)C)CCCC3""",21,"""D5F4CEDDBB594CA3"""
+"""23C0264595D0A656_92759F5A6C239CE1_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCCC3CCOCC3""",21,"""D5F4CEDDBB594CA3"""
+"""542BF76282A8FA71_0465C6EEEF3270B5_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCCC3=CC(=NO3)CC""",21,"""D5F4CEDDBB594CA3"""
+"""8F9649ACAE5EF21B_10E816FDACE31890_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=CN=CC(=C3)F)=O""",21,"""D5F4CEDDBB594CA3"""
+"""C18DDD49FE941060_6465B6AE35F1B3BF_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C(C(OC)=O)(C)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""1B8FD474DF6B985E_A05962D1FDDB445B_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(OC)C3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""D6DEE2E3C95D3FD5_247F5FA252C98C88_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=NC=CC(=C3)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""621E06DED48D74D4_829FA27A0ED103CB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(COC)C=C3""",21,"""D5F4CEDDBB594CA3"""
+"""D9A3D665E20F29FC_75A7F449F4A5BA84_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=N[NH]C(=N3)C(C)(C)C""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""23B8649814F96426_B523CA92EC774B06_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=C(C)N=CC=C3)=O""",21,"""D5F4CEDDBB594CA3"""
+"""5DB3CE0118759C55_FF417038245BD94F_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=N[N]3CC(F)F""",21,"""D5F4CEDDBB594CA3"""
+"""D81FBDECDDFB2655_D67088310F1A6F16_6039_UN""","""O(C2CCC1(CCCC1)CC2)CCSCC3=CC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""C2C4802B9281C018_59B19301BC88FF6D_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NCC3CCCO3""",21,"""D5F4CEDDBB594CA3"""
+"""B67EB8B2D4832314_5926FD53536B34F6_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)N3CCCCCC3""",21,"""D5F4CEDDBB594CA3"""
+"""93AE189C940B2D3F_21A9F60B45EC2BA4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N3CCCC(C)C3)=O""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""04FA2FD52EF96FA2_A3DDD99CDCDF9ADB_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC=N[N]3CC(C)C""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""69ECE7967D3705F2_C81165C827816AAF_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=C(OC)C=C3)C""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""A452C001451DFBA7_D98675CA3C517901_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(N(C)CC(F)(F)F)=O""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""E9F579A34F5DC80C_94725F98472BA7B4_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=COC(=C3)[S](N)(=O)=O""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""5EE08D2108B81FE3_A4C3576DBC81756E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3)C(C)C""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""A34A9F17EB0C1277_FBDC46C1EAC8BF66_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=CC(=C3C)OC""",21,"""D5F4CEDDBB594CA3"""
+"""80C20B043487AEAE_ED0BD03FC2D714FD_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=NC(=NO3)CC4CC4""",21,"""D5F4CEDDBB594CA3"""
+"""E6637953CA9A454F_4359AF772B25E720_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC=C(C(C)(C)C)O3""",21,"""D5F4CEDDBB594CA3"""
+"""5CF49ED4DD2F5ED5_98E55B54C9FB70B3_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C=CC=C3)N=[N]#N""",21,"""D5F4CEDDBB594CA3"""
+"""D7156AF9F0D2E00A_AB29454C1F43E8B7_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=C(C(OC)=O)C=CS3""",21,"""D5F4CEDDBB594CA3"""
+"""859917BFE05DC003_9E54EB61E928ED17_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(=O)NC3=NC=CC=C3""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""2D8CD7AA6A87AE62_CE11DB5CB69C04DA_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC3=CC(=CO3)C(F)(F)F""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""9B2A8430809C2AB2_EAA1074C36DD578E_6039_UN""","""O(C2CCC1(CCCC1)CC2)CC(C3=N[N](C(=C3)C)C)=O""",21,"""D5F4CEDDBB594CA3"""
+"""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"""
+"""9CA2740478F77430_A741F4916F554A1D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=CC(=C3)OC(F)F""",21,"""E32042D8467CE435"""
+"""E23FC126C46693B9_16D93D8B95C5D48B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(C(OCC)=O)O3""",21,"""E32042D8467CE435"""
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+"""D9BCC96B3A7D6D19_CB5A84F5FE8A5F7E_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NCCC3=CSC=C3""",21,"""E32042D8467CE435"""
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+"""26F97DE2B7502FFA_A4159950569D6B1F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC4=C([N]3C)C=CC=C4""",21,"""E32042D8467CE435"""
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+"""455CA5ABD1C5DE52_3B5DC3C94D76E9A7_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=NC3=C(F)C=CC=C3[NH]4""",21,"""E32042D8467CE435"""
+"""E30043DB6CF87F56_723341C502EE671A_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC(=CO3)C(O)=O)=O""",21,"""E32042D8467CE435"""
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+"""5321932708C56822_28FD80A948A86E30_6039_UN""","""O(CC12CN(CC1)CCC2)CCCCC[N]3C=C(C)C=N3""",21,"""E32042D8467CE435"""
+"""7EFFE592238CAA16_BF5E62B3752412B7_6039_UN""","""O(CC12CN(CC1)CCC2)CCC(N(CC(OC)=O)C)=O""",21,"""E32042D8467CE435"""
+"""7F95F62041313C65_5E25C801F800A94E_6039_UN""","""O(CC12CN(CC1)CCC2)CCC[N]3N=C([N](=O)=O)C=C3""",21,"""E32042D8467CE435"""
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+"""9DD37AD4339A1EFF_AE77B0082406FCAA_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CSC(=N3)C4=COC=C4""",21,"""E32042D8467CE435"""
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+"""E0C87175B75C180D_022909FD49AEC43A_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC=C[N]3CC(F)(F)F""",21,"""E32042D8467CE435"""
+"""53AA7D288B1923AA_83E3B8315F0B554E_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3=NC=C(C(C)(C)C)O3""",21,"""E32042D8467CE435"""
+"""94F640D4D54D5B07_8677E0CB85BCC8F7_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N(CC(OCC)=O)C)=O""",21,"""E32042D8467CE435"""
+"""935CDA271C6B026C_1A95096FD94E8707_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC(=C(C=C3)SC)OC""",21,"""E32042D8467CE435"""
+"""9109311719B6D82E_F6E89CCFD640458C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3OCCC4=C3C=CC=C4""",21,"""E32042D8467CE435"""
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+"""5DB7843AC6915FA0_951AE81CA777F361_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=N[N](C(CC)CC)C=C3""",21,"""E32042D8467CE435"""
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+"""057B740917AB533F_DF2E6AE78EEB4FCA_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3=CC4=C(C=C3)OCC4""",21,"""E32042D8467CE435"""
+"""B53794BF9C00D66C_A3CB5DBD9B15400D_6039_UN""","""O(CC12CN(CC1)CCC2)CCN3CCN(C(C)C)CC3""",21,"""E32042D8467CE435"""
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+"""EFA6C0BE886C4F57_8A57DC8A82B9C2B7_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=CC=C(SC)C=C3""",21,"""E32042D8467CE435"""
+"""E202B15A3E7C2C0E_33225019D9F8666C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(C=C3)OCC#N""",21,"""E32042D8467CE435"""
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+"""B99729C33D768C54_E6A07C2F500C259F_6039_UN""","""O(CC12CN(CC1)CCC2)CCC3=CC=C(C(O)=O)C=C3""",21,"""E32042D8467CE435"""
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+"""968E95809E95708F_8DA26327B4F56978_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)C4=N[NH]C=N4""",21,"""E32042D8467CE435"""
+"""5C2C5C4AC68B09C0_94F14D43D33B0DC6_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC(=C(C=C3)F)C)=O""",21,"""E32042D8467CE435"""
+"""C4DF3AC966194CB0_D845CFC4F92EE837_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=NC3=C(C=CS3)C(=O)N4""",21,"""E32042D8467CE435"""
+"""0C0D2C5AA8E6D220_81CBC4FCBFC0903D_6039_UN""","""O(CC12CN(CC1)CCC2)CCCNC(=O)C3CCCC3""",21,"""E32042D8467CE435"""
+"""3E1F86C3DAAB1363_408DBAB1BE76DA66_6039_UN""","""O(CC12CN(CC1)CCC2)CCN[S](CCCOC)(=O)=O""",21,"""E32042D8467CE435"""
+"""23DE405125D4E48A_75BBEF365C17F5AB_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(OC(C)=O)C=C3""",21,"""E32042D8467CE435"""
+"""A9E902182B01D372_8C55ECF4991E24BE_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC(=CS3)C(O)=O)=O""",21,"""E32042D8467CE435"""
+"""F2B60DA3D4FEDBD9_AB870B4F2EADBDE8_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NOC(=N3)C4=COC=C4""",21,"""E32042D8467CE435"""
+"""877DFF5BCCB2C18B_ED33099D6CB426F7_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C3=CC(=CS3)C(N)=O)=O""",21,"""E32042D8467CE435"""
+"""F023112D7BFBE042_7FD67C5F0ADD6865_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC=C(O3)C4=CC=CS4""",21,"""E32042D8467CE435"""
+"""64580B4673369E35_3AEBBB31AB356138_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NCC3=CN=CC=C3""",21,"""E32042D8467CE435"""
+"""9A8928C80ACA8DED_A79AF1242EFADC1D_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=CC3=C([N](C)N=N3)C=C4""",21,"""E32042D8467CE435"""
+"""0534C28F4F740C3F_2F710E22544D982B_6039_UN""","""O(CC12CN(CC1)CCC2)CCNC(=O)C3=NC=CC=C3""",21,"""E32042D8467CE435"""
+"""9CF067498AD27F9A_42442EC56B70BDF4_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C([N](C)N=C3)C(F)(F)F""",21,"""E32042D8467CE435"""
+"""EF4C8C0421FE1BE7_43235EBB3E56851B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)CCC(C)C""",21,"""E32042D8467CE435"""
+"""7733692E97B97651_71DFA37E11AD9D44_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)C(SCC)C""",21,"""E32042D8467CE435"""
+"""B74B033BC5269CED_A59567156A8A6CA4_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C[NH]C(=N3)C4=CC=CS4""",21,"""E32042D8467CE435"""
+"""F5A4E1520B1DDE66_35D309B911262E0A_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(OC)C=CC(=C3)C#N""",21,"""E32042D8467CE435"""
+"""2125F4A5EB771DBB_B4A7F8B04F055A24_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC4=C(C=C3)NC(=O)O4""",21,"""E32042D8467CE435"""
+"""803DC745D30BBFC6_9E7D58762C0A2934_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=CC=CC(=C3)OC""",21,"""E32042D8467CE435"""
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+"""9194AC236634E091_76FC332AD08B42C4_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(NCC(C)C)=O)=O""",21,"""E32042D8467CE435"""
+"""4714135DEAC50637_D47AC674FB5E4B7A_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3CCC(C)CC3)=O""",21,"""E32042D8467CE435"""
+"""9CE03138706D0C50_36656FBE84D70490_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)C4=CC=CO4""",21,"""E32042D8467CE435"""
+"""207A726D0AD681D6_549E342D22CED14D_6039_UN""","""O(CC12CN(CC1)CCC2)CCOC3=C(C)C=CC=C3C""",21,"""E32042D8467CE435"""
+"""C69A2E84E1C1AEF0_47119535B8BF09B3_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CSC(=N3)C4CCCC4""",21,"""E32042D8467CE435"""
+"""C62B6C6541D744BB_C04C2571876BD8C1_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)C4CCCC4""",21,"""E32042D8467CE435"""
+"""B3021CD56CCC4687_5158FA7E3333EA43_6039_UN""","""O(CC12CN(CC1)CCC2)CC(N(CC(C)C)C(C)C)=O""",21,"""E32042D8467CE435"""
+"""830948E3776912C5_697CC86EA77E3FAC_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(CC(O)=O)C=C3""",21,"""E32042D8467CE435"""
+"""43B1889825E4D106_F20B9071F704BB25_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NCCOCCCC)=O""",21,"""E32042D8467CE435"""
+"""4C83349EB1391431_0AED0053A7E3BF3B_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CSC(=N3)C(OCC)=O""",21,"""E32042D8467CE435"""
+"""C60177A7471389A3_7C77968DCB75711D_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC(=NO3)C4=CC=CS4""",21,"""E32042D8467CE435"""
+"""6209C31E8CE84978_DDF563E9392C8736_6039_UN""","""O(CC12CN(CC1)CCC2)CC(=O)NC(C3CC3)C4CC4""",21,"""E32042D8467CE435"""
+"""10246B31C9E03663_1832C47A1E857429_6039_UN""","""O(CC12CN(CC1)CCC2)CC4=NC3=C(SC=C3)C(=O)N4""",21,"""E32042D8467CE435"""
+"""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"""
+"""B79F7AD5BA1F2287_6EFF8E077025DDAA_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(C)(C#N)C3CC3)=O""",21,"""E32042D8467CE435"""
+"""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"""
+"""D97C2091CF7950AF_4BC4118B7A2096F2_6039_UN""","""O(CC12CN(CC1)CCC2)CCCOCC3CCCCO3""",21,"""E32042D8467CE435"""
+"""A75A29A73A78D24D_553C86EDC7D4A54F_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=C(C=C([N](=O)=O)C=C3)F""",21,"""E32042D8467CE435"""
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+"""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"""
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+"""C703DAA5EB1866BD_4412C8E181811490_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC=C(SC(C)C)C=C3""",21,"""E32042D8467CE435"""
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+"""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"""
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+"""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"""
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+"""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"""
+"""E3122ECDB64DED57_632750AD4B8F5BBD_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=NC=C(C(F)(F)F)C=C3""",21,"""E32042D8467CE435"""
+"""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"""
+"""6A3F88B8920A624C_D88A1739E2EC2938_6039_UN""","""O(CC12CN(CC1)CCC2)CC(C(C(OCC)=O)(C)C)=O""",21,"""E32042D8467CE435"""
+"""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"""
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+"""2D5BFF1676B7FADF_E397E38F019E36F4_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC(CCCCC)C)=O""",21,"""E32042D8467CE435"""
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+"""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"""
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+"""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"""
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+"""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"""
+"""F415D81946E14D26_4AD6659980B1E41E_6039_UN""","""O(CC12CN(CC1)CCC2)CC(NC3CCN(C)CC3)=O""",21,"""E32042D8467CE435"""
+"""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"""
+"""6A5887F379B59FBB_021414C5FCE1584C_6039_UN""","""O(CC12CN(CC1)CCC2)CC3CC4(CO3)CCOCC4""",21,"""E32042D8467CE435"""
+"""B6478FFAF6662FFC_825FA7D1855A6C4A_6039_UN""","""O(CC12CN(CC1)CCC2)CC3=CC4=C(C=C3)N=CC=N4""",21,"""E32042D8467CE435"""
+"""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"""
+"""9D7155B6654D8FEB_061F8E2BCF81C6B6_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCC1=CC=C(C(N)=O)C=C1)C2""",21,"""B46BD75EB1F8BDBB"""
+"""F46472EAEE159011_BB74AECEF319D6EA_6039_UN""","""COC(=O)[C@@H]2CC=C[C@H](OCC1=C(F)C=CC(=C1)C#N)C2""",21,"""B46BD75EB1F8BDBB"""
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+"""9F339416B26125C4_4904C4635704C5DA_6039_UN""","""COC(=O)[C@@H]1CC=C[C@H](OCC(NC(NCCC)=O)=O)C1""",21,"""B46BD75EB1F8BDBB"""
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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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+"""0C102A776CC3B80C_CF36B92F9C175F64_6039_UN""","""O(C1CCCC12CCCC2)CCOC3=CC(=CC(=C3)C)C""",21,"""6FF6AA6D1BE24644"""
+"""BB69A146EE60420D_6D6E2A28F45F0C5A_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(NC(C)(C)C)=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""9E75D969561B0069_FF6758BF0CDF0EA2_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NC3CC[S](=O)(=O)C3""",21,"""6FF6AA6D1BE24644"""
+"""D7403C01803F1666_F246C57483017CFD_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=NN=C(CC)S3)=O""",21,"""6FF6AA6D1BE24644"""
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+"""6B7CA8F5A48C31F7_5DBB37C61AA2812A_6039_UN""","""O(C1CCCC12CCCC2)CC(CC3=C(F)C=CC=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""7CB586F50E7A89DB_51496CC67387A7BE_6039_UN""","""O(C1CCCC12CCCC2)CC(CC3=CC=C(F)C=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""3D229A3B271C6174_8F5FE004C0EE7FE4_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=C([NH]N=C3C)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""DD017FEE74BF17B3_D2DA479905AF7405_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(C(F)(F)F)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""912A3AC35FE28369_82BF48A20143ACA3_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C=CC(=C3)OC)OC""",21,"""6FF6AA6D1BE24644"""
+"""490FD68A7B2CE535_6FD88A2B13A3B54C_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(C)C3=CC=CO3)=O""",21,"""6FF6AA6D1BE24644"""
+"""01299EB417E27743_822CEDB173CBF020_6039_UN""","""O(C1CCCC12CCCC2)CC3=COC(=N3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
+"""8A8991C91D28130E_5CAFD3573F3474A0_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C4=CSC=C4""",21,"""6FF6AA6D1BE24644"""
+"""9C68D1850C706F8C_B829490B7CE4C346_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC(=N3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
+"""F041E3000F8CE69C_369C7227B4FBF99C_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(CCC(C)C)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""DC210B93E3E40823_1D763D4CA4DB5617_6039_UN""","""O(C1CCCC12CCCC2)CCOC3=CC=C(C=C3)C#N""",21,"""6FF6AA6D1BE24644"""
+"""DAA8B3F74F3C21DA_AFCB0A42B2841A2F_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NCC3=NC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""4D8007E633FF5467_7CE13FF26D9CF7B5_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)C=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""B51FE7E8806F837C_4E82ED17DDAF260C_6039_UN""","""O(C1CCCC12CCCC2)CC4=C[N]3C=C(C)C=CC3=N4""",21,"""6FF6AA6D1BE24644"""
+"""91DB18F36BBEB027_59BF797B2FF03769_6039_UN""","""O(C1CCCC12CCCC2)CC4=C[N]3C=CC=C(C)C3=N4""",21,"""6FF6AA6D1BE24644"""
+"""8215DE39CCFBC862_F0176685061E4A12_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC4=C(C=C3)C=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""F1769EAE4F2608C2_EDD19A692DAA96DD_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)C(OC)=O""",21,"""6FF6AA6D1BE24644"""
+"""1A10A9BE937EE7F6_8D5054B11375E1BA_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=C[NH]3)[N](=O)=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""BE7D4D155586ED9B_B25C0237305FAD48_6039_UN""","""O(C1CCCC12CCCC2)CC3=NN=C(O3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
+"""E402AA1F41AE998C_4978BE8C4CE2A7F1_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=C(C=C(F)C=C3)F)=O""",21,"""6FF6AA6D1BE24644"""
+"""260D93CD5B3553A9_D1CD1A036A30D385_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=C(C=CC(=C3)C)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""53AE1BAC2CBBFA49_7963C04B3A6644D7_6039_UN""","""O(C1CCCC12CCCC2)CCCCOC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""D119A887F84F928A_8A4631B91777C39F_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)C3=CC=C(C=C3)C#N""",21,"""6FF6AA6D1BE24644"""
+"""DA6A50E820E86AE2_5280F28DA8D56903_6039_UN""","""O(C1CCCC12CCCC2)CC4=C3N=CC=CC3=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""E60A7FBD4FFE8105_ECD06BDA251EBB6D_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=N)NC(=N3)N(C)C""",21,"""6FF6AA6D1BE24644"""
+"""7B3ECB26D8E747BF_3BEDF155F3631369_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(C)C3=CC=CS3)=O""",21,"""6FF6AA6D1BE24644"""
+"""3A73FCF5A7CB02F3_C1E4AE2F6FD0149C_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC=C(CC)C=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""5EB321193B99873A_7154321C3AFE0B40_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NC(=O)C3=CC=CS3""",21,"""6FF6AA6D1BE24644"""
+"""AB25B3626CEAF14C_BFADD07FCDE04388_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC(=N3)C4=CC=CO4""",21,"""6FF6AA6D1BE24644"""
+"""F6AB928BC04B6E26_00EE22375AE4A1CD_6039_UN""","""O(C1CCCC12CCCC2)CCC(=O)NC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""9EB949D5CCDEDD8C_3C95798BCB3FC459_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)OCC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""112B96C815253054_6BFE6A6E50F60A29_6039_UN""","""O(C1CCCC12CCCC2)CC(NCCCC(OC)=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""9F72141A3DAC58FE_325AEDB4558999A0_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(C(C)(C)C)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""DE15EE106FA4D3AB_E6268B322923448D_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=C(F)C=CC=C3F)=O""",21,"""6FF6AA6D1BE24644"""
+"""DBE1510547360068_F7C3D65BFB6C3D5F_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(C(C)C)C(=O)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""A638CF1C7E6FFF29_FB9DE4CA7B4F8ADE_6039_UN""","""O(C1CCCC12CCCC2)CC3OCCN(CC(C)C)C3""",21,"""6FF6AA6D1BE24644"""
+"""5110B1C19A470DB4_E2BA731B4C0181AD_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC(=C3)C4=CC=CO4""",21,"""6FF6AA6D1BE24644"""
+"""E9A163A28C350BB0_2B971C2432CBE86C_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)OC(F)F""",21,"""6FF6AA6D1BE24644"""
+"""F35F80F6F72E9E75_9A0FD53EC85B76FA_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(C(OCC)=O)O3""",21,"""6FF6AA6D1BE24644"""
+"""E45642225E65F6D6_943C68179128F839_6039_UN""","""O(C1CCCC12CCCC2)CCOC3=C(OC)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""C79BEA954B619832_990A815DD643F694_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NNC3=NC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""D4800626C0FAC1B7_60C6D74894F320BD_6039_UN""","""O(C1CCCC12CCCC2)CC(N=C3N=C(SC)NS3)=O""",21,"""6FF6AA6D1BE24644"""
+"""9919CA6405BF9896_889FA5A704F05192_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3C)[N](=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""F0B663E23856851D_2ACC23D44EB50A5B_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NC3(CCCC3)C#N""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""F967620F5C0142E3_6A67A0566AA5E573_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NC(=O)C3=CC=CO3""",21,"""6FF6AA6D1BE24644"""
+"""B467F76911A0B70C_93C8845183F7F7A3_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)OC(C)C""",21,"""6FF6AA6D1BE24644"""
+"""8A9E6AADC2E4748E_49E0E3BA32ED05DC_6039_UN""","""O(C1CCCC12CCCC2)CC(NCC3=C(C)C=CS3)=O""",21,"""6FF6AA6D1BE24644"""
+"""F147922CBA2B2EA0_B36E1E6573815754_6039_UN""","""O(C1CCCC12CCCC2)CC(NCC3=CC=C(C)S3)=O""",21,"""6FF6AA6D1BE24644"""
+"""DB555ED028B93DBE_2AFC59F2E76ACE55_6039_UN""","""O(C1CCCC12CCCC2)CC(N(CC(C)C)C3CC3)=O""",21,"""6FF6AA6D1BE24644"""
+"""86904D85496A4E1C_1DBD6BEE3F8DAA4C_6039_UN""","""O(C1CCCC12CCCC2)CC(N(CC)CC(C)C#N)=O""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""05AF4230F74D3910_DB9C2CA46E8635B0_6039_UN""","""O(C1CCCC12CCCC2)CCNC(OCC(F)(F)F)=O""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""75AB0A027F87E08E_85F57FD75185C276_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C4=COC=C4""",21,"""6FF6AA6D1BE24644"""
+"""FC565FA0C1FF2C5E_22A158BD79985EDB_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)C4=COC=C4""",21,"""6FF6AA6D1BE24644"""
+"""E48E7A8C3CB955E1_EDBF9BC08FB92568_6039_UN""","""O(C1CCCC12CCCC2)CC4=C[N]3C(=CC=CC3=N4)C""",21,"""6FF6AA6D1BE24644"""
+"""49C28EF7ECDE92F9_32C95E5CC7F3B4A3_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=CS3)C(C)=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""3C9DDF9C7FF9B925_8EFFE1481430664B_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=C[N]3CC(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""5E3A1AFD455D8E02_0F3550840295F73F_6039_UN""","""O(C1CCCC12CCCC2)CCC3=NC=C(C(C)(C)C)O3""",21,"""6FF6AA6D1BE24644"""
+"""D6CBD46347247C0A_0AA1087ED8226A86_6039_UN""","""O(C1CCCC12CCCC2)CC(N(CC(OCC)=O)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""4BAEB351D8DE503F_9643E1DA84D02576_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C(C=C3)SC)OC""",21,"""6FF6AA6D1BE24644"""
+"""E5FF49D5B4E05AF7_7A3E747A8BDEE7FD_6039_UN""","""O(C1CCCC12CCCC2)CC3OCCC4=C3C=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""F5DA3EC0550ADB8E_C098521F3B59AE8F_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)C(OCC)C""",21,"""6FF6AA6D1BE24644"""
+"""0F4680993FF0B70C_19CC00A9FAE95110_6039_UN""","""O(C1CCCC12CCCC2)CC3=N[N](C(CC)CC)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""7E5B2DF6B3273FBF_FADF13A5F498B4DC_6039_UN""","""O(C1CCCC12CCCC2)CCCC3=CC=CC(=C3)OC""",21,"""6FF6AA6D1BE24644"""
+"""818C897E21370594_53F88252D375EDBB_6039_UN""","""O(C1CCCC12CCCC2)CCC3=CC4=C(C=C3)OCC4""",21,"""6FF6AA6D1BE24644"""
+"""5106B0CC988724D9_2F1DB508C68BE27C_6039_UN""","""O(C1CCCC12CCCC2)CCN3CCN(C(C)C)CC3""",21,"""6FF6AA6D1BE24644"""
+"""A26450AAC1B6A8DF_20BBD3FD25519050_6039_UN""","""O(C1CCCC12CCCC2)CC4=C3C=CC=CC3=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""9B0C731C30AD6BB7_0246A576BD9FBD6A_6039_UN""","""O(C1CCCC12CCCC2)CC4=C3OCCOC3=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""90C1AB193FDDED7B_54932771A4B04A46_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(C=CS3)C(=O)N4""",21,"""6FF6AA6D1BE24644"""
+"""42AA1885AE481655_0D1D2C49E25E324C_6039_UN""","""O(C1CCCC12CCCC2)CCCNC(=O)C3CCCC3""",21,"""6FF6AA6D1BE24644"""
+"""54A1ABF12E82E7B7_CC5B5204E3E87817_6039_UN""","""O(C1CCCC12CCCC2)CCN[S](CCCOC)(=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""6748D1FAFFE906D3_F96D0783018957DA_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(OC(C)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""EA8FDAD6938A5260_00830441C48086CF_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC(=CS3)C(O)=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""22E4F25A703657B5_2751E3FA73331F99_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC(=N3)C4=COC=C4""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""6ACDD971098456D5_2B4C199173647E6C_6039_UN""","""O(C1CCCC12CCCC2)CC4=CC3=C([N](C)N=N3)C=C4""",21,"""6FF6AA6D1BE24644"""
+"""3729D9BD8F54B193_A3A7E69709D33A5A_6039_UN""","""O(C1CCCC12CCCC2)CCNC(=O)C3=NC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""1CDB9790E855BA1A_CE92C67036EE1F85_6039_UN""","""O(C1CCCC12CCCC2)CC3=C([N](C)N=C3)C(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""18DF302C7F07483F_CFF5B60E63C8276A_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)CCC(C)C""",21,"""6FF6AA6D1BE24644"""
+"""32C4D558CFD3CD4C_FD094BCB4C333F35_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C(SCC)C""",21,"""6FF6AA6D1BE24644"""
+"""2D35F5DB011AA3A7_29438FA03714CED5_6039_UN""","""O(C1CCCC12CCCC2)CC3=C[NH]C(=N3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
+"""6B7EFB5F59914D22_B905E10C4CB88C7B_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(OC)C=CC(=C3)C#N""",21,"""6FF6AA6D1BE24644"""
+"""AB97EDC5BCAA88A2_38711005129BF855_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)NC(=O)O4""",21,"""6FF6AA6D1BE24644"""
+"""43D99C14ED199E18_12ABB0C371948B45_6039_UN""","""O(C1CCCC12CCCC2)CCOC3=CC=CC(=C3)OC""",21,"""6FF6AA6D1BE24644"""
+"""8400866FA3EA17F6_4E05E33E9623FC78_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(C(OC)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""E14F0DB86691EC25_FA2ADB9F8D15E0B5_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(NCC(C)C)=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""226E49C70C93D76B_58AC2EC1A6C0E90B_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3CCC(C)CC3)=O""",21,"""6FF6AA6D1BE24644"""
+"""CC72414C98387E67_BAB3870BD949A6E1_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C4=CC=CO4""",21,"""6FF6AA6D1BE24644"""
+"""7C985BD67B934FB7_D848DC987F50733C_6039_UN""","""O(C1CCCC12CCCC2)CCOC3=C(C)C=CC=C3C""",21,"""6FF6AA6D1BE24644"""
+"""709DF3F0796119BC_CBC77D80E521ABC2_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)C4CCCC4""",21,"""6FF6AA6D1BE24644"""
+"""141BCB256EFA7591_4C9ACDC4DAF57AB0_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C4CCCC4""",21,"""6FF6AA6D1BE24644"""
+"""D7107E213F610445_DD8E12CB6EAD4832_6039_UN""","""O(C1CCCC12CCCC2)CC(N(CC(C)C)C(C)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""7C1DA5B68760AE0F_E5AA20DBFAE09DDD_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(CC(O)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""C744DFFDA61FE681_7EDD78C4AA9A1954_6039_UN""","""O(C1CCCC12CCCC2)CC(NCCOCCCC)=O""",21,"""6FF6AA6D1BE24644"""
+"""0C1BD011FE4A6029_863BE8E6FA7D1D4A_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)C(OCC)=O""",21,"""6FF6AA6D1BE24644"""
+"""4FFF93353C52F32E_F0A17E3896EBD36C_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
+"""3E250742FD88D106_51238B5C64B22547_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NC(C3CC3)C4CC4""",21,"""6FF6AA6D1BE24644"""
+"""B3FC47DE045CFB53_94E42CCF431BD658_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(SC=C3)C(=O)N4""",21,"""6FF6AA6D1BE24644"""
+"""277A7F5CAD748030_A5D8B008C8C70419_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NCCC3=CC=CS3""",21,"""6FF6AA6D1BE24644"""
+"""CEEBE1A517101FA8_7907BC68B4BE520F_6039_UN""","""O(C1CCCC12CCCC2)CCN3C(NC(C)(C)C3=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""1733C1E5E5780A0D_E22966B22DBB7FDB_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(C)(C#N)C3CC3)=O""",21,"""6FF6AA6D1BE24644"""
+"""E7F0BA2D7D3D2BBE_4704E5EC21DD3231_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(C=CC(=C3)F)O4""",21,"""6FF6AA6D1BE24644"""
+"""E3F02214DEB10560_24A2C0731D275436_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(C(C)C)(C)C#N)=O""",21,"""6FF6AA6D1BE24644"""
+"""9513E8980E6AB039_59172D7743DBD029_6039_UN""","""O(C1CCCC12CCCC2)CC3=C([N](=O)=O)C=CC(=C3)F""",21,"""6FF6AA6D1BE24644"""
+"""3D89E89350D3C95E_D8673A386E386DF9_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)CC(NC)=O""",21,"""6FF6AA6D1BE24644"""
+"""EA59CFD3A5CD268E_00AEA09C538016DC_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(N(CC)C)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""3797242E7F01E12E_BBB7E5C4D21F3876_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)N(C)C4CC4""",21,"""6FF6AA6D1BE24644"""
+"""D34870CD3B313E12_F2498DF929758098_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=N[NH]3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
+"""98245DAD1D42D693_589C59B852AE741F_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C)SC(=C3)C(OC)=O""",21,"""6FF6AA6D1BE24644"""
+"""49178683ABE9B1DA_E129793F7C4BF595_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NNC(=O)C3CCC3""",21,"""6FF6AA6D1BE24644"""
+"""BA7D9D1A75DE3E46_C712F93E27BE3483_6039_UN""","""O(C1CCCC12CCCC2)CCCOCC3CCCCO3""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""26ABDC6097E778F3_443BF0114220CEE5_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)C4CCCO4""",21,"""6FF6AA6D1BE24644"""
+"""F09991A19A74B838_19DB28E51884E360_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NCC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""A4D3B3AA6A9BD014_BDD9126AD26597A4_6039_UN""","""O(C1CCCC12CCCC2)CCCCCN3CCCCC3""",21,"""6FF6AA6D1BE24644"""
+"""B25A09253DA73139_00E9C04F71328DC3_6039_UN""","""O(C1CCCC12CCCC2)CC3OC(=C(C(OC)=O)C3)C""",21,"""6FF6AA6D1BE24644"""
+"""FAA4BFF4FB15056E_C602FAEBBCD7216E_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(ON=C3)C4=CC=CO4""",21,"""6FF6AA6D1BE24644"""
+"""340A69F020985E72_951D308F5BC4408F_6039_UN""","""O(C1CCCC12CCCC2)CC3=C4C(=CN=C3)C=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""59DFED5D2ACD6423_E0A6E88E9B689EDC_6039_UN""","""O(C1CCCC12CCCC2)CC(N(C)C3=CC=CC=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""D3346CF012AD1D6F_338E0F5FFA8BA75C_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=CC=C(C)C=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""D92BAD198C9ACBDF_C33B4FA886BD287C_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=C(F)C=CC=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""DD15D045DFD96BAA_1F69F0197C056F9C_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=CC=C(F)C=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""0C2F69DE19775E22_366B714D36702D5A_6039_UN""","""O(C1CCCC12CCCC2)CCC(C3=CC=C(C)C=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""4B972091B429A109_264D720430DD2569_6039_UN""","""O(C1CCCC12CCCC2)CCCOCC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""8ED0F83C0A7790DB_AA6F17524C9A2C8E_6039_UN""","""O(C1CCCC12CCCC2)CC(N3CC(C)OC(C3)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""0FCB6301006FD681_5E43DC13E7CB344D_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=CC=CC(=C3)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""D121019DCE59238F_C8C42054DC1FB6E1_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(SC(C)C)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""6D7993C909229992_25D5651EF8B444AC_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=C(C=CC(=C3)F)F)=O""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""3A3EEC0F5A66BC6D_4955D70997246EE4_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(C(C)C)C(=O)O)=O""",21,"""6FF6AA6D1BE24644"""
+"""793D8B7386BD73FB_AB8C3CF7F540931C_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(C)C=CN=C3[NH]4""",21,"""6FF6AA6D1BE24644"""
+"""A5B4B5FE3E7E3B5A_B0D42E133D92EE3E_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(N=C(C)S3)C(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""453B113F838FB240_7AB623B95EACC0FE_6039_UN""","""O(C1CCCC12CCCC2)CC3=N[N](CC(F)(F)F)N=N3""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""E2DB81F1D18455C2_98ADA1C5316D1612_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=CS3)C(OCC)=O""",21,"""6FF6AA6D1BE24644"""
+"""18B337025C87C83A_064499B0427BE4F1_6039_UN""","""O(C1CCCC12CCCC2)CC3=N[N](CC(F)(F)F)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""3AB4F7CF312589FC_3C5670ACB4E42DA7_6039_UN""","""O(C1CCCC12CCCC2)CCN(C)CC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""809CAED6BF246DC5_81648920366358E9_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)[S](C)(=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""DCE803F6591E1A8D_C53566B95B0CA5FB_6039_UN""","""O(C1CCCC12CCCC2)CC3=C[N](CC(OC)=O)N=N3""",21,"""6FF6AA6D1BE24644"""
+"""4CA072DB9754B9BC_C9747694B96E85D0_6039_UN""","""O(C1CCCC12CCCC2)CC(N3CC(CC(C)C3)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""757AA390815B7AF2_ED9894851C725D32_6039_UN""","""O(C1CCCC12CCCC2)CC(N3CCCCC3CC)=O""",21,"""6FF6AA6D1BE24644"""
+"""961A73CCF04E81C2_D666217CC66EB2A2_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=N[N]3C4CCCC4""",21,"""6FF6AA6D1BE24644"""
+"""23F8FE0380935D61_939ABCA30F44B9AE_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=N[N]3CC(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""BF3611A05270A966_645C273FE2DA4F0D_6039_UN""","""O(C1CCCC12CCCC2)CC4COC3=C(C=CC=C3)O4""",21,"""6FF6AA6D1BE24644"""
+"""ED3090EF9C6C54B9_0C29154F5B9125CF_6039_UN""","""O(C1CCCC12CCCC2)CC(N(C)CC3=CC=CO3)=O""",21,"""6FF6AA6D1BE24644"""
+"""71C49C047747C015_3AD7A1BFFA94C9E1_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)CCC3CCCCO3""",21,"""6FF6AA6D1BE24644"""
+"""9EE0F3FE58F555B2_F47756E45AD17036_6039_UN""","""O(C1CCCC12CCCC2)CCC(NC3=NOC(=C3)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""6186D0F30A8722B2_E78AF3CCAF4ECEDC_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NC3=C(C=CS3)C#N""",21,"""6FF6AA6D1BE24644"""
+"""8FAEA986D2CA1F77_78938348D0583D7E_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC(=C3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
+"""413C23980DCB8BFE_8D8B761D6FCBC00A_6039_UN""","""O(C1CCCC12CCCC2)CC(OC)CC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""7D4F2B9B197F49D1_F9123442315FB1C3_6039_UN""","""O(C1CCCC12CCCC2)CCOC3=C(C=CC=C3)C#N""",21,"""6FF6AA6D1BE24644"""
+"""BED7DE1FA81FD3B7_0132D95775995927_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(NCCCC)=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""962A97E9B18B9D94_2C27CFF6175DA23D_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(C=C(F)C=C3)O4""",21,"""6FF6AA6D1BE24644"""
+"""9BE3D8ABAD0EDBE3_5F167148EF9752FD_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(ON=C3)C4=CC=CS4""",21,"""6FF6AA6D1BE24644"""
+"""2D20C138FECDF842_6FCB112B9DA61388_6039_UN""","""O(C1CCCC12CCCC2)CC3=CSC(=N3)C[S](C)(=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""4447C58C86A79ACE_70361EB42BD1F4F0_6039_UN""","""O(C1CCCC12CCCC2)CCC(CC)(CC)C(=O)OC""",21,"""6FF6AA6D1BE24644"""
+"""3774229F1A46A17C_E0415D85CA28D81D_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=C(OC)N=CC=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""16BC897B441582DF_D0594A20BCB37169_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=C(C=C(C)C=C3)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""902DFFB76D98820F_0F74E5748255C20A_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C(N(C)C)C=C3)C""",21,"""6FF6AA6D1BE24644"""
+"""352EC1A0619849E7_B70E642A40C35BA4_6039_DP""","""O(C1CCCC12CCCC2)CC(NCC3CCCNC3)=O""",21,"""6FF6AA6D1BE24644"""
+"""D63061C3A14C7E4E_390E57A54BB14301_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=N[N]3C)C(OC)=O""",21,"""6FF6AA6D1BE24644"""
+"""BCF69B0D3D233B08_0404884696FBEB35_6039_UN""","""O(C1CCCC12CCCC2)CCOCC(C(F)(F)F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""1650DE5F668761D1_124FF0BD61BA73CA_6039_UN""","""O(C1CCCC12CCCC2)CCCC3=C(OC)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""EFDD86D09C0F0D10_66D9F5AFE8A20D9F_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(OC)=O)C=CC=N3""",21,"""6FF6AA6D1BE24644"""
+"""4D8D619FAC7EF7D7_FBDD25BD3807B27D_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=CC(=N3)N(C)C)C""",21,"""6FF6AA6D1BE24644"""
+"""D704684A9F67BEF6_25AAD1D9B58D7EE4_6039_UN""","""O(C1CCCC12CCCC2)CC(N(C)CC3=CC=CS3)=O""",21,"""6FF6AA6D1BE24644"""
+"""FCD838B563D8CC13_1ED3AA6DAB543A2E_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C(OCC)C""",21,"""6FF6AA6D1BE24644"""
+"""0856A0DA60B35EB6_80BBBF5B1163069D_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)CC(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""B1B62E127C4AC25D_21322C49C1B62680_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)C3=CC(=CC=C3)C#N""",21,"""6FF6AA6D1BE24644"""
+"""06E6E2F4DE5A7586_1762E9CE4C4E0485_6039_UN""","""O(C1CCCC12CCCC2)CC3=N[N](C=C3)C4CCCC4""",21,"""6FF6AA6D1BE24644"""
+"""F3F3F863DEDAB937_4B22610763E9BA77_6039_UN""","""O(C1CCCC12CCCC2)CCCSCC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""F8D5D770FB58F60E_BAA43EE6D1AB9663_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(OC(F)F)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""2DEE94D970E77351_3EB9DE3F1B785867_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)NC(C)=O""",21,"""6FF6AA6D1BE24644"""
+"""479E5010E1B3A15E_16D5D75FF2215792_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(OC(F)F)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""D8980CAD054B444E_E238F72DC1D4C2A7_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=N[N]3C)C(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""4E99DD639386B38F_6F410B3A5C009485_6039_UN""","""O(C1CCCC12CCCC2)CC(NC(CCCCC)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""CA1B91B312E677D9_5ED5F6503A288711_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C=CC=C3)OC4CC4""",21,"""6FF6AA6D1BE24644"""
+"""F6368F133DB19E41_753AEB21F6537909_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3=CC(=N[N]3C)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""C9605033F59ABEF9_1A9C4E42480E9C69_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)CCC3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""9376591B914FA3DB_E909A1224D88FC79_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=N[N](CC)N=C3C)=O""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""825DBC9FC0878C60_0F5611B3D5E07358_6039_UN""","""O(C1CCCC12CCCC2)CCO[S](C[S](C)(=O)=O)(=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""AB92DCB9385170E5_D320F90988CDA7E0_6039_DP""","""O(C1CCCC12CCCC2)CC4=CC3=C(CCNC3)C=C4""",21,"""6FF6AA6D1BE24644"""
+"""6ED57E8B59299289_31BA847F993380D4_6039_DP""","""O(C1CCCC12CCCC2)CC(N[C@@H](C(C)C)C(=O)O)=O""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""93F89DE343436A08_F087E8174DCDAAB4_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)C(C)(C)C""",21,"""6FF6AA6D1BE24644"""
+"""423138B46228A7BB_134ACF535B94DB2A_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=CC(=C3)OC(C)C""",21,"""6FF6AA6D1BE24644"""
+"""DE0886BFE7DB1DCD_B60FCC98198A7632_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C=C(C(O)=O)C=C3)F""",21,"""6FF6AA6D1BE24644"""
+"""5C3F5323435B1EE6_AD8C1546C19CFB42_6039_UN""","""O(C1CCCC12CCCC2)CCCN(C)C3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""5333C9905952E522_37C311B872B49BA8_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(F)C=C(C(=C3)F)C#N""",21,"""6FF6AA6D1BE24644"""
+"""D15AF1A05689DE27_7BEDF8DB83032594_6039_UN""","""O(C1CCCC12CCCC2)CCSC3=CC=CC(=C3)OC""",21,"""6FF6AA6D1BE24644"""
+"""867916D83E78E785_A8D1D0432C8302AE_6039_UN""","""O(C1CCCC12CCCC2)CCC3=NSC4=C3C=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""F491B8A028A11649_9568F811F622F353_6039_UN""","""O(C1CCCC12CCCC2)CCC3=NOC4=C3C=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""20A8C681907FCBC1_2686E66DAFD937B5_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC4=C(N=C3)C=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""859E3BE0C9934206_66DD312214BF4628_6039_UN""","""O(C1CCCC12CCCC2)CCO[P](OCC)(=O)OCC""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""FF98D36B08B5DB86_BD7E947CD453E677_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)C=CN=C4""",21,"""6FF6AA6D1BE24644"""
+"""659DFC79910D3014_67CBA3C4905D0475_6039_UN""","""O(C1CCCC12CCCC2)CC4=C3CCOCC3=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""E192C29CC73B69BD_C6008D2CDD2F466F_6039_UN""","""O(C1CCCC12CCCC2)CC(NC3CCN(C)CC3)=O""",21,"""6FF6AA6D1BE24644"""
+"""3CAB756797560F58_8912D02FEACD4014_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C(C)C=C3)[N](=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""BF797509CC91BD79_05AF21344F4654CA_6039_UN""","""O(C1CCCC12CCCC2)CC3CC4(CO3)CCCCC4""",21,"""6FF6AA6D1BE24644"""
+"""310BEB5A9C74098D_8EC2FC70A17FFA3D_6039_UN""","""O(C1CCCC12CCCC2)CC3CC4(CO3)CCOCC4""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""9C4E80F699B7DA71_63D6927005B1762B_6039_DP""","""O(C1CCCC12CCCC2)CC4OCC3(CCNCC3)C4""",21,"""6FF6AA6D1BE24644"""
+"""F14B2203C087AC85_80FFADBE22A838E6_6039_UN""","""O(C1CCCC12CCCC2)CC4COC3(CCCCC3)O4""",21,"""6FF6AA6D1BE24644"""
+"""807F8473C70C46D9_CE5EE78D0BBFA8B7_6039_UN""","""O(C1CCCC12CCCC2)CC(N3CC(C)(C)OCC3)=O""",21,"""6FF6AA6D1BE24644"""
+"""0CE74939C5089099_74ED64733622EF81_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC=C(OC)C=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""F37BBF4D9BCF9480_45DE1E43999A0EE6_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)N3CC4CCC(C3)O4""",21,"""6FF6AA6D1BE24644"""
+"""1D536F674DB4B562_5E4D20E8E20F82F2_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC=C(F)C=C3)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""2E04B16D7DF4D357_972CEDD20C6BCBB6_6039_UN""","""O(C1CCCC12CCCC2)CCC[S](NC(C)(C)C)(=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""B709D01D8343705D_316605E0DD8C2B78_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=C(OC)C=CC=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""22E758C3C7351C25_BB4771AAA9343DB5_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(CC(C)C)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""DAB18FD2FC7E7747_471658472567AAD0_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NCC3CCCCC3""",21,"""6FF6AA6D1BE24644"""
+"""A228EDF5B2FBB463_170FA6823904C6DF_6039_UN""","""O(C1CCCC12CCCC2)CC(N(C)C3CCCCC3)=O""",21,"""6FF6AA6D1BE24644"""
+"""D59E28E2AC154B21_72D2903660F8AF7C_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)COC(C)C""",21,"""6FF6AA6D1BE24644"""
+"""9A5E5AA5EA6E999D_2E98BE67443A9819_6039_UN""","""O(C1CCCC12CCCC2)CC4COC3(CCOCC3)O4""",21,"""6FF6AA6D1BE24644"""
+"""9AEB63B2FE94EF9D_4A3F464EC8803D98_6039_UN""","""O(C1CCCC12CCCC2)CC3CCCC(C(F)(F)F)O3""",21,"""6FF6AA6D1BE24644"""
+"""7D3D784961241CD3_BE285E3223359963_6039_UN""","""O(C1CCCC12CCCC2)CC3=NSC(=N3)C(OCC)=O""",21,"""6FF6AA6D1BE24644"""
+"""E5D3FD68524FF01B_DA4060432C466D10_6039_UN""","""O(C1CCCC12CCCC2)CCCCCCCCCCC""",21,"""6FF6AA6D1BE24644"""
+"""BD19E9FD3D56EE60_E015C3730604CFF1_6039_UN""","""O(C1CCCC12CCCC2)CC3=NN=C4C(=O)NC=C[N]34""",21,"""6FF6AA6D1BE24644"""
+"""2AEEB59913633D79_6D91D7DC8B451A80_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=C(S3)C(C)(C)C)C""",21,"""6FF6AA6D1BE24644"""
+"""9180184050D67CB5_9FA80DDF7998AD71_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)C=NC=C4""",21,"""6FF6AA6D1BE24644"""
+"""C81DDC7CF5EBE484_22A353CF76424C12_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C)C=C(C=C3C)C#N""",21,"""6FF6AA6D1BE24644"""
+"""F568AC868B91C372_82FEC3A8F07E61B6_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=CC(=C3)C(OC)=O""",21,"""6FF6AA6D1BE24644"""
+"""F1D1C4894D7A1B18_FBFFF6F3B3F256E2_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)[S](F)(=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""82A31BECF68944C6_06A5D53494558CD2_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(CC(C)=O)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""DD4BD3A45C80A547_60911159F6B1BF6F_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=NN=C3C4CC4)C""",21,"""6FF6AA6D1BE24644"""
+"""0C6FC6912144EDA3_7F0EFCC42BEDCFAD_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=N3)C(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""C81625F26A32EDAF_49E745E4CEFD80AA_6039_UN""","""O(C1CCCC12CCCC2)CCCN3CCC(F)(CC3)F""",21,"""6FF6AA6D1BE24644"""
+"""7046F41610F28E20_411681F418991EEC_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C)C=CC(=C3)[N](=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""B5CBB9AD60F248D5_BEA8CAE5FCC0E5B9_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C=CC(=C3)C(O)=O)F""",21,"""6FF6AA6D1BE24644"""
+"""8CC19EA38B5EFC7A_175F3901A3F58058_6039_UN""","""O(C1CCCC12CCCC2)CCNC(=O)C3CCOCC3""",21,"""6FF6AA6D1BE24644"""
+"""8C43B2575FD5AAF5_B87C967804B2BEFE_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=CC(=C3)C(OC)=O""",21,"""6FF6AA6D1BE24644"""
+"""9127216181492920_7E5E5D267A955715_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)COCC4""",21,"""6FF6AA6D1BE24644"""
+"""00E90CD619C163AB_E5AB32006C1342C7_6039_UN""","""O(C1CCCC12CCCC2)CCOC3CC[S](=O)(=O)CC3""",21,"""6FF6AA6D1BE24644"""
+"""0195152A335EA93A_BF4400AF033648EC_6039_UN""","""O(C1CCCC12CCCC2)CC3=NSC4=C3C=CC(=C4)F""",21,"""6FF6AA6D1BE24644"""
+"""32C423B81B6E431F_1384A46FDC2AD613_6039_UN""","""O(C1CCCC12CCCC2)CCCNC(C(CC)CC)=O""",21,"""6FF6AA6D1BE24644"""
+"""9F7190BEA17F0D31_223826A4B45E1F10_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(F)C=C(C=C3F)C#N""",21,"""6FF6AA6D1BE24644"""
+"""D01187522531D57D_C3459BA56C94BD2D_6039_UN""","""O(C1CCCC12CCCC2)CC3(F)OC(=O)CC34CCC4""",21,"""6FF6AA6D1BE24644"""
+"""A5E27D76E930C703_EAD2D4E2BC1200EB_6039_UN""","""O(C1CCCC12CCCC2)CC3=C([N](C)N=N3)C(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""F565409FAEAA8710_54D42D9367487D24_6039_UN""","""O(C1CCCC12CCCC2)CC3=C[N](C)N=C3C(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""C4D54F5B31BB93DE_0286D114AE297D87_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C(OCC)C=C3)F""",21,"""6FF6AA6D1BE24644"""
+"""D6D78C3EF1084F4B_E4D92F7BF3284C56_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(F)C=CC=C3O4""",21,"""6FF6AA6D1BE24644"""
+"""250E844F3A737C67_1550737B7D01E1EA_6039_DP""","""O(C1CCCC12CCCC2)CC3OCCC34CCNCC4""",21,"""6FF6AA6D1BE24644"""
+"""1791E7BB0606A6C4_FD4045BE91C5A84A_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C([S](N)(=O)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""16506A64EC31924B_85DD081C008A3EE1_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC=C([N](=O)=O)O3)=O""",21,"""6FF6AA6D1BE24644"""
+"""D92525EE0167AA9E_1E2C99303744B0C8_6039_UN""","""O(C1CCCC12CCCC2)CC3=C([S](C)(=O)=O)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""100EE22FF4278A98_070064C147C025F3_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=NO3)C(OC)(C)C""",21,"""6FF6AA6D1BE24644"""
+"""6C7062E20082EBB8_A13458F85EA4D237_6039_UN""","""O(C1CCCC12CCCC2)CC(NCCCOC(C)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""429D07E8A7F42CF5_1B2DEE31EEAD4146_6039_UN""","""O(C1CCCC12CCCC2)CC3=NCCC4=C3C=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""E624C33F2F972F14_EF734F2C0B866F7B_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(SC(F)F)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""13C004CBF19A8D3F_57AA7D48E96B2A74_6039_UN""","""O(C1CCCC12CCCC2)CCC(=O)NC3=NC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""B53B76EFE2A18321_5DACABB5F6DF71A9_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C)OC(=C3)C(OC)=O""",21,"""6FF6AA6D1BE24644"""
+"""EB31CE432D111A8C_E710C1A1703B8DE3_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(C=C3)[S](=O)(=O)Cl""",21,"""6FF6AA6D1BE24644"""
+"""0A6EA10F2CA84C34_1C64788C6D7626EF_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3[N](=O)=O)C""",21,"""6FF6AA6D1BE24644"""
+"""A8628005B101176A_E89C7776E636BAB1_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)C=CC=N4""",21,"""6FF6AA6D1BE24644"""
+"""6A3FB85759A839E7_C8E2DFFB44CFBF07_6039_UN""","""O(C1CCCC12CCCC2)CCCOC3=C(F)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""CA74982EBD993F05_96BDE8A26AAC5754_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C=CC(=C3)[N](=O)=O)F""",21,"""6FF6AA6D1BE24644"""
+"""F553A2B77E64E0D0_F3C3CB98388562AE_6039_UN""","""O(C1CCCC12CCCC2)CCCNC(CC(C)(C)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""1490685D089D7F4A_04B8C5E0F934227A_6039_UN""","""O(C1CCCC12CCCC2)CCC(=O)N3CCCCCC3""",21,"""6FF6AA6D1BE24644"""
+"""D0C7E9E779FF5987_E2639DB595A353F2_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(CCCCC3)S4""",21,"""6FF6AA6D1BE24644"""
+"""870103900A691233_B649207BA703A07E_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=CC(=C3)C(C)(C)C""",21,"""6FF6AA6D1BE24644"""
+"""ED8F2C822CF582A9_74B8D303C191516C_6039_UN""","""O(C1CCCC12CCCC2)CC4CCCC3(CCOC3)O4""",21,"""6FF6AA6D1BE24644"""
+"""B52C2348119DB688_E75F90CD83B7EA2A_6039_UN""","""O(C1CCCC12CCCC2)CC(N(C)CC3=CSC=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""F8FFB04386DB30B2_19D91DF50D9BBB44_6039_UN""","""O(C1CCCC12CCCC2)CC3CCCC(F)(F)C(N3)=O""",21,"""6FF6AA6D1BE24644"""
+"""8873BDF0F5AB48AF_B2171FE2929D16EC_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC(=N3)N4CCCC4""",21,"""6FF6AA6D1BE24644"""
+"""356BFBA582B4140F_09FA4EF7C8000EAA_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C)OC=C3C(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""8A8946CCD6BCBCA1_84B760E1C9D636D8_6039_UN""","""O(C1CCCC12CCCC2)CC4=CC3=C(CN(C)C3)C=C4""",21,"""6FF6AA6D1BE24644"""
+"""15B66A19FA7A5A87_46ED64061CA0A28B_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(OCC)=O)[NH]N=C3""",21,"""6FF6AA6D1BE24644"""
+"""57387E67D15DF626_D92DF1E6443A96FA_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C(C)O3)[S](=O)(=O)C""",21,"""6FF6AA6D1BE24644"""
+"""B2BE2768B783D3FF_3DA696F8CA9A1C0F_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC4=C3N=C(C)O4""",21,"""6FF6AA6D1BE24644"""
+"""A54A5F554790A8CD_A007611807234EEB_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC=CC(=C3)OC)F""",21,"""6FF6AA6D1BE24644"""
+"""B5FC9695F235D2BB_3483C169D6AABF12_6039_UN""","""O(C1CCCC12CCCC2)CC3=NN=C4[N]3CCOCC4""",21,"""6FF6AA6D1BE24644"""
+"""4AE5C13EAC55F292_BB882F01334BD7E0_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC4=C(C=C3)CCOC4""",21,"""6FF6AA6D1BE24644"""
+"""FE82FD8ABD1D6727_EF1CE7E29A85A969_6039_DP""","""O(C1CCCC12CCCC2)CC3(OC(CC34CNC4)=O)F""",21,"""6FF6AA6D1BE24644"""
+"""86FE1768DF2F91EE_17E82C45D3FF6294_6039_UN""","""O(C1CCCC12CCCC2)CC4=NC3=C(CC(C)CC3)S4""",21,"""6FF6AA6D1BE24644"""
+"""98B18B395700E14B_EAC043C19917E5AA_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=CC=C(SC)C=C3)=O""",21,"""6FF6AA6D1BE24644"""
+"""437368A5AFC49F8F_3F4FCE9DAEB1A4B8_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=C(C(OC)=O)C=N3""",21,"""6FF6AA6D1BE24644"""
+"""C4FCA4860EF95C28_863E17DF75A8C6D4_6039_UN""","""O(C1CCCC12CCCC2)CCC(N3CCN(C)CC3)=O""",21,"""6FF6AA6D1BE24644"""
+"""6D8418A2A92DAF6C_58DE7A589AA3DAC9_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(F)(F)F)C=CC=N3""",21,"""6FF6AA6D1BE24644"""
+"""2FA38FB1C7861D47_02A15700CC629AB4_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(OCC)=O)SN=N3""",21,"""6FF6AA6D1BE24644"""
+"""1E6239213D4AC90B_1C74613DC2C380DB_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=C4[N]3C=C(F)C=C4""",21,"""6FF6AA6D1BE24644"""
+"""1F979F542477DA17_7B8B3E6330CD57CF_6039_UN""","""O(C1CCCC12CCCC2)CCCC(=O)N3CCCCC3""",21,"""6FF6AA6D1BE24644"""
+"""00F1EFC81DF803D7_35A2C74C9D14DEDA_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(C)(C)C)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""3D41F2BFFE1A359D_B758C6FB18FBFF91_6039_UN""","""O(C1CCCC12CCCC2)CCC3=CC(=C(C(=C3)F)F)F""",21,"""6FF6AA6D1BE24644"""
+"""6E740495BE408ABC_06244799458630A9_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=CC(=C3)[S](F)(=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""93A1DCFF860CD955_512ECBE34EB51D2E_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=C(C(F)(F)F)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""1BC61423778FABB9_A33D1E03E166D781_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=NC=C3)C(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""D675C097695F0DE4_1D2B93C867F3691C_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)C3=CC=C(C=C3)C#C""",21,"""6FF6AA6D1BE24644"""
+"""651783774EC176DA_2D4EB9A7AE5ED528_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=C(OC(C)C)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""4501A7F803A891E8_92F89982E2AF9135_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C(C(O)=O)C=C3)F""",21,"""6FF6AA6D1BE24644"""
+"""AC8D914F2B50E9F4_21CAD3675AE5960A_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(NC(C)=O)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""C803E5A23C4C3175_C9AA7ABDFF8D0C22_6039_UN""","""O(C1CCCC12CCCC2)CC4CN3CC(CCC3=O)O4""",21,"""6FF6AA6D1BE24644"""
+"""A3108E7595073126_805D601205EC36EA_6039_UN""","""O(C1CCCC12CCCC2)CC3=NN=C(O3)N4CCCC4""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""8B467FFC36E0EA76_FD50F93980359312_6039_UN""","""O(C1CCCC12CCCC2)C[C@@H](C(C)(C)C)N[S](=O)(=O)C""",21,"""6FF6AA6D1BE24644"""
+"""6C46680B95A32D55_4283497FFD13D881_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)C3=CN=C4[N]3C=CS4""",21,"""6FF6AA6D1BE24644"""
+"""8D11BD6C5F847A56_03D271BE5FBC2577_6039_UN""","""O(C1CCCC12CCCC2)CCCOC3=CC(=O)CCC3""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""0AE0D8F8E8DFBA24_75CF262073C6C9A5_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=N3)C(C)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""3C1DE4BE4E5B24F5_1CEF689772B6C9EC_6039_UN""","""O(C1CCCC12CCCC2)CC3=NOC(=N3)C(OCC)=O""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""AC7C441C64CD71C5_335EF8F83C39CA2D_6039_UN""","""O(C1CCCC12CCCC2)CC4CC3(CCCC3)C(=O)O4""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""84E6358A3C5B1FA2_36A332055DE6EB26_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(C)(C)F)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""CC9CFD20077AE781_3A47ED311712DEE5_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C(OCC)=O)C=N[NH]3""",21,"""6FF6AA6D1BE24644"""
+"""050A684CD9E026A5_8E2F0D1D5552EA2A_6039_UN""","""O(C1CCCC12CCCC2)CCOC3(CCOCC3)C#N""",21,"""6FF6AA6D1BE24644"""
+"""1BA113E60C2B44C0_1C1AC1BD3E750607_6039_UN""","""O(C1CCCC12CCCC2)CC#CC3=CC=CC(=C3)OC""",21,"""6FF6AA6D1BE24644"""
+"""32AF670EDD22E8D2_769F908634C9FFB0_6039_UN""","""O(C1CCCC12CCCC2)CCCO[S](C(F)(F)F)(=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""1C438B714206402F_E7A1674EC421CB15_6039_UN""","""O(C1CCCC12CCCC2)CC[S](=O)(=O)C3=CC=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""8DC1A0125B165B4E_EC4D7CFAF2B10023_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=C(OC)C=C3OC""",21,"""6FF6AA6D1BE24644"""
+"""BDDCB20CDCF52195_67D491D74A175603_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=C(C(OC)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""51F2A72F989E49C6_C15BD2739AE8233D_6039_UN""","""O(C1CCCC12CCCC2)CC3=C([S](F)(=O)=O)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""EE4FCFA7FB0A4C4D_19AB0EA3874DC1B4_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=C(C(C)(F)F)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""4B227D8355F43229_BCFE9437088423F7_6039_UN""","""O(C1CCCC12CCCC2)CC3CN3CC4=C[N](C)N=C4""",21,"""6FF6AA6D1BE24644"""
+"""F93429644793890C_28BC99138CDF45FC_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC(=C(C=C3)[N](=O)=O)C""",21,"""6FF6AA6D1BE24644"""
+"""E3E8B8AB77848C8F_5600C695D8AB7D41_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=N3)OC(F)F""",21,"""6FF6AA6D1BE24644"""
+"""B01AA27AF7211B5B_11150D9220CB407E_6039_UN""","""O(C1CCCC12CCCC2)CC4=C[N]3C=CC=C(F)C3=N4""",21,"""6FF6AA6D1BE24644"""
+"""7AD569DF4C084645_4405415C66B5539F_6039_UN""","""O(C1CCCC12CCCC2)CC3=NN=C(O3)C4=CC=CO4""",21,"""6FF6AA6D1BE24644"""
+"""46C499B0BADB5E3F_2CA34F1B197BEA18_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)C3CC4=C3C=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""362943F96174B00D_04719A62024883D5_6039_UN""","""O(C1CCCC12CCCC2)CCN3CCN(CC3)C4CC4""",21,"""6FF6AA6D1BE24644"""
+"""75F9C32723569FE5_22BED9B5EF3DABD7_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)N3CCCCCCC3""",21,"""6FF6AA6D1BE24644"""
+"""8553611FD2B7BF74_69924C77A721B0CD_6039_UN""","""O(C1CCCC12CCCC2)CC(NNC(C(C)(C)C)=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""97473C0F0BC92BF0_CFED2F25A519C4B6_6039_UN""","""O(C1CCCC12CCCC2)CC(C3=C(C)[N](C(=C3)C)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""DDBCA2E2F6518019_02585DDB77623DDA_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(SC(F)F)C=CC=C3""",21,"""6FF6AA6D1BE24644"""
+"""22C8709B42FBF040_6A8AA22A76BD939E_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC(=C(O3)C)C(OC)=O""",21,"""6FF6AA6D1BE24644"""
+"""2AC28638EEC9A5D3_C19D5B4DB6B183C4_6039_UN""","""O(C1CCCC12CCCC2)CCC3=CC=C([N](=O)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""6F69FAD4DFE8BD7F_A333B81856D34A8C_6039_UN""","""O(C1CCCC12CCCC2)CCCCC(N[S](C)(=O)=O)=O""",21,"""6FF6AA6D1BE24644"""
+"""B01AEC8BC1C245A5_56EB19A877EF9421_6039_UN""","""O(C1CCCC12CCCC2)CC(=O)NC(=O)C3=CC=C[NH]3""",21,"""6FF6AA6D1BE24644"""
+"""2745D75445249C80_4B28A71216763B79_6039_UN""","""O(C1CCCC12CCCC2)CCOC3=C(C=CC(=C3)C)C""",21,"""6FF6AA6D1BE24644"""
+"""7A4FB4942CD240C7_25F2C551B32AA5BA_6039_UN""","""O(C1CCCC12CCCC2)CC3=CC=CC(=C3)OCCC""",21,"""6FF6AA6D1BE24644"""
+"""782B3203556FD0B4_16EFE7D995242769_6039_UN""","""O(C1CCCC12CCCC2)CC3=C([N](=O)=O)C=CC=C3F""",21,"""6FF6AA6D1BE24644"""
+"""65F7B738308C0524_54FF14302643B182_6039_UN""","""O(C1CCCC12CCCC2)CCCN(CC)CC(F)(F)F""",21,"""6FF6AA6D1BE24644"""
+"""5E6CBC6F6FD616E3_24B17105E84B2D17_6039_UN""","""O(C1CCCC12CCCC2)CC3=CN=C(C(C)(C)C)N=C3""",21,"""6FF6AA6D1BE24644"""
+"""9819AA9E820D141D_2CEFE8408FF49255_6039_UN""","""O(C1CCCC12CCCC2)CC3=NC=C(C(OC)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""EFD2E84E53EDE989_4E258908232310F4_6039_UN""","""O(C1CCCC12CCCC2)CC(N(C(CC(C)C)C)C)=O""",21,"""6FF6AA6D1BE24644"""
+"""CBA3259999D0BF6A_BD09658CB3112ADF_6039_UN""","""O(C1CCCC12CCCC2)CC(N3CC(CC)OCC3)=O""",21,"""6FF6AA6D1BE24644"""
+"""62F9FEAAE89068B9_5361378DB1F0541F_6039_UN""","""O(C1CCCC12CCCC2)CCC3=CC=C(C(N)=O)C=C3""",21,"""6FF6AA6D1BE24644"""
+"""9D15239FF4CEF8FC_F07D8FA5A4F16789_6039_UN""","""O(C1CCCC12CCCC2)CC(C34CC(C)(C3)OCC4)=O""",21,"""6FF6AA6D1BE24644"""
+"""61A5039B4CD295A7_3E45581512AB6BF4_6039_UN""","""O(C1CCCC12CCCC2)CC3=C4C(=CC=C3)N=CC=C4""",21,"""6FF6AA6D1BE24644"""
+"""6A64E6660634FD64_D4CF8928B6570227_6039_UN""","""O(C1CCCC12CCCC2)CC(C3CCC(C)(C)CC3)=O""",21,"""6FF6AA6D1BE24644"""
+"""A4CD54327FC19469_198C41921C01FD89_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C=C(C(N)=O)C=C3)F""",21,"""6FF6AA6D1BE24644"""
+"""7C3888C5E1A6F45F_3A665769C253C99E_6039_UN""","""O(C1CCCC12CCCC2)CC3=C(C=N[N]3C)[S](=O)(=O)Cl""",21,"""6FF6AA6D1BE24644"""
+"""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"""
+"""56CF579A9BD9775F_C3DDA1303ACAEE2F_6039_UN""","""C[C@H](OCC(N1CCC(C(N)=O)CC1)=O)CN2CCCC2""",21,"""84B363E7BB3ACD30"""
+"""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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+"""4E7FD855EC2C8547_24C2AE724D6D3F5F_6039_UN""","""O(CCC1=CSC=N1)CC2=C(C=C(C(=C2C)C(C)=O)C)C""",21,"""8CF4B8082FD7E8EF"""
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+"""F02C95A3DACEED9A_7D2017A2B7875DCD_6039_UN""","""O(CCC1=CSC=N1)CC3=NC2=C(C)C=CC=C2C(N3)=O""",21,"""8CF4B8082FD7E8EF"""
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+"""38B5E3F10020A913_C637C6A64434A9F3_6039_UN""","""O(CCC1=CSC=N1)CC2=CC=C(C=C2)C3CCCCC3""",21,"""8CF4B8082FD7E8EF"""
+"""8CE4C3C5360232A4_4F2E82ADF073DA24_6039_UN""","""O(CCC1=CSC=N1)CC2=NC(=NO2)C3=CC=CC(=C3)C""",21,"""8CF4B8082FD7E8EF"""
+"""9DB46741E210E8E8_C91BFBAF6AC8B45E_6039_UN""","""O(CCC1=CSC=N1)CC(NC2=CC=CC(=C2)C(C)C)=O""",21,"""8CF4B8082FD7E8EF"""
+"""0C1EE1C311FF8D5C_E2B4E5437DE00E0C_6039_UN""","""O(CCC1=CSC=N1)CCC(NC2=CC=CC(=C2)OC)=O""",21,"""8CF4B8082FD7E8EF"""
+"""D4C3B3322B56A4ED_7CDD8626075B0D6D_6039_UN""","""O(CCC1=CSC=N1)CC2=NOC(=N2)C3=CC=C(F)C=C3""",21,"""8CF4B8082FD7E8EF"""
+"""A9E7A4A85B9A2B92_C412A76D571FA6F1_6039_UN""","""O(CCC1=CSC=N1)CCN3C(=O)NC2(CCCC2)C3=O""",21,"""8CF4B8082FD7E8EF"""
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+"""C0E004B7BBFA9840_83C6D43A53A7355F_6039_UN""","""O(CCC1=CSC=N1)CC2=COC(=N2)CC3=CC=CC=C3""",21,"""8CF4B8082FD7E8EF"""
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+"""4606E9F22D648E3D_5446AA61F9317626_6039_DP""","""C[C@@H]3CC[C@H](OCC1=NOC(=N1)C2=CC=C(C)C=C2)CN3""",21,"""CF192C8E56414A6F"""
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+"""ECF356F59599E67B_9AB48C615A2AB919_6039_DP""","""C[C@@H]3CC[C@H](OCC(=O)NC2=C1N=[S]=NC1=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
+"""A7D89E7C315F9767_7402B879274626A0_6039_DP""","""C[C@@H]2CC[C@H](OCCOC1=CC=C(OCCC)C=C1)CN2""",21,"""CF192C8E56414A6F"""
+"""C5398E40BBB40F4E_E4AB37268EAAC3A0_6039_DP""","""C[C@@H]3CC[C@H](OCC(=O)NC2=NC1=C(C=CC=C1)S2)CN3""",21,"""CF192C8E56414A6F"""
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+"""A51550291E469C8F_9EBC16F1160EA273_6039_DP""","""C[C@@H]1CC[C@H](OCC(N(CC)CC(=O)NC(C)C)=O)CN1""",21,"""CF192C8E56414A6F"""
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+"""E94D05E242A971CA_7409BD65F88A570B_6039_DP""","""C[C@@H]2CC[C@H](OCC(NCCC1=C(C)C=CC=C1)=O)CN2""",21,"""CF192C8E56414A6F"""
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+"""19C2DB11EA43EFD5_35E7056AEEA39906_6039_DP""","""C[C@@H]2CC[C@H](OCC(NC1CCN(C(C)=O)CC1)=O)CN2""",21,"""CF192C8E56414A6F"""
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+"""803D6AE5998D9819_39BB3CC22E2ABB4E_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=CC=CC(=C1)OC(F)F)=O)CN2""",21,"""CF192C8E56414A6F"""
+"""57B1840C042AC380_529E2458831F398B_6039_DP""","""C[C@@H]2CC[C@H](OCCOC1=CC(=C(C(C)C)C=C1)C)CN2""",21,"""CF192C8E56414A6F"""
+"""4895C4F1A0F0D1AB_E30F951DCABDC988_6039_DP""","""C[C@@H]2CC[C@H](OCC(=O)NC1=CC=C(C=C1)CC#N)CN2""",21,"""CF192C8E56414A6F"""
+"""4AAC9604F4FF864B_C391542009A0682F_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=C(C=CC(=C1)CC)CC)=O)CN2""",21,"""CF192C8E56414A6F"""
+"""8C9B327F1E76EE41_C4F6DD73FCBA617F_6039_DP""","""C[C@@H]2CC[C@H](OCC(N(C)C1(CCCCC1)C#N)=O)CN2""",21,"""CF192C8E56414A6F"""
+"""45AC2B4674053553_C5ACD3347E4220DA_6039_DP""","""C[C@@H]2CC[C@H](OCC1=C(C)C=C(C=C1C)C(C)(C)C)CN2""",21,"""CF192C8E56414A6F"""
+"""F65922423BF39801_D59FB65F8AA1FBF5_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=C(C(=C(C)C=C1C)C)C)=O)CN2""",21,"""CF192C8E56414A6F"""
+"""6C52A7CAB9913AB3_82E8C6B5B45B577D_6039_DP""","""C[C@@H]3CC[C@H](OCC1=NC(=NO1)C2=CC=C(C)C=C2)CN3""",21,"""CF192C8E56414A6F"""
+"""9B8BF94F5ECEEF7A_C597348603846081_6039_DP""","""C[C@@H]2CC[C@H](OCC1=CC=CC(=C1)[S](N(C)C)(=O)=O)CN2""",21,"""CF192C8E56414A6F"""
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+"""9E5FE08BB6ECE79C_4D9D03EBA9814A0D_6039_DP""","""C[C@@H]2CC[C@H](OCCC[S](C1=CC=C(F)C=C1)(=O)=O)CN2""",21,"""CF192C8E56414A6F"""
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+"""991D423EF0EADA05_8F23BC3C74D2FBD5_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=CC(=CS1)C(N(C)C)=O)=O)CN2""",21,"""CF192C8E56414A6F"""
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+"""B53DB7BDD7E23FEE_7197E2D2816A93B8_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=CC=C(NC(N)=O)C=C1)=O)CN2""",21,"""CF192C8E56414A6F"""
+"""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"""
+"""13CABC28F5A0954B_68B82699FD8BC70C_6039_DP""","""C[C@@H]3CC[C@H](OCC1=NC2=C(N(C)C1=O)C=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
+"""79ED7E23AB091CF6_7F3D639C270EF20F_6039_DP""","""C[C@@H]3CC[C@H](OCC1=NOC(=N1)C2=C(C)C=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
+"""E54D50532775881F_EC04CB39F1F94BB7_6039_DP""","""C[C@@H]2CC[C@H](OCC1=CN=C(OCC(F)(F)F)C=C1)CN2""",21,"""CF192C8E56414A6F"""
+"""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"""
+"""9BDC9DB7CF96F0E2_D561FA955BD5A296_6039_DP""","""C[C@@H]3CC[C@H](OCC1=NC(=NO1)C2=CC=C(F)C=C2)CN3""",21,"""CF192C8E56414A6F"""
+"""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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+"""E07829AD588C73CF_8D69D3F2CB15E702_6039_DP""","""C[C@@H]3CC[C@H](OCCN2C(=O)C1=C(C=CC=C1)C2=O)CN3""",21,"""CF192C8E56414A6F"""
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+"""EE53AB5C2788E711_E2FD97189F86A97B_6039_DP""","""C[C@@H]2CC[C@H](OCC1=CC(=C(C=C1[N](=O)=O)F)OC)CN2""",21,"""CF192C8E56414A6F"""
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+"""35490E69770F68B4_848ADC40A5988991_6039_DP""","""C[C@@H]2CC[C@H](OCC1=CC=C([S](N(C)C)(=O)=O)C=C1)CN2""",21,"""CF192C8E56414A6F"""
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+"""484B770DF8057CF7_F96ACC72203CB412_6039_DP""","""C[C@@H]3CC[C@H](OCC(=O)C2COC1=C(C=CC=C1)O2)CN3""",21,"""CF192C8E56414A6F"""
+"""6AB7057151F40344_98F0E5C4A056447D_6039_DP""","""C[C@@H]3CC[C@H](OCC1=C(C)C=C(C=C1)[N]2C=NC=C2)CN3""",21,"""CF192C8E56414A6F"""
+"""C227447926A283A1_0AB4410991411DB6_6039_DP""","""C[C@@H]3CC[C@H](OCC1=NN=N[N]1CC2CCOCC2)CN3""",21,"""CF192C8E56414A6F"""
+"""0809A03C412747E3_80C39CEEF9697766_6039_DP""","""C[C@@H]2CC[C@H](OCC1=CC(=C(C=C1)[N](=O)=O)OCC)CN2""",21,"""CF192C8E56414A6F"""
+"""398F4DB6994FD734_680A5AD83C88A224_6039_DP""","""C[C@@H]3CC[C@H](OCC2=CC1=C(N(C)C(=O)CC1)C=C2)CN3""",21,"""CF192C8E56414A6F"""
+"""F362E017984B4042_76A21C04C3A17585_6039_DP""","""C[C@@H]2CC[C@H](OCC1=C(C=C([N](=O)=O)C=C1)[N](=O)=O)CN2""",21,"""CF192C8E56414A6F"""
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+"""5DD6CC605A18732B_EDE390C2AC5530C0_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=NC=C(C(F)(F)F)C=C1)=O)CN2""",21,"""CF192C8E56414A6F"""
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+"""A2F76CB567F418FE_46DFE7775DC4C743_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=CC(=NC=C1)C(F)(F)F)=O)CN2""",21,"""CF192C8E56414A6F"""
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+"""0BE4D6B34D0B8BBA_4B215257A96534A5_6039_DP""","""C[C@@H]3CC[C@H](OCC1=C(OC(O1)=O)C2=CC=CC=C2)CN3""",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"""
+"""B604B23BEF9C3425_635198AB80A3D19D_6039_DP""","""C[C@@H]4CC[C@H](OCC(=O)C23CC1CC(CC(C1)C2)C3)CN4""",21,"""CF192C8E56414A6F"""
+"""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"""
+"""9E61241BF337DE54_20C4A6C929B32B69_6039_DP""","""C[C@@H]3CC[C@H](OCC(=O)C1=CC2=C(C=C1)NC(=O)O2)CN3""",21,"""CF192C8E56414A6F"""
+"""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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+"""D934FB24F90AB31C_3B3D8087FFCDEB6C_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=CC=CC(=C1)[S](C)(=O)=O)=O)CN2""",21,"""CF192C8E56414A6F"""
+"""B13073CFCC762F4B_B7A9FCD216E9C810_6039_DP""","""C[C@@H]3CC[C@H](OCC1=CSC(=N1)CC2=NC=CC=C2)CN3""",21,"""CF192C8E56414A6F"""
+"""F9E3A4762B185405_018E0BEED8BE56AA_6039_DP""","""C[C@@H]2CC[C@H](OCC1=CC=C([S](C(C)C)(=O)=O)C=C1)CN2""",21,"""CF192C8E56414A6F"""
+"""0A1FD5FA8201D631_D3B8EC48DEF0A963_6039_DP""","""C[C@@H]2CC[C@H](OCC(C1=CN=C(OC(F)F)C=C1)=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"""
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+"""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"""
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+"""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"""
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+"""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"""
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+"""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"""
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+"""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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+"""4BBC83D78B2E14EB_4E84EF48CADB11A9_6039_DP""","""COC(=O)[C@H](COCCC(=O)NC1=C(C=CC=C1)C#N)N""",21,"""900EDC69AE6D7356"""
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+"""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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+"""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"""
+"""AF3E5316429A15FD_44C4E9DD045CDCD2_6039_UN""","""CC(OCC(C1=C(C)[N](C(=C1)C)C2CC2)=O)CCCC#C""",21,"""47F105B33DE3184A"""
+"""190297C14A3C6946_4C53C15F2828CEF3_6039_UN""","""CC(OCC1=NN=N[N]1CC2=CC=CC=C2)CCCC#C""",21,"""47F105B33DE3184A"""
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+"""192A42811BC1BDC4_6B4CDDA62AC28014_6039_UN""","""CC(OCC1=NC(=NO1)C(OCC(C)C)C)CCCC#C""",21,"""47F105B33DE3184A"""
+"""513B36E1D23665CB_BFA32C82B86A738C_6039_UN""","""CC(OCC[S](=O)(=O)C1=CC=C(C=C1)C#N)CCCC#C""",21,"""47F105B33DE3184A"""
+"""AEB2FCE97BDE3E37_BEAEAAF5D8FC9760_6039_UN""","""CC(OCCCC1=CC=C(C(F)(F)F)C=C1)CCCC#C""",21,"""47F105B33DE3184A"""
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+"""CC39A63A0782E6B3_43ABFA028DEAFCB3_6039_UN""","""CC(OCC[N]1N=CC(=C1)C2=CC=CC=C2)CCCC#C""",21,"""47F105B33DE3184A"""
+"""0A66688DBA2F2AA3_E0500FA496299529_6039_UN""","""CC(OCC1=NC2=C(N(C)C1=O)C=CC=C2)CCCC#C""",21,"""47F105B33DE3184A"""
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+"""89085BA8EE99CF40_EA3B0ACDE924E605_6039_UN""","""CC(OCC(NC1=NN=C(C(C)(C)C)S1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
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+"""F373F75B9B351E8C_5D89D3A83077F0B3_6039_UN""","""CC(OCC1=NC(=NO1)C2=CC=C(F)C=C2)CCCC#C""",21,"""47F105B33DE3184A"""
+"""93A7AF134A4A5DDB_70FFDDB812B5CE1F_6039_UN""","""CC(OCC(C1=C(C(=C(C)[NH]1)C(C)=O)C)=O)CCCC#C""",21,"""47F105B33DE3184A"""
+"""F689F157BFF8BE60_AD9FFFF8AE82DA5B_6039_UN""","""CC(OCC(=O)N1CCSC2=C1C=CC=C2)CCCC#C""",21,"""47F105B33DE3184A"""
+"""294A87A14E6EB1C3_009F38A89B020DCF_6039_UN""","""CC(OCC1=C(C=C(C(N)=O)C=C1)[N](=O)=O)CCCC#C""",21,"""47F105B33DE3184A"""
+"""8AB9C21506F8A75B_05487B1DC7231B75_6039_UN""","""CC(OCCC(=O)NC(=O)NC1CCCC1)CCCC#C""",21,"""47F105B33DE3184A"""
+"""CBDC2E5A563D6028_35E80FC5B926B89B_6039_UN""","""CC(OCC(=O)NC(=O)CC1=CC=CC=C1)CCCC#C""",21,"""47F105B33DE3184A"""
+"""2A46734AC0C22F62_7212E4886F85FC9B_6039_UN""","""CC(OCC(C1=CC(=C(C)C=C1)[N](=O)=O)=O)CCCC#C""",21,"""47F105B33DE3184A"""
+"""CD08B5CE4186FF45_FE57309F60144AAC_6039_UN""","""CC(OCC(NC1=CC=CC(=C1)C(C)=O)=O)CCCC#C""",21,"""47F105B33DE3184A"""
+"""1A96DBC0C89E5E84_4241D4AF12D5C68A_6039_UN""","""CC(OCC(NC(C(OC)=O)CC(C)C)=O)CCCC#C""",21,"""47F105B33DE3184A"""
+"""CE1C42E6241772EF_36117431412A0FE0_6039_UN""","""CC(OCC(N=C1N=C(SCCC)NS1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
+"""4A8273A7C3C4108A_F0B8F1607F114689_6039_UN""","""CC(OCC(=O)NC1=CC2=C(C=C1)CCC2)CCCC#C""",21,"""47F105B33DE3184A"""
+"""991773A791B3A718_1B4DD1917FEA84AA_6039_UN""","""CC(OCC2=NC1=C(C=C([N](=O)=O)C=C1)[NH]2)CCCC#C""",21,"""47F105B33DE3184A"""
+"""AAE40B3E98B0BEC1_5DCA5D9967447821_6039_UN""","""CC(OCCC(=O)N2CCC1=C(C=CS1)C2)CCCC#C""",21,"""47F105B33DE3184A"""
+"""930E9BAED9819970_5EB51B766CEF8BF3_6039_UN""","""CC(OCC(=O)C1=CC2=C(C=C1)OCCO2)CCCC#C""",21,"""47F105B33DE3184A"""
+"""8174692D8E15372A_CC59465DE08985A5_6039_UN""","""CC(OCCCN1C(=O)OC2=C1C=CC=C2)CCCC#C""",21,"""47F105B33DE3184A"""
+"""50FCE4F5E28D620C_FC5A406A9BD607B8_6039_UN""","""CC(OCC(=O)NC(=O)NC1=CC=CC=C1)CCCC#C""",21,"""47F105B33DE3184A"""
+"""D486A6F8E3114B6A_759E559F26D5BC59_6039_UN""","""CC(OCC(C1=CC=C(CC(C)C)C=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
+"""5A075AE8DE23F8CC_00C3E11F76AD3864_6039_UN""","""CC(OCC(C1=CC=C([S](N)(=O)=O)C=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
+"""862F16817938B9B2_C17398EB33664A6A_6039_UN""","""CC(OCC(NC1=C(C(O)=O)C=CC=C1)=O)CCCC#C""",21,"""47F105B33DE3184A"""
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+"""DC0571CB72559B5A_75BB698A96B340B6_6039_UN""","""CC(OCCC1=NC=C(O1)C2=CC=CC=C2)CCCC#C""",21,"""47F105B33DE3184A"""
+"""226820BF9C8F7556_62EF1600DD141D15_6039_UN""","""CC(OCC2=NC=C(C1=C(C)C=CC=C1)O2)CCCC#C""",21,"""47F105B33DE3184A"""
+"""F692A4F450BF8558_0D7CA01EE3B2ABA5_6039_UN""","""CC(OCCC(=O)NCCC1=CC=CC=C1)CCCC#C""",21,"""47F105B33DE3184A"""
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+"""4178189BDE87AB2E_1763E4CCACCBE6C5_6039_UN""","""CC(OCCCCCCOCCOCCC)CCCC#C""",21,"""47F105B33DE3184A"""
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+"""3F1EC0A42738124A_93F1CD7DCCE42191_6039_UN""","""CC(OCC1=N[N](C=C1)CC2=CC=CC=C2)CCCC#C""",21,"""47F105B33DE3184A"""
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+"""B89F88C5906464D9_C8256587275EE603_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=NON=C3""",21,"""FB7B3055678EBA83"""
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+"""3C8BA1A0FAF5313D_CA535C443287CAE6_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCSC(C)=O""",21,"""FB7B3055678EBA83"""
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+"""0374A7240327142A_66C629DC0ABD92E7_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=NN=CO3""",21,"""FB7B3055678EBA83"""
+"""A910CBCAC13DAAED_CA9C8605B7DD73C8_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCC(F)(F)Cl""",21,"""FB7B3055678EBA83"""
+"""375F7025AFD9395F_ED32B338E7AFF320_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC[S](O)(=O)=O""",21,"""FB7B3055678EBA83"""
+"""B1A6A88E93758CF7_1FD978E52E3C33A5_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCOC3CC3""",21,"""FB7B3055678EBA83"""
+"""08C3D5A0474FD150_D63B9FE702598566_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=CN=CS3""",21,"""FB7B3055678EBA83"""
+"""0946F085AC14B7CD_284D7B991E520E82_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=CC=NS3""",21,"""FB7B3055678EBA83"""
+"""9A9813F9CF66EB44_EFFA8A6A0E061A75_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3CC(=O)O3""",21,"""FB7B3055678EBA83"""
+"""9737CC5166D424C0_D243D35C9341CDCE_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCOC(C)=O""",21,"""FB7B3055678EBA83"""
+"""2F0AE76452CA1CD7_C407512E7B31D3A5_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCOCC#C""",21,"""FB7B3055678EBA83"""
+"""101F9B70D8F7CCA9_782C2031C5A3ABBA_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC(CC)(F)F""",21,"""FB7B3055678EBA83"""
+"""B1C620099CFEDBB6_13AD3E1A7CAEBB1D_6039_DP""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OC[C@H]3CCCN3""",21,"""FB7B3055678EBA83"""
+"""E02B169A74FD0157_C0AEB15A34CF6774_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3OC3(C)C""",21,"""FB7B3055678EBA83"""
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+"""691A3A48669821DD_2C094EEB5E9388F1_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCC3CC3""",21,"""FB7B3055678EBA83"""
+"""D81FC9B1A1ED00FB_727869708136077F_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC(C(F)F)=O""",21,"""FB7B3055678EBA83"""
+"""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"""
+"""0A4B1FFDFFFA7666_3F5E477C9296DE05_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC[S](N)(=O)=O""",21,"""FB7B3055678EBA83"""
+"""BCA6D6932E909495_195A418CB3C1EDBC_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCCC#N""",21,"""FB7B3055678EBA83"""
+"""862FFFF5F019D034_E60B83795A7C7039_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCC=CC=C""",21,"""FB7B3055678EBA83"""
+"""E46C019F936A1F85_3157407D2387F4A2_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCNC(C)=O""",21,"""FB7B3055678EBA83"""
+"""5C3318B6A4BEF214_7C057E1822343913_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC[S](=O)(=O)Cl""",21,"""FB7B3055678EBA83"""
+"""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"""
+"""B4870D7A3A75086A_ABFB26DD9F706667_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC(=C)CC#N""",21,"""FB7B3055678EBA83"""
+"""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"""
+"""5A8B2CA08651A07B_58E4C9D2DD5D68AA_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC(NCO)=O""",21,"""FB7B3055678EBA83"""
+"""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"""
+"""32D12CB9794D4D7E_1E679E00F66D5761_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCC(C)(F)F""",21,"""FB7B3055678EBA83"""
+"""4C74E0C6902E9D78_9938859441CF7992_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCC3(C)N=N3""",21,"""FB7B3055678EBA83"""
+"""608AB5AB4BB500E0_A92DE2F1E1112254_6039_DP""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3CCCN3""",21,"""FB7B3055678EBA83"""
+"""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"""
+"""6104BBE5B88AA663_5CC0FE3BF374C59B_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=N[NH]C=C3""",21,"""FB7B3055678EBA83"""
+"""BDB268D2FEA05634_834D516A761DB1F6_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCC(C)(C)F""",21,"""FB7B3055678EBA83"""
+"""3BD9397841A65D57_4199F9A21DC7E155_6039_DP""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC(C(C)C)N""",21,"""FB7B3055678EBA83"""
+"""1F7EB8E83BE0A4E5_CD04D2B900AE32AF_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCN=[N]#N""",21,"""FB7B3055678EBA83"""
+"""A8FAA25C76EAF4A2_F920D7295AB3139C_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC[N+](C)(C)C""",21,"""FB7B3055678EBA83"""
+"""89DC444838A18EFA_9F9086DCCEF862BB_6039_DP""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCCCO""",21,"""FB7B3055678EBA83"""
+"""6ABB7B35AD97F2B2_EDE7BA4C79CC18B3_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCOCCC""",21,"""FB7B3055678EBA83"""
+"""8B3ED31ADB2BC227_87A648FEA1BC6D4E_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=NC=CS3""",21,"""FB7B3055678EBA83"""
+"""5079BBCF1BA3228F_E618E2FDDEAB4C06_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=NSC=C3""",21,"""FB7B3055678EBA83"""
+"""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"""
+"""B9C08F1FB1277E65_F0478008C44D4E9E_6039_DP""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCNC3CC3""",21,"""FB7B3055678EBA83"""
+"""84E9C49DABD97539_E40F950548465D6F_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCN(CC)C""",21,"""FB7B3055678EBA83"""
+"""05AF68D2F9A82741_514205F02DD5956A_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3OC3CC""",21,"""FB7B3055678EBA83"""
+"""D10C8EBCB3F6560D_AD7A906D8914DA9D_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCCCC=CC""",21,"""FB7B3055678EBA83"""
+"""9BF09FB577B4DDEA_7021C0BFE4173DE7_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=N[NH]C=N3""",21,"""FB7B3055678EBA83"""
+"""54546847C05FF970_DCA0AF072CC0DA60_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC3=CN=CO3""",21,"""FB7B3055678EBA83"""
+"""2FFED7DEBC130327_4D5F6C24BDD10C9A_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC(=O)C(Cl)Cl""",21,"""FB7B3055678EBA83"""
+"""EB4F455161147126_0F22252928309421_6039_DP""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC([C@H](C)N)=O""",21,"""FB7B3055678EBA83"""
+"""5C3318B6A4BEF214_800AE6C5F672E67A_6039_UN""","""CC(C)C1=NC(=N[NH]1)C2=CC(=CC=C2)OCC[S](Cl)(=O)=O""",21,"""FB7B3055678EBA83"""
+"""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"""
+"""B46DB2F998265363_10A3B0D3A68F7188_6039_UN""","""O(C1=CC2=C(N=C1)C(=CC=C2)C#N)CC(NNC(C)=O)=O""",21,"""D699F8C234797C1D"""
+"""46AB52B44BE8A0E9_BE4074004A94D641_6039_UN""","""O(C1=CC2=C(N=C1)C(=CC=C2)C#N)CCOCC(F)(F)F""",21,"""D699F8C234797C1D"""
+"""BD4F3602D12F5BDD_0F346DB76ECEB49F_6039_UN""","""O(C1=CC2=C(N=C1)C(=CC=C2)C#N)CCCCOC(C)=O""",21,"""D699F8C234797C1D"""
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+"""5EC90DF865B2ED3C_023197EDEC321320_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(OC)(OC)OC""",21,"""F0EBD3232513BB54"""
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+"""B4C058155CE6E3E6_32B6D6E5EA248FA2_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC(NC(N)=O)=O""",21,"""F0EBD3232513BB54"""
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+"""E84B476007048E37_055137C686CA44CA_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC(=NO3)OC""",21,"""F0EBD3232513BB54"""
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+"""F12552AEA231A344_138C776709454704_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=NC(=CS3)C#N""",21,"""F0EBD3232513BB54"""
+"""46902B2A8FCAF058_1DDB02953896940C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(=C)C[S](=O)(=O)Cl""",21,"""F0EBD3232513BB54"""
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+"""8AA0ECC20FFA71F6_0A85F9F29A4765A2_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=C[N](CC)N=N3""",21,"""F0EBD3232513BB54"""
+"""19799CCC12103BB6_7FBC1C5A32EEDA3E_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(N=[S](C)(=O)C)=O""",21,"""F0EBD3232513BB54"""
+"""2AF1B99692EC1F28_9B02741D470F5275_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCN3CCOC3=O""",21,"""F0EBD3232513BB54"""
+"""D151FFE701B63564_731E73C562F0B6B4_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCC3CCOC3""",21,"""F0EBD3232513BB54"""
+"""275255DE4C757867_D093C19F5A3FA7C0_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3CN3CC(C)C""",21,"""F0EBD3232513BB54"""
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+"""EB2F08AF4C51A84B_088A0EFB93BB5617_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCC3=NN=N[NH]3""",21,"""F0EBD3232513BB54"""
+"""5C15C1AB63FC2F7A_FA984344349BF4B5_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC3=NOC(=N3)C""",21,"""F0EBD3232513BB54"""
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+"""3B707684C69F8A15_F37D85B83301BF0D_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3CCC[S]3(=O)=O""",21,"""F0EBD3232513BB54"""
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+"""9D92521949554EBA_879CB964FF10768F_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(OC)C3CCC3""",21,"""F0EBD3232513BB54"""
+"""3606508469B0C5BE_3942571E958ECE9C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC3=NC=CC=C3""",21,"""F0EBD3232513BB54"""
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+"""CF2BF001D4FFC82C_749D8D8E468EDB94_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC3=C[N](C)N=N3""",21,"""F0EBD3232513BB54"""
+"""88F9F29997FCACF2_46BA39608B3272E0_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(=O)C3=COC=C3""",21,"""F0EBD3232513BB54"""
+"""6A44F6E4FDF696F6_5EE4EFC64A4B8D1F_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(OCC)C3CC3""",21,"""F0EBD3232513BB54"""
+"""67E77DE6E46F1383_2A140AAEBFE1DE72_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCC(CCC)C""",21,"""F0EBD3232513BB54"""
+"""45860CC02E7E981A_1D5CFCEF013A7D46_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=C(C)C=NC=C3""",21,"""F0EBD3232513BB54"""
+"""CDF2183EDDCC7243_51E987B7DD9C5F76_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC(=NC=C3)F""",21,"""F0EBD3232513BB54"""
+"""06B7BD81D02CA1D9_CBC25A5B17C54AD2_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC=CC(=C3)F""",21,"""F0EBD3232513BB54"""
+"""5121E2C4E69530DE_5E45B078AF13267C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=NN=C(CC)S3""",21,"""F0EBD3232513BB54"""
+"""40FF81E2BB3D1099_06B3DD99FBAE381A_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=NC(=C([NH]3)C)C""",21,"""F0EBD3232513BB54"""
+"""F60875B3130F930E_5FE4D37C3272A8BF_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=C(C)N=CC=N3""",21,"""F0EBD3232513BB54"""
+"""264ECD279AAFE5EF_2DBA311CF1B0EB95_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC(=NC=C3)C""",21,"""F0EBD3232513BB54"""
+"""7F3C7A4C8375E325_8F7A61C4D8546AE4_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCSC(C)(C)C""",21,"""F0EBD3232513BB54"""
+"""ED5A45050AAA02DC_2FA5CEF057FC9F44_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3OCC(C)(C)C3""",21,"""F0EBD3232513BB54"""
+"""89D3A42BF0505631_EB0D9BC0EA9000EB_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC3=NN=N[N]3C""",21,"""F0EBD3232513BB54"""
+"""CFA38EE63B76E3CF_7CCFF4745549590C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCOC(C(C)=C)=O""",21,"""F0EBD3232513BB54"""
+"""EA4E731E5A0A86F5_04775A34B81854B3_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCCC(OC)=O""",21,"""F0EBD3232513BB54"""
+"""14D559B01F5D4EA8_689657E18310019D_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=C(N=C(C)[NH]3)C""",21,"""F0EBD3232513BB54"""
+"""E43FA55FDEBBCFCD_8EDF812119780FA4_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CSN=C3OC""",21,"""F0EBD3232513BB54"""
+"""4BEE9EE2DE73965E_BFD7A13FCCD8FC98_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC=C(C#N)O3""",21,"""F0EBD3232513BB54"""
+"""E8AFC18BADD9698A_C936C6C3359D58FE_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(CC(OC)=O)=O""",21,"""F0EBD3232513BB54"""
+"""7D273897AE658BF7_C80A36AAB8AF90E8_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC[C@@H]3C[C@H]3C4CC4""",21,"""F0EBD3232513BB54"""
+"""1166EE5B7EA95710_4E2F636287885D32_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCC(OCC)=O""",21,"""F0EBD3232513BB54"""
+"""4BE022018CCCC821_E394EE5976428BA8_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCC3=NC=C[NH]3""",21,"""F0EBD3232513BB54"""
+"""5DA41A4EACBB5ECB_7850BC4C47D79A1D_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(N(CC)CC)=O""",21,"""F0EBD3232513BB54"""
+"""1DDCE191B8CE0CAE_AAC1A39526BB8B75_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=C(C)C=CC=C3""",21,"""F0EBD3232513BB54"""
+"""7D4C1CFB51D62F1D_94938A754F785F8C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(NC(CC)C)=O""",21,"""F0EBD3232513BB54"""
+"""8DA813156F0A3398_C318651B04ED2645_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(C(OCC)=O)=O""",21,"""F0EBD3232513BB54"""
+"""55AC4FD3EA5F5306_DB9075290460343A_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCOC(F)(F)F""",21,"""F0EBD3232513BB54"""
+"""65D52ECCAB069F59_6C07A0D57A8781F8_6039_DP""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC=CC(=C3)O""",21,"""F0EBD3232513BB54"""
+"""A3C82CF9E85C4671_5AAC050C90B5E998_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC=C(F)C=C3""",21,"""F0EBD3232513BB54"""
+"""5C687E44BC1740F5_DBAE65944490A4A4_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=C(F)C=CN=C3""",21,"""F0EBD3232513BB54"""
+"""5E2B3C4F08BD4862_CAC4C97C4D83E734_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC=C(C)C=C3""",21,"""F0EBD3232513BB54"""
+"""CE2439D0DEC8274C_C7A84B2C3F0737A6_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC=CC(=C3)C""",21,"""F0EBD3232513BB54"""
+"""6FBA59F4A406C785_431FF0C12F466FFB_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=NN=C(C)[N]3C""",21,"""F0EBD3232513BB54"""
+"""4C4EEBAD44038E3F_E30E3D4553291A92_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(NCC(C)C)=O""",21,"""F0EBD3232513BB54"""
+"""CFA761D993830E61_2824765E4103973E_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(NCCCC)=O""",21,"""F0EBD3232513BB54"""
+"""5A52545DBB00DC53_9A48AF2340EDDD73_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCC3CCCC3""",21,"""F0EBD3232513BB54"""
+"""C33771A014FCDBE0_3A992756161AA4C6_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCOCCOC""",21,"""F0EBD3232513BB54"""
+"""4719801ED1739161_80931FE799D45A6C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCCC(C)(C)C""",21,"""F0EBD3232513BB54"""
+"""28E6EBF28ECC7E58_FE87FB0849442D20_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC3=NN=C[N]3C""",21,"""F0EBD3232513BB54"""
+"""3D29E9043B14181E_6200EB6ABD936ED8_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCC(C(C)C)=O""",21,"""F0EBD3232513BB54"""
+"""2CA1D40006F81074_04C493AAFB01D64C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC[S](C(F)(F)F)=O""",21,"""F0EBD3232513BB54"""
+"""0C171A1A80DA65A5_DA8EE851B96800B5_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCOCCOCC""",21,"""F0EBD3232513BB54"""
+"""6B3392DBC1B22913_7B52DCEE19A58CAE_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CN=C(CC)O3""",21,"""F0EBD3232513BB54"""
+"""D8169235E8715A39_34CCD12701849F74_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCOC3CCOC3""",21,"""F0EBD3232513BB54"""
+"""2135FBD52B055DC7_5C0AADC4510A5933_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC3=NN=C(C)O3""",21,"""F0EBD3232513BB54"""
+"""7D9EA815974FDB00_919D5B08331F4041_6039_DP""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC=CC(=N3)O""",21,"""F0EBD3232513BB54"""
+"""742D95FF4AFC924D_797CD46F8B5EBB0D_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCCCCC#C""",21,"""F0EBD3232513BB54"""
+"""46838E78DC092A73_C616691F50133C49_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=N[N](C=C3C)C""",21,"""F0EBD3232513BB54"""
+"""8E460CE1F3AD7FE9_25803994C265584F_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3OCCNC3=O""",21,"""F0EBD3232513BB54"""
+"""6E20E4049F86627C_D21E028A9CE41916_6039_DP""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CSC(=N3)CO""",21,"""F0EBD3232513BB54"""
+"""92216FBF55478BAD_2FB0231F4097A6DF_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCOC3CCC3""",21,"""F0EBD3232513BB54"""
+"""75CB1203CC5490EC_36D392A01CB90244_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC[N]3C=NC=C3""",21,"""F0EBD3232513BB54"""
+"""40792D00957DC4B0_F9DBA92AC035F024_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3OCC(F)(F)C3""",21,"""F0EBD3232513BB54"""
+"""5A466008C1B2B7EA_F5F900D0CF3B41C7_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(=O)C3=CSC=C3""",21,"""F0EBD3232513BB54"""
+"""25DC08A1F997B20E_39F7C8B54C27695D_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(=O)C3=CSN=C3""",21,"""F0EBD3232513BB54"""
+"""8C878E8A0254145B_C044FDA7B1E9973C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(=O)C3CCCO3""",21,"""F0EBD3232513BB54"""
+"""2F74D46443F9FBF2_B4A017B1714E8366_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC[N]3N=CN=C3""",21,"""F0EBD3232513BB54"""
+"""85E23E03228931B2_B21E003AC642CCFE_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=NN=C(C)C=C3""",21,"""F0EBD3232513BB54"""
+"""71203F1607140587_0C1BFD3302CB7BB6_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3OCCC3(C)C""",21,"""F0EBD3232513BB54"""
+"""9677AED9AB8E5646_34F26567A97ED7AA_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CN=C[N]3CC""",21,"""F0EBD3232513BB54"""
+"""EA05AEAA273BB24B_D18C18C59071E9CD_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC(C(F)F)(F)F""",21,"""F0EBD3232513BB54"""
+"""E410A0A186584178_21BAC5ED9DF6BA75_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC3=CC=C[N]3C""",21,"""F0EBD3232513BB54"""
+"""731935D3D1E334D7_7017AF83387A8202_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCOCCC(C)=O""",21,"""F0EBD3232513BB54"""
+"""6AA4B7872064AFE5_E6A3E9E636E7D714_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3CN(C)CCO3""",21,"""F0EBD3232513BB54"""
+"""1F34AF0516329418_ACB0C7FF76A68132_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCSC3CCOC3""",21,"""F0EBD3232513BB54"""
+"""5520D7B5158F51DF_3E13FA28C722CD55_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCN(C)[S](=O)(=O)C""",21,"""F0EBD3232513BB54"""
+"""0DBDA763CE6FF48A_756F224441FDCF5F_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=NN=C(OC)S3""",21,"""F0EBD3232513BB54"""
+"""A646491FC4BE6C15_FC78C3B144237C58_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=N[NH]C(=N3)CC""",21,"""F0EBD3232513BB54"""
+"""8DBE07A30E9F51B4_D197D8D01FC79C4C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(=O)NCCC#N""",21,"""F0EBD3232513BB54"""
+"""E83E713701B0AB87_C2622F7BE38CF749_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCCCC(O)=O""",21,"""F0EBD3232513BB54"""
+"""AF61F3A11AC439B5_06EA5CFE183A7AF6_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(NC(C)(C)C)=O""",21,"""F0EBD3232513BB54"""
+"""CDBFDAC9E1E37CC6_E42F10C1F2EE73F2_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=C(C)SC(=N3)C""",21,"""F0EBD3232513BB54"""
+"""D1208156E3606FC6_C564237B0BA100C0_6039_DP""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC(C3CCNC3)=O""",21,"""F0EBD3232513BB54"""
+"""B7CEE0E99209F643_118B1003AE34D05C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=CC=N[N]3CC""",21,"""F0EBD3232513BB54"""
+"""CD542271E8FA9AC0_76262CB47F2755D3_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC#C[Si](C)(C)C""",21,"""F0EBD3232513BB54"""
+"""F4D531C95ABED23B_361231243B61F428_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC3=NC=CN=C3""",21,"""F0EBD3232513BB54"""
+"""71153F7FBD33403E_8DE7C7CA360CB968_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCC[N]3C=NN=N3""",21,"""F0EBD3232513BB54"""
+"""F393B3605E26B355_C3F4458D2E775F64_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC#CC3=CC=CS3""",21,"""F0EBD3232513BB54"""
+"""2109803F6ED99CA6_46D2B7A83E1F2563_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCCCCCC(C)=O""",21,"""F0EBD3232513BB54"""
+"""2F62E8AC1F2CAB8E_3ADC219CC3F15848_6039_DP""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3=C(CN)OC=N3""",21,"""F0EBD3232513BB54"""
+"""B3C6D11B036BCE01_D1E3657A231EFB6C_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC3CC[S](=O)(=O)N3""",21,"""F0EBD3232513BB54"""
+"""8E067EB783BA59DA_34EC14FF0D2D3EB6_6039_UN""","""C[N]1C=C(C=N1)[C@@H]2OCC[C@H]2COCC#CCOC(C)=O""",21,"""F0EBD3232513BB54"""
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+"""AFE350BA7BA35F14_CBBEAA70A477F717_6039_DP""","""N1CCC3(CC1)CC(OCC[S+](C)C)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
+"""98DD41EEEE89819F_076149EF7C26C6F7_6039_DP""","""N1CCC3(CC1)CC(OCCC(C)=O)C2=C(C=CC=C2)O3""",21,"""12F3D75AF83B7F12"""
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+"""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"""
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+"""A18007ABDC3441CE_A5DF903509DA1936_6039_UN""","""NC(=O)[C@@H]2C[C@@H](OCC1CO1)CN2C(=O)C3=CC=CC=C3""",21,"""DCC12CB1F04C802B"""
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+"""87469A79562B3766_9662DE74CEF8CD55_6039_UN""","""NC(=O)[C@@H]2C[C@@H](OC[C@H]1CO1)CN2C(=O)C3=CC=CC=C3""",21,"""DCC12CB1F04C802B"""
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+"""3199E1DC44A4B7B9_7106D8C97843020B_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCC(F)F)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
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+"""4663D95DBA3A77B2_35D0B8FD22FFDA64_6039_UN""","""NC(=O)[C@@H]1C[C@@H](OCCCF)CN1C(=O)C2=CC=CC=C2""",21,"""DCC12CB1F04C802B"""
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+"""DE178878B7CE067E_EFCD22265E04E07A_6039_UN""","""O(CC1=NN=N[NH]1)CC(N2C(CC)C3=C(CC2)SC=C3)=O""",21,"""61AAA8EA1A3A9448"""
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+"""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"""
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+"""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"""
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+"""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"""
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+"""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"""
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+"""D16106BFF869446A_47A1D010BDA7808A_6039_UN""","""O(CC1=NN=N[NH]1)CC3=NN=C(CC2=C(C)C=CC=C2)O3""",21,"""61AAA8EA1A3A9448"""
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+"""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"""
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+"""264422C890847686_6573339E4C846585_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=CC=C([S](N)(=O)=O)C=C2)=O""",21,"""61AAA8EA1A3A9448"""
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+"""EDA4EF8106649EC9_AA921102C8AA3178_6039_UN""","""O(CC1=NN=N[NH]1)CC(NC2=C(C=CC(=C2)OC)OC)=O""",21,"""61AAA8EA1A3A9448"""
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+"""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"""
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+"""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"""
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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"""
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+"""8CA9CB15BFC78A0E_79E5F1CB44A8A97E_6039_UN""","""O(CC1=NN=N[NH]1)CCC[S](C2=C(OC)C=CC=C2)(=O)=O""",21,"""61AAA8EA1A3A9448"""
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+"""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"""
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+"""5EBDC11427CCD7AE_60C813539FA8BE34_6039_UN""","""O(CC1=NN=N[NH]1)CC2=C(C(OC)=O)C=CC=C2[N](=O)=O""",21,"""61AAA8EA1A3A9448"""
+"""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"""
+"""FF0B4899D969E73B_92D499FC1863A46F_6039_UN""","""O(CC1=NN=N[NH]1)CC(C(C2=CC=CC(=C2)OC)=O)(F)F""",21,"""61AAA8EA1A3A9448"""
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+"""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"""
+"""48AD242E92347B84_4579FBBEDC3C6F2F_6039_UN""","""O(CC1=NN=N[NH]1)CC3=NC=C(C2=CC=C(CC)C=C2)O3""",21,"""61AAA8EA1A3A9448"""
+"""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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+"""C4C326703F44CD5C_B6BF103D754C2E27_6039_UN""","""O(CC1=NC=CC=N1)CCOC2=CC3=C(C=C2)C=CC=C3""",21,"""A6D6950D662EA2EC"""
+"""EBBC2ECD4259DAEC_AA6202C037A2D3DF_6039_UN""","""O(CC1=NC=CC=N1)CC(NC2=C(C(OC)=O)SC=C2)=O""",21,"""A6D6950D662EA2EC"""
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+"""E939F95D28DD3596_5851949AE7D44610_6039_UN""","""O(CC1=NC=CC=N1)CC(C2=C(C(=CC(=C2C)C)C)C)=O""",21,"""A6D6950D662EA2EC"""
+"""89022A9D505E5413_DFB8FD5640979345_6039_UN""","""O(CC1=NC=CC=N1)CC2=NOC(=N2)CCCC(OC)=O""",21,"""A6D6950D662EA2EC"""
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+"""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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+"""B08FD72553924339_C5A533667FF14183_6039_DP""","""N1CC2CC1CC2OCCC(=O)NC3=C(C=CC=C3)C#N""",21,"""1B2F00471B47237C"""
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+"""2C18C944EB1BEFD0_6C011A8A8A6CA490_6039_DP""","""N1CC2CC1CC2OCC(C3=C(C=CC(=C3)OC)OC)=O""",21,"""1B2F00471B47237C"""
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+"""11D088E266B3504C_2A3BDEE6C7A9394D_6039_DP""","""N1CC2CC1CC2OCC3=NC(=NO3)C4=NC=CC(=C4)C""",21,"""1B2F00471B47237C"""
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+"""0C5944C82AADB246_9AF74A7B2F2B92A3_6039_DP""","""N1CC2CC1CC2OCC3=CSC(=N3)C4=CC=C(F)C=C4""",21,"""1B2F00471B47237C"""
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+"""F5C4C63DDF741782_9795FB932EEC7C36_6039_DP""","""N1CC2CC1CC2OCC(C3=CC=C(OC(C)C)C=C3)=O""",21,"""1B2F00471B47237C"""
+"""7B338A012872D0DA_06EC32BADB8A4F95_6039_DP""","""N1CC2CC1CC2OCC3=C(OCC)C=CC(=C3)[N](=O)=O""",21,"""1B2F00471B47237C"""
+"""12857897E127F3FC_CA264CA07B63D1CF_6039_DP""","""N1CC2CC1CC2OCC(N(CC)C3=C(C=CC=C3)C)=O""",21,"""1B2F00471B47237C"""
+"""650363440CDFE776_FE2F2128C21A6A8B_6039_DP""","""N1CC2CC1CC2OCC3=COC(=N3)C4=CC=CC(=C4)F""",21,"""1B2F00471B47237C"""
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+"""C14F010222CC1F23_4BBDE1388A6FDDF3_6039_DP""","""N1CC2CC1CC2OCCCCCCOCCOCCC""",21,"""1B2F00471B47237C"""
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+"""CC5D0FE9F6A78CAC_D60761CF2DF3C703_6039_DP""","""N1CC2CC1CC2OCC4CCC3(CCCCCCC3)O4""",21,"""1B2F00471B47237C"""
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+"""3D7D3FED6C07EE9E_B86CE8870D2FFCFE_6039_DP""","""N1CC2CC1CC2OCC3=N[N](C(=C3)C)C4=CC=CC=C4""",21,"""1B2F00471B47237C"""
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+"""274ACC06CF440013_87FA252A79C331BF_6039_DP""","""N1CC2CC1CC2OCC(N(C(C)C3=CC=CC=C3)C)=O""",21,"""1B2F00471B47237C"""
+"""A27C74FE73B0D001_7A906491635D7455_6039_DP""","""N1CC2CC1CC2OCCOC3=C(C(F)(F)F)C=CC=C3""",21,"""1B2F00471B47237C"""
+"""514C36A95FB4CA17_EF0BAC4EB2CB827F_6039_DP""","""N1CC2CC1CC2OCC(C3=CC=CC(=C3)[S](C)(=O)=O)=O""",21,"""1B2F00471B47237C"""
+"""D499A8938BE89978_639FD01B5BEFA103_6039_DP""","""N1CC2CC1CC2OCC3=CSC(=N3)CC4=NC=CC=C4""",21,"""1B2F00471B47237C"""
+"""940C5FB549F83CB8_D5B8272795B83FB9_6039_DP""","""N1CC2CC1CC2OCC3=CC=C([S](C(C)C)(=O)=O)C=C3""",21,"""1B2F00471B47237C"""
+"""ABF9222C2319D91B_078EC08193F6C070_6039_DP""","""N1CC2CC1CC2OCC(C3=CN=C(OC(F)F)C=C3)=O""",21,"""1B2F00471B47237C"""
+"""FF1FCB07D05C8097_A658702B575459A2_6039_DP""","""N1CC2CC1CC2OCC(=O)C3CCOC4=C3C=CC=C4""",21,"""1B2F00471B47237C"""
+"""50D85062C08B4B2C_5164453B0DEE4130_6039_DP""","""N1CC2CC1CC2OCC(N[C@H](C)C3=CC=C(C=C3)F)=O""",21,"""1B2F00471B47237C"""
+"""E6AEE133B12FE893_246E4E17AA6E3576_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(NOC)=O""",21,"""E99986E879805DF5"""
+"""4E05D00FDA782A60_9BEBC7AF5843AE10_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCC(OC)=O""",21,"""E99986E879805DF5"""
+"""7424B46110122388_1EEC9C8716F888A1_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(OC)OC""",21,"""E99986E879805DF5"""
+"""EF1F1BAD2B83AC74_541EF0D798A60D0E_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(C(O)=O)=O""",21,"""E99986E879805DF5"""
+"""D65614B01F7B6222_1154885E8AD3267B_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCOC(C)C""",21,"""E99986E879805DF5"""
+"""57DF9BFBE8E4A36F_9763D1B8C72A3662_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3OCCO3""",21,"""E99986E879805DF5"""
+"""79307DBA05FDDC52_3FF4F0137D133B95_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3CCCO3""",21,"""E99986E879805DF5"""
+"""EDFCCF0FC6B9F6EE_0F0A7A356203E071_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCC(NC)=O""",21,"""E99986E879805DF5"""
+"""D1127CD041097911_52ED7E7107BF6821_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCCN=C=O""",21,"""E99986E879805DF5"""
+"""38B4B697B626F35D_A6971532D3015045_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3=NC=NO3""",21,"""E99986E879805DF5"""
+"""E52D274B4ECB6983_8BE1DAE4E0CD87C7_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(=O)C3CC3""",21,"""E99986E879805DF5"""
+"""7F25E609AFDA2172_B86C42032BFDCD37_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(CCC)=O""",21,"""E99986E879805DF5"""
+"""64426C56C6A0C9B2_301804ACB63A60A3_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(C(C)C)=O""",21,"""E99986E879805DF5"""
+"""A689863491C1BB97_2AB5CC4F3A8E7AC4_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCCCOC""",21,"""E99986E879805DF5"""
+"""904543B89CCFBA26_F14B9C5169A3FE8B_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCCN(C)C""",21,"""E99986E879805DF5"""
+"""3E43E667890C8B7F_3AFA4AFC36ED3534_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCCOCC""",21,"""E99986E879805DF5"""
+"""F06355940E22CFA1_11464F5745F06022_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCCC(C)=O""",21,"""E99986E879805DF5"""
+"""4BCD0B24301C085A_D3F12B1E08E129F7_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3=NOC=N3""",21,"""E99986E879805DF5"""
+"""8B18F5804BFE756A_89F73C6E1B2096FE_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCC(C)(C)C""",21,"""E99986E879805DF5"""
+"""7AE83559C125FD15_3CDA1249D13D292A_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3=CSC=N3""",21,"""E99986E879805DF5"""
+"""EA5F74511F112DA9_A6D4D121A214AF67_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3=NN=N[NH]3""",21,"""E99986E879805DF5"""
+"""0BAEFF3689896BA0_A1432F5766B85B61_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COC[CH]=[C]3C[CH2]C3""",21,"""E99986E879805DF5"""
+"""2A7163CEA7FC10CA_AD66737D202F4619_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(N(C)C)=O""",21,"""E99986E879805DF5"""
+"""9A21E6156E814E78_A37DDBF5B01B4DA4_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC#CCOC""",21,"""E99986E879805DF5"""
+"""7CC3199B068BB58C_17B8C39DA0752F25_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCC(Cl)(Cl)Cl""",21,"""E99986E879805DF5"""
+"""EA5D0ECCDCFB44DF_88C723D23377EE6D_6039_DP""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCCC(O)=O""",21,"""E99986E879805DF5"""
+"""60F99EFF311AB5B5_27D3B17609933A25_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3=C[NH]C=N3""",21,"""E99986E879805DF5"""
+"""B857167075D6E40E_8010BD163A298F51_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCC=CCC""",21,"""E99986E879805DF5"""
+"""0711FAE00BB10F36_E8E15AA7C7635862_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCCC(C)C""",21,"""E99986E879805DF5"""
+"""D1E81C2021FAB2D6_086CE76620BF554C_6039_DP""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCOCCN""",21,"""E99986E879805DF5"""
+"""2B311D3CAC0B8197_A0B23D3B2BF65C8F_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCC(NO)=O""",21,"""E99986E879805DF5"""
+"""0AC62BD180C17628_2A868210971FCC48_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3=C[NH]N=C3""",21,"""E99986E879805DF5"""
+"""59B64CD7E88153F8_315BEC292E57002B_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC[S](C)(=O)=O""",21,"""E99986E879805DF5"""
+"""7FF57261DD22918D_E224D263547B6DCD_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(COC)=O""",21,"""E99986E879805DF5"""
+"""BE85206ED6BE0063_70F3A0415B9A2447_6039_DP""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCCC3CNC3""",21,"""E99986E879805DF5"""
+"""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"""
+"""62F693EDEAED8BC6_6E966EACE5F825EC_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3=C[NH]N=N3""",21,"""E99986E879805DF5"""
+"""53A9BF3BBD966689_E5176C2DD8191778_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC(OCC)=N""",21,"""E99986E879805DF5"""
+"""D4339642037702D5_3F4B242EEC2B2D3B_6039_UN""","""CC[N]1N=CC=C1[C@@H]2OCCC[C@H]2COCC3=CC=N[NH]3""",21,"""E99986E879805DF5"""
+"""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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+"""C6CDC3ED88D4E98F_F7EAD3D6344E98E3_6039_UN""","""COCC(C)(OCC1=NC(=CS1)C2=CC=C(C)C=C2)C#C""",21,"""AA1F8C092E52535D"""
+"""EC1C3FAC5BDE73EC_EA434E7CB4013388_6039_UN""","""COCC(C)(OCCC2=C(C)N=C1SC=CN1C2=O)C#C""",21,"""AA1F8C092E52535D"""
+"""7950E95CDEF68478_88E53045D44629F2_6039_UN""","""COCC(C)(OCC(C1=NC=C(C(F)(F)F)C=C1)=O)C#C""",21,"""AA1F8C092E52535D"""
+"""4C63F8A47FC4C563_4F623D3F63D888F4_6039_UN""","""COCC(C)(OCC(=O)C2=C1C=CC=CC1=CC=N2)C#C""",21,"""AA1F8C092E52535D"""
+"""6D477ED77A02BA5C_A9E9C506A1282E71_6039_UN""","""COCC(C)(OCC(C1=CN=C([S](C)(=O)=O)C=C1)=O)C#C""",21,"""AA1F8C092E52535D"""
+"""09AB42F26DAF0972_23D947F025D7DE71_6039_UN""","""COCC(C)(OCC(C1=CC(=NC=C1)C(F)(F)F)=O)C#C""",21,"""AA1F8C092E52535D"""
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+"""FCBC6FDC719C4641_FD9DFAD002BB661C_6039_UN""","""COCC(C)(OCC(NC(C(CC)C)C(=O)OC)=O)C#C""",21,"""AA1F8C092E52535D"""
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+"""926390270403E025_D371E45208EB62F4_6039_UN""","""COCC(C)(OCC1=NOC(=N1)CCCC(OC)=O)C#C""",21,"""AA1F8C092E52535D"""
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+"""FBCA5680DEED6E32_DF4F76ABC0A55EF3_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(C=CC=C2)C#N""",21,"""1617F2BC2F88E021"""
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+"""883A25D665530DFE_64A9FB761AC6AB8C_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2=C[N](C)N=C2""",21,"""1617F2BC2F88E021"""
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+"""E20D2CAA30B57553_AE569BA29C26853A_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CSC3=NCCN23""",21,"""1617F2BC2F88E021"""
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+"""D41FC3A5A008F81E_42F672B48B48BEFC_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCOCC(F)(F)F""",21,"""1617F2BC2F88E021"""
+"""42E14F76FA341F0E_0758CDDFB99BB312_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(NCCN(C)C)=O""",21,"""1617F2BC2F88E021"""
+"""CF8600AA801E3303_9BEBA66DF73903E7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C[N]3C(=N2)SC=C3""",21,"""1617F2BC2F88E021"""
+"""669457FF8BE9FCDF_2FF89DEB9BB4A04B_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCN2CCOCC2""",21,"""1617F2BC2F88E021"""
+"""532637F06E0729DD_456440EBBCAC993B_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2OCCN(CC)C2""",21,"""1617F2BC2F88E021"""
+"""3BE36EC51DA903BC_A073EEA9D9FFA379_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=N[N]2C(C)C""",21,"""1617F2BC2F88E021"""
+"""B3B8D7F4CF93C77A_475CE62092A8BFED_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCCC(N(C)C)=O""",21,"""1617F2BC2F88E021"""
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+"""3FE9A1C58774F0B2_046DE8282CB3A9A7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=C[N](C)N=C2)=O""",21,"""1617F2BC2F88E021"""
+"""FB09D96C72593379_8CBCD65CB825B036_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC[S](N(C)C)(=O)=O""",21,"""1617F2BC2F88E021"""
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+"""B81457C54B0836DF_DAC81C7D5F387EAA_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(C)C=CC=C2C""",21,"""1617F2BC2F88E021"""
+"""9171B2E5CE17F7F5_5850F69381B2770F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC=CC(=N2)OC""",21,"""1617F2BC2F88E021"""
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+"""496766AF72358E84_D3EDD3051C421557_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2=CC=C(C)C=C2""",21,"""1617F2BC2F88E021"""
+"""E8CF40923CD1115F_107B84296AA7EC02_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CN=C(OC)C=C2""",21,"""1617F2BC2F88E021"""
+"""90B5ECF3C313CA25_CD9AC56803608A4F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2ON=C(C(C)C)C2""",21,"""1617F2BC2F88E021"""
+"""2A86787B2F16A0A2_374A0A18EBD2926F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2COC(C)(C)O2""",21,"""1617F2BC2F88E021"""
+"""060B2A3513FF0980_72A0D5F6EC2DD721_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(NC(C)C(=O)O)=O""",21,"""1617F2BC2F88E021"""
+"""717BEFE964ED953C_6FC14CC993745503_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(NCCOCC)=O""",21,"""1617F2BC2F88E021"""
+"""A7AFB24B2633059D_4341B7B28A877748_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(C=CC(=C2)F)F""",21,"""1617F2BC2F88E021"""
+"""B225EF5143E8827B_0DC7D90330CAD31E_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(OC)N=CC=C2""",21,"""1617F2BC2F88E021"""
+"""9921229B89995FBD_0E4EE556DDFDC229_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOCC2CCCO2""",21,"""1617F2BC2F88E021"""
+"""8D56E024832ACE24_5909F090BDEAEB97_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2=C(C)N=CS2""",21,"""1617F2BC2F88E021"""
+"""AB1F831291FCAAB7_7F27A677B81589A5_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2CCC(C)CC2""",21,"""1617F2BC2F88E021"""
+"""D3E1F72A413102A7_0434A2AA95E04834_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC[S](C(C)C)(=O)=O""",21,"""1617F2BC2F88E021"""
+"""CEF0892AEB402E72_0CBB6B5B6B419C85_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=C([N]2CC)C""",21,"""1617F2BC2F88E021"""
+"""938F7C0A24992B7E_6173CF64D2896C0C_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)C2CCOCC2""",21,"""1617F2BC2F88E021"""
+"""B5E0E3E10BE404E0_A9E22EEDB397634A_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCN2CCCCC2""",21,"""1617F2BC2F88E021"""
+"""4DD2A7444176579D_1E72F2502A843CA9_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2=NN=C(C)O2""",21,"""1617F2BC2F88E021"""
+"""CBA023CD23223BE2_AA58AF7E2D3917E1_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCCN(CC)CC""",21,"""1617F2BC2F88E021"""
+"""B52DCEEF1324487C_FCF1F0E96FBF6EE3_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2CCC[S]2(=O)=O""",21,"""1617F2BC2F88E021"""
+"""3DFC867B8A25A50F_46F92FCE76428983_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(N(C)CC2CC2)=O""",21,"""1617F2BC2F88E021"""
+"""6CC572D1886A354E_4FA1C652D70CA033_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=CC=C[N]2C)=O""",21,"""1617F2BC2F88E021"""
+"""DE3BC0C9E9DA638F_35482B4B33446F02_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC(NC(NC)=O)=O""",21,"""1617F2BC2F88E021"""
+"""255245C260A50880_2E4D9D5D244C6487_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC=C(C(C)C)O2""",21,"""1617F2BC2F88E021"""
+"""FD02E1CB91718708_2E3D42DE589BDFA1_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(ON=C2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""F6917CBF5393403C_F09FAEF9ADF6570E_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(N2CCNCC2)=O""",21,"""1617F2BC2F88E021"""
+"""929324CCF005D9F9_A769E679C94BF53D_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOC[C@H]2NC(O[C@@H]2C)(C)C""",21,"""1617F2BC2F88E021"""
+"""048850710901B586_1C5D6FE3CB1FD3F6_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(NCCCCC)=O""",21,"""1617F2BC2F88E021"""
+"""6431FA83791EE443_A15EBA054F5288BF_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=C[N](C)C=C2)=O""",21,"""1617F2BC2F88E021"""
+"""6D1B869CA8A126A4_CA3B34AA7D6F5772_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CSC(=N2)COC""",21,"""1617F2BC2F88E021"""
+"""A3F4569160B18742_83E5D1115E4E8FB3_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2=C(ON=C2C)C""",21,"""1617F2BC2F88E021"""
+"""C6907D0847EA336B_5426B651CBDD20FF_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=C(O2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""4A394CC84F680D7D_BE839B6F57A45F26_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCN[S](CC)(=O)=O""",21,"""1617F2BC2F88E021"""
+"""9BE25866CF654DCC_863FFB5592FFADEA_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=C(F)C=C2)F""",21,"""1617F2BC2F88E021"""
+"""D52150A145987D93_6F948AD8864BBF03_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC[N]2C=CN=C2C""",21,"""1617F2BC2F88E021"""
+"""967119257C4FBFA6_C04188B72CB66C08_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(OC)C=CC=C2""",21,"""1617F2BC2F88E021"""
+"""B5ECC2945F024F6A_31D3288FE68F7838_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOCC(OCC)=O""",21,"""1617F2BC2F88E021"""
+"""265D66FF59FCDB1F_5F83D10F7DC1B32A_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC[N]2N=C(C)N=C2C""",21,"""1617F2BC2F88E021"""
+"""FE4A9D903BD807AC_EC0DC81D0B691901_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(ON=C2CC)C""",21,"""1617F2BC2F88E021"""
+"""F321997101535EBE_2BFA4D7F4F0AFEF4_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(OC=N2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""92F7B89A47B43F38_3DE40B678FE28905_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2CCN(C)CC2""",21,"""1617F2BC2F88E021"""
+"""FB4794C47B254FAB_F7F5525B6F6ED3E0_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(C(C)C)OC=N2""",21,"""1617F2BC2F88E021"""
+"""F933A75DB111AEAD_D976CC32810A818B_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2C(C=CC=C2)=O""",21,"""1617F2BC2F88E021"""
+"""EC4C63615F7B7585_6D3C0C6758686A54_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC(=NO2)COC""",21,"""1617F2BC2F88E021"""
+"""C18C4CF710202123_EB7669E2EEAC96A7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC=C(CF)C=C2""",21,"""1617F2BC2F88E021"""
+"""5CDD7C391709D4DB_AF04AB8130953228_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)NC2CCCC2""",21,"""1617F2BC2F88E021"""
+"""86DE4C131564E4DF_19858D060D01B07E_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)NC2=NC=CS2""",21,"""1617F2BC2F88E021"""
+"""398ECABC8EAABAEF_DFB928E3188DA7E2_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=C(CCC)S2""",21,"""1617F2BC2F88E021"""
+"""57126FA7F5A0AEE2_72C9C63BDA13E55D_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CSC(=N2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""7CC3956307412C7E_8C09FCBCDB607763_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)C2CCCCC2""",21,"""1617F2BC2F88E021"""
+"""7F4C965B2B5B544B_338C53439F7D6973_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NOC(=N2)COC""",21,"""1617F2BC2F88E021"""
+"""F6F9A44C3A7B92D9_774CF60FAAD52146_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC=C(C=C2)C#N""",21,"""1617F2BC2F88E021"""
+"""F7B745D97C1DCEDB_9DA0A8AD6C4DECF9_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(SC)C=CC=C2""",21,"""1617F2BC2F88E021"""
+"""1FE34E8632658CEF_44CC83FE01B7C6E1_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(NCC(F)(F)F)=O""",21,"""1617F2BC2F88E021"""
+"""1ED8F402817A774B_D160F4CA06115576_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=C(C(F)F)S2""",21,"""1617F2BC2F88E021"""
+"""6006708C0DBCCEBF_8971F617583FC22E_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(F)C=CC=C2F""",21,"""1617F2BC2F88E021"""
+"""C8C5DEEB85F84AF6_70852FF285083BDD_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC(=CS2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""C479ADAF91FF25A6_31F0A035992A5A1F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C#C[Si](C)(C)C)=O""",21,"""1617F2BC2F88E021"""
+"""312972C466B9C5E3_DD847235E93143C7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2N(C)CCCC2""",21,"""1617F2BC2F88E021"""
+"""BEB0A41D7E74768F_303280A493B14C5E_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)C2CCCOC2""",21,"""1617F2BC2F88E021"""
+"""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"""
+"""1CAF3E671E8270DE_7F91E7D80479520A_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=CC(=NO2)C)=O""",21,"""1617F2BC2F88E021"""
+"""F0D01A4BF5F87A46_84BAB359283CC207_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOC2=CC=CC=C2""",21,"""1617F2BC2F88E021"""
+"""11F25677866BE8FE_A2C30EC903D00025_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC(=NO2)N(C)C""",21,"""1617F2BC2F88E021"""
+"""C592C71137BAB6AE_292C47A4E8B4F470_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(C)C=C(C=C2)F""",21,"""1617F2BC2F88E021"""
+"""C2D5BEEBCD8788D4_2D95C9F755A47477_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(N=C(C)C=C2)C""",21,"""1617F2BC2F88E021"""
+"""4A465ECAFB84BB91_F20DFB356550AC1D_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOC2=CN=CC=C2""",21,"""1617F2BC2F88E021"""
+"""36441481095858C9_7DE0007C7C3473BB_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(CC)C=CC=C2""",21,"""1617F2BC2F88E021"""
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+"""7AFB756ECB5CD278_FE00C37E3F0A3437_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2C(C)COCC2""",21,"""1617F2BC2F88E021"""
+"""7F259AA6A0666010_1CE95A8B6BC23BD1_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2CC(F)(F)C(O2)=O""",21,"""1617F2BC2F88E021"""
+"""96CD209001D8C23C_ABEB2530B3BB2EA7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2CCOCCC2""",21,"""1617F2BC2F88E021"""
+"""79050DFD45634D01_DDB7447490EF79DF_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=C(N(C)C)O2""",21,"""1617F2BC2F88E021"""
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+"""CE788EB422A7711B_2A57BF6023057790_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=C(C)C=C2)C""",21,"""1617F2BC2F88E021"""
+"""B95314DB017230C0_3C04A4607B74C0A7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=C(OC)C=C2""",21,"""1617F2BC2F88E021"""
+"""8D0A255116AC2A0D_C58F49F3FDD3FDE8_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CN=C(OC)N=C2""",21,"""1617F2BC2F88E021"""
+"""E4B8617D8A618536_F69FE07EDE70054D_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCSC2CCCCC2""",21,"""1617F2BC2F88E021"""
+"""D3F9489EF125CEB8_CFDDFD13C493C0B7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC(C(OC)=O)(C)C""",21,"""1617F2BC2F88E021"""
+"""A0F1D5F16870C955_D72C39E2926E509B_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=N[N](C)N=C2)=O""",21,"""1617F2BC2F88E021"""
+"""0799ED4D99E89F23_1530A5B4960C518D_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(CCSC(C)=O)=O""",21,"""1617F2BC2F88E021"""
+"""B8746F113026AADE_1682B05E7EB5451F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=COC(=N2)C(C)C""",21,"""1617F2BC2F88E021"""
+"""6F740B805F9F51E1_57BD0A413485E22F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(OC)C=CN=C2""",21,"""1617F2BC2F88E021"""
+"""521211FB1D0CFF1A_34D480C258E21F2C_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CN=CC(=C2)OC""",21,"""1617F2BC2F88E021"""
+"""82CFD1E4CEB6ED15_91DA5DB215D85859_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C[N](C(C)C)N=N2""",21,"""1617F2BC2F88E021"""
+"""D90FA7FB1280DA2A_BC5D605E0EC34882_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOCCNC(C)=O""",21,"""1617F2BC2F88E021"""
+"""60DE85006B149131_4BFFE3115490552E_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2CCOCC2=O""",21,"""1617F2BC2F88E021"""
+"""75009AC516362E34_1504A730327CF85F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=NO2)C(C)=O""",21,"""1617F2BC2F88E021"""
+"""388421352F8A2355_61ABB0F5E34EDFF7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(CCC(OC)=O)=O""",21,"""1617F2BC2F88E021"""
+"""7B491FB776DA6F87_747B288786FC1330_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C(CC(O)=O)N)=O""",21,"""1617F2BC2F88E021"""
+"""7B1D52161993FBB7_D75B11E78EE0F994_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(N=C(CC)O2)C""",21,"""1617F2BC2F88E021"""
+"""0719B89909515E48_0B32383CADAFC11C_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=NO2)C(C)C""",21,"""1617F2BC2F88E021"""
+"""D03DD14C5EE582C9_146327A969E10254_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=N[N](CCC)C=C2""",21,"""1617F2BC2F88E021"""
+"""CA5A4ED7346F7315_871DB6D16E737B2B_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)N2CCOCC2""",21,"""1617F2BC2F88E021"""
+"""40E58516BF3AFC8A_2E7C50116BB6A434_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC=C[N]2C(F)F""",21,"""1617F2BC2F88E021"""
+"""83D81850D4E01453_57E3C707C65EBFFA_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)N2CCCC2=O""",21,"""1617F2BC2F88E021"""
+"""1044C407FC97064A_740F54509CD7DF1E_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC=CC(=C2)OC""",21,"""1617F2BC2F88E021"""
+"""1748C37AF215515F_A9AEC81024B3BA15_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCCN2CCCC2""",21,"""1617F2BC2F88E021"""
+"""1B77DF14CFA2362B_655F61B00564063D_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC=CC(=N2)OC""",21,"""1617F2BC2F88E021"""
+"""F7FA6DF8C91AEE18_460A1AF6BAA87E41_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(N=C(C)C=N2)C""",21,"""1617F2BC2F88E021"""
+"""ACDDE7EAB8E689CA_F364FF5C1B1D8336_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC(C(OC)=O)=O""",21,"""1617F2BC2F88E021"""
+"""B6DF77139ED8CA8E_A24B3A31DC3420D1_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)C2=NC=CN=C2""",21,"""1617F2BC2F88E021"""
+"""CA4F128D1AF93D62_E3B44FB1EDB7A89E_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC[N]2N=C(C)C=C2C""",21,"""1617F2BC2F88E021"""
+"""E08C5426D6D75A06_BFCB27748CA4883E_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=N[N](CC)N=C2C""",21,"""1617F2BC2F88E021"""
+"""79BD0DD628A6EBDE_6070FE3F3DCF35FB_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(OCC(F)(F)F)=O""",21,"""1617F2BC2F88E021"""
+"""F70E3980A59005B9_2A44CC7D8F27DCF5_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(C=CC(=C2)C)F""",21,"""1617F2BC2F88E021"""
+"""77725D85541306ED_D27B6AC43E811AFD_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=CN=N[N]2C)=O""",21,"""1617F2BC2F88E021"""
+"""5FDC930D965E5D78_DA2DFEFC1A758597_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC=N[N]2CCC""",21,"""1617F2BC2F88E021"""
+"""6BD40C3039F5B815_B661484D0F802501_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2CCOCC2""",21,"""1617F2BC2F88E021"""
+"""CB4F7FA5FA137F9B_B8784C0C1830EB1F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCCCC(C)(C)C""",21,"""1617F2BC2F88E021"""
+"""CF6106FE243EB555_51FE2D2C71A7A1D5_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(C=CC(=C2)C)C""",21,"""1617F2BC2F88E021"""
+"""BABC8D30672550E1_4B4BE9DAE750FF1F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=N[NH]C(=N2)C(C)C""",21,"""1617F2BC2F88E021"""
+"""ED0D61194C692800_15163382FD1DAB42_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2=C(F)C=CC=C2""",21,"""1617F2BC2F88E021"""
+"""EC05D6A2C7067B37_38F6AD1429D49445_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=NC(=N2)C)C""",21,"""1617F2BC2F88E021"""
+"""780C5EC56D826BC9_9972270FF3761A5A_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC=CC(=C2)C#N""",21,"""1617F2BC2F88E021"""
+"""79C94D223DB2B0D0_FB72DE7537A2A5A7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=C(C)C=C2)F""",21,"""1617F2BC2F88E021"""
+"""2EB12781A8BEC4FC_38B3D58299E4B7A5_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC(=N[NH]2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""1778515EDD4C93D4_D81EA7779BF98808_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NSC(=N2)N(C)C""",21,"""1617F2BC2F88E021"""
+"""7F3DA952DA23103B_D0B40129F5660985_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)C2=CN=CC=C2""",21,"""1617F2BC2F88E021"""
+"""CDA553BF9CB80034_CF4F769DEB2464E9_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCCC(OCC)=O""",21,"""1617F2BC2F88E021"""
+"""1504EB8C0B5A3679_CBB85EAD25ABE674_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2=NC(=NO2)C""",21,"""1617F2BC2F88E021"""
+"""C3C94FAC286512B4_7FAC31AD7FDA2EBD_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NOC(=N2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""FD25595A991442F9_0B93F3D74C45D040_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOC2CCCCO2""",21,"""1617F2BC2F88E021"""
+"""6200483138221143_C5B2E26AA8A31FED_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCSC2=CC=CC=C2""",21,"""1617F2BC2F88E021"""
+"""280C82E6CE17DC6E_6A8817648EC56C2D_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)CC2CCCO2""",21,"""1617F2BC2F88E021"""
+"""D999962EE5A3420D_58E10E9E7D4B4414_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOCC2CCCC2""",21,"""1617F2BC2F88E021"""
+"""6B511D9B451D98BA_0DA5E46E134E42B8_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(N=N[N]2CC)C""",21,"""1617F2BC2F88E021"""
+"""1E25A6726719ED3C_44BD2EFAB1D2709F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC=CC(=C2F)F""",21,"""1617F2BC2F88E021"""
+"""922D6E1A752DA163_D028538620CCC342_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC=C(C=N2)C#N""",21,"""1617F2BC2F88E021"""
+"""DC19BC4A493707C5_145077AE4B55D7C8_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCNC(NC(C)C)=O""",21,"""1617F2BC2F88E021"""
+"""5A0D5420919D7551_AED17FE9CDFDB91D_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2=CN=C[N]2C""",21,"""1617F2BC2F88E021"""
+"""7B4FE12F20FB9792_93FC3B972066856D_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC(=NO2)C(F)F""",21,"""1617F2BC2F88E021"""
+"""896193398835A3B2_E6F77682350F4442_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=NC=C[N]2C)=O""",21,"""1617F2BC2F88E021"""
+"""AC10FEDDC5372038_F88D80101908F2AF_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=C(N=C2)Cl)F""",21,"""1617F2BC2F88E021"""
+"""6193C5FA635BB092_7E9D31CB3ABBE0A2_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=NON=C2C)=O""",21,"""1617F2BC2F88E021"""
+"""3809947D2391C0E9_23B0E3E919C52480_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=C(S2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""EFE839FEDACBB123_3EE68C584AD1C13C_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC=C(C=C2)C#N""",21,"""1617F2BC2F88E021"""
+"""7594E72EB2AEB121_6A5AE16435326285_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(C=C(C)C=C2)C""",21,"""1617F2BC2F88E021"""
+"""2FDA70DBE4330E59_F83C9EE949D84D03_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=C[N](C)N=N2)=O""",21,"""1617F2BC2F88E021"""
+"""ACD6169E51F18054_ABF0F9E0FC438F82_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=CC=N[N]2C)=O""",21,"""1617F2BC2F88E021"""
+"""9F0691D812908DAD_6C0E7C15903D8336_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOCC3OCC2(CNC2)C3""",21,"""1617F2BC2F88E021"""
+"""E5D50E22290A569D_0212E281028E2275_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2CCCCCC2""",21,"""1617F2BC2F88E021"""
+"""B67C24E74AD8B281_6B35400470FFE5F2_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC3=N[N]2CCCC2=C3""",21,"""1617F2BC2F88E021"""
+"""1B2DBE8386D5962A_BD5BCE975A7FE3AE_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2CCNCC2""",21,"""1617F2BC2F88E021"""
+"""2B4F9E256EDA2012_7535D7E8554C3D95_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(C=NC=C2)C#N""",21,"""1617F2BC2F88E021"""
+"""75642BECADBF1A40_78CC631F499E1E65_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2CN(CC)C(O2)=O""",21,"""1617F2BC2F88E021"""
+"""5BDF754A6AB12526_0976AAB4EE814A7E_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2=CN=CC=C2""",21,"""1617F2BC2F88E021"""
+"""806F22D57E8EB883_46ED2E90D09CC132_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC=CC(=C2)SC""",21,"""1617F2BC2F88E021"""
+"""A23B6802CDFC655B_EC9D1ABB8012C859_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)C2=CC=CC=C2""",21,"""1617F2BC2F88E021"""
+"""6D098C80A2A59958_FD0EC1CFC82001F9_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC#C[Si](C)(C)C""",21,"""1617F2BC2F88E021"""
+"""05BEFEA4D86D1308_D087134C8FAD1EFE_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(OC)C2CCOC2""",21,"""1617F2BC2F88E021"""
+"""AAD2FC5243EBFE4A_F24109F2A0731DF5_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOCC3CCC2(CNC2)O3""",21,"""1617F2BC2F88E021"""
+"""D6D436D9C4E0CB0D_B8598D7932C82DC1_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC=N[S](C(C)(C)C)=O""",21,"""1617F2BC2F88E021"""
+"""B0F2EB01E3CAF92E_A530F501FF49E13D_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2NC(OC2C)(C)C""",21,"""1617F2BC2F88E021"""
+"""B95E7784F0E4450D_61E0B29C57C2FF75_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC(=CS2)C(O)=O""",21,"""1617F2BC2F88E021"""
+"""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"""
+"""2527DF1B5DBF67E6_745C088A1AB0AC7B_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=C(C(C)C)S2""",21,"""1617F2BC2F88E021"""
+"""D7ED7FC122BAD2A2_A557A89902032C14_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOC2CCOCC2""",21,"""1617F2BC2F88E021"""
+"""12D1E1ABDAD11B69_4290781536C18180_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC(=NS2)C(C)C""",21,"""1617F2BC2F88E021"""
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+"""E573673A6B9F5C56_DD6C38F2D7365257_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2CCCCC2""",21,"""1617F2BC2F88E021"""
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+"""BD84907C64E39EC3_53D9101FB82A8052_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC=C[N]2C(C)C""",21,"""1617F2BC2F88E021"""
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+"""51AC35B3CBE855A5_E12D1C1EB92D6339_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC(C)(C)C(F)(F)F""",21,"""1617F2BC2F88E021"""
+"""EF73B00750066ECC_F1661619256FF6D1_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(F)C(=NC=N2)Br""",21,"""1617F2BC2F88E021"""
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+"""45512099C94DF8BB_75BCBEA0481DD576_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC(NCCC)=O""",21,"""1617F2BC2F88E021"""
+"""03047835AF2070CE_5B9E9256F05D9666_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=NO2)C(F)F""",21,"""1617F2BC2F88E021"""
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+"""2E3B1FF6936D3DF1_4871EE95B7F245FE_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=NOC(=C2)C)=O""",21,"""1617F2BC2F88E021"""
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+"""54F74DC6488BFFA6_1A81860FF6B6441F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=CC(=CS2)C)=O""",21,"""1617F2BC2F88E021"""
+"""B28BBA50E86B8479_A592AA4C71D1874A_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=CON=C2C)=O""",21,"""1617F2BC2F88E021"""
+"""A57838254AD2E3E4_1A7359649DC040B6_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NOC=C2C(O)=O""",21,"""1617F2BC2F88E021"""
+"""4F699817977B90AC_6567F80669B79296_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCO[P]2(=O)CC=CC2""",21,"""1617F2BC2F88E021"""
+"""6CE34ECEF8B9169D_F64F1B413667B452_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=COC(=N2)[C@@H](C)N""",21,"""1617F2BC2F88E021"""
+"""8B5121BF7FA36ECA_08E4AD12F2DB9EAD_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2(CCC#C)N=N2""",21,"""1617F2BC2F88E021"""
+"""C0E84BFEE3C52382_4F00D7AC9F8ABE0B_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2CCCC(=O)O2""",21,"""1617F2BC2F88E021"""
+"""D8B4CD6B5B510977_E23DBD670BDE327C_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2CCCCCC2""",21,"""1617F2BC2F88E021"""
+"""CBB18419C9ADEB8F_264CB9AE32E82172_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=C(C)N=NS2)=O""",21,"""1617F2BC2F88E021"""
+"""13DB6FD6618E2258_CDF51746C061D8F6_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=C(C)N=CO2)=O""",21,"""1617F2BC2F88E021"""
+"""55B079897CAF1C57_D3020A0C4AB379A7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=C(C)OC=C2)=O""",21,"""1617F2BC2F88E021"""
+"""4B6424D12B0FA5B3_1CBEDA17FF68E5F7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NOC(=C2)C(O)=O""",21,"""1617F2BC2F88E021"""
+"""275FCBA52BE3EED0_CEE74B6DB128EC13_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=C(C)N=CS2)=O""",21,"""1617F2BC2F88E021"""
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+"""685718474269964A_DB98D75C703FA6C0_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2C[C@H]([C@@H](C)C2)C""",21,"""1617F2BC2F88E021"""
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+"""EF52D948795638D1_ECF3B982BEC81979_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2(C(O)=O)CC2""",21,"""1617F2BC2F88E021"""
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+"""7E28F13AB5878141_51DF684B224A3922_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2CC(C)(C)OC2""",21,"""1617F2BC2F88E021"""
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+"""19F609D3DEEDC9B7_93F32A00468F1ADA_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NO[C@@H]3COC[C@H]23""",21,"""1617F2BC2F88E021"""
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+"""E924F815CDF79386_34C860D682A5FBBA_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=NO2)COC""",21,"""1617F2BC2F88E021"""
+"""354C68A7D8C603F5_52F98D2CFD805653_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NOC(C(O)=O)C2""",21,"""1617F2BC2F88E021"""
+"""68EAACFFED71841A_63C307A420DE1044_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC(=NC=N2)OC""",21,"""1617F2BC2F88E021"""
+"""E4B67290B21EB101_55BE024639D7A20A_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(CCN)OC=N2""",21,"""1617F2BC2F88E021"""
+"""5A0C3346A5E0EBD1_30A0F1B0B1FF89E9_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2=CN=C(C)C=C2""",21,"""1617F2BC2F88E021"""
+"""B1E78A7251711FCF_C60F35F842D9E0B1_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(C)C=C(N=C2)F""",21,"""1617F2BC2F88E021"""
+"""474A7BAC7596C425_1EFFA804E5BE0D56_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2CNC(CO2)(C)C""",21,"""1617F2BC2F88E021"""
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+"""75F4F289FEAEB745_3ABEBF300663D7CA_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOC(C#N)C2CC2""",21,"""1617F2BC2F88E021"""
+"""77837C4186A52038_89FFE917A8B5F996_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2CC(=NO2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""616DBD4B9A8A9D16_34B9905FF58C4353_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CC=NC(=N2)OC""",21,"""1617F2BC2F88E021"""
+"""77CB75B327E3CB77_BFC184AF3B9748D7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(ON=C2OC)C""",21,"""1617F2BC2F88E021"""
+"""A4233B4FF1A42DF7_8AEA1B80E2540230_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOCC(OC)OC""",21,"""1617F2BC2F88E021"""
+"""FDC18931E95DADF6_B4E8B2FCF11D49F2_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC(=CC=C2)C#N""",21,"""1617F2BC2F88E021"""
+"""B35A86E1079FD5CE_DACEC703AFA74B06_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NNC(=O)NC2=O""",21,"""1617F2BC2F88E021"""
+"""317DE4CAF61B946E_398A5D282E80428D_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=N[NH]C3=C2CCC3""",21,"""1617F2BC2F88E021"""
+"""7C026C0AAB83CFF9_4F832F25E6D8EA1C_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2CCN(C)CC2""",21,"""1617F2BC2F88E021"""
+"""D4648A014EFE9C17_42E3876155F65DE9_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NOC(=C2C)CC""",21,"""1617F2BC2F88E021"""
+"""C1FA2ACA9F7E3FFA_B27D18811113B9FA_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOC[C@H]2CNCC(O2)(C)C""",21,"""1617F2BC2F88E021"""
+"""4B8B3BADE4A255E7_D4F05780D50361BE_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NOC(=C2)C(F)F""",21,"""1617F2BC2F88E021"""
+"""CF0AA544BA39AD6E_AED078520562E1E6_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(F)C2CCOCC2""",21,"""1617F2BC2F88E021"""
+"""2F4DE441A66EE4B0_B8685A863820169E_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOC[C@@H]2CNCC(O2)(C)C""",21,"""1617F2BC2F88E021"""
+"""26A09F4B30AE46B0_3B523C11AB5D0395_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2=C(C)OC=N2)=O""",21,"""1617F2BC2F88E021"""
+"""AE03EEB030F6210F_02C358A48D12A9FB_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=N[N](CCF)C=C2""",21,"""1617F2BC2F88E021"""
+"""071AACC0739C3A77_55B98073285E5289_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=CN=C(O2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""7DB58EB96F78881C_3A31989649B944C0_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(N(CC)C(C)C)=O""",21,"""1617F2BC2F88E021"""
+"""89EEF0C7760F5E26_6F196C2D5A4A12AE_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=C3[N]2CCC3""",21,"""1617F2BC2F88E021"""
+"""87DB952DD61387F1_69451D4A666CD35B_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCOC2CCOC2""",21,"""1617F2BC2F88E021"""
+"""9903A4212726CB6C_75DFBBFC75F94341_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2CCC(F)(F)CO2""",21,"""1617F2BC2F88E021"""
+"""09C53F5EBF2AC908_176CD548FF7F42BF_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(OC)C2CCCC2""",21,"""1617F2BC2F88E021"""
+"""59AB8FA84B332674_C0E762CBC7172DD0_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2CC[S](=O)(=O)C2""",21,"""1617F2BC2F88E021"""
+"""9FB4742D2D3775BB_A21FB53D97C58C3F_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NN=C(C(C)C)O2""",21,"""1617F2BC2F88E021"""
+"""15DC2CBCBB97D3C1_5CB43F4C68D07740_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NC=N[N]2CCF""",21,"""1617F2BC2F88E021"""
+"""95AB788CBA25F80E_240CBB4CA4F3073B_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCCC(C)(C)C#N""",21,"""1617F2BC2F88E021"""
+"""AA9AB71C57E6BFBD_C72647CEFD731187_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=C(CC)ON=C2C""",21,"""1617F2BC2F88E021"""
+"""327A074D209F22AB_F67D753F4FFCC4F6_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(=O)C2COCCO2""",21,"""1617F2BC2F88E021"""
+"""16E4755938BDFCE5_E30CDDB3AC553EE7_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2CCCC2(F)F""",21,"""1617F2BC2F88E021"""
+"""9F10E38EAC42B551_E73DC34E30521AE5_6039_DP""","""CC(C)(C)[N]1N=NC(=N1)CCOCC(C2CCNCC2)=O""",21,"""1617F2BC2F88E021"""
+"""3E43D6750F34D9FA_23121EF1FDCB0CC3_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2OC(=O)CC23CC3""",21,"""1617F2BC2F88E021"""
+"""81681756A3BA7425_83651E81C14C3BEA_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2CN=C(O2)C3CC3""",21,"""1617F2BC2F88E021"""
+"""FD94A22F69999F73_C15EE216FEFF4E0D_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCCC2=CC=NC=C2""",21,"""1617F2BC2F88E021"""
+"""C3F93A8B93701BC5_55B5D060288929AB_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2N=C(C)OC2=O""",21,"""1617F2BC2F88E021"""
+"""56B439EBE4475BE4_D07A32CE99EA2BFB_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCC2CCC(C)CC2""",21,"""1617F2BC2F88E021"""
+"""2265701498C98D46_3505FE86C1248FAE_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCC2=NO[C@@H]3CCC[C@H]23""",21,"""1617F2BC2F88E021"""
+"""1867447D07FB4739_0CEC2C7CB29627DC_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCN2C3CCC(C2)C3""",21,"""1617F2BC2F88E021"""
+"""0C26C0BE30AD2A9C_97E1BE68287245E6_6039_UN""","""CC(C)(C)[N]1N=NC(=N1)CCOCCOCCOCC#C""",21,"""1617F2BC2F88E021"""
+"""F642403CEFF94A65_EFD49D2BD89122A7_6039_UN""","""NC(=O)C2=NC1=C(C=CC(=C1)OCCCCCCCC)O2""",21,"""39DD793185E4A8C4"""
+"""24A7A865D368FE6F_5667D3050998CBBA_6039_UN""","""NC(=O)C3=NC1=C(C=CC(=C1)OCC(=O)C2=CC=C[NH]2)O3""",21,"""39DD793185E4A8C4"""
+"""AC5862CE938C0BF9_51C11EA4419B9A38_6039_UN""","""NC(=O)C2=NC1=C(C=CC(=C1)OCC(NC(OC)=O)=O)O2""",21,"""39DD793185E4A8C4"""
+"""4EF7FD6C5BFBCFF1_FFE731201712A551_6039_UN""","""NC(=O)C2=NC1=C(C=CC(=C1)OCC(NNC(C)=O)=O)O2""",21,"""39DD793185E4A8C4"""
+"""C1DCC3B3EE13737C_5104F5F3FB090298_6039_UN""","""NC(=O)C2=NC1=C(C=CC(=C1)OCCOCC(F)(F)F)O2""",21,"""39DD793185E4A8C4"""
+"""21B2D7555E162531_E070EC44DF536046_6039_UN""","""NC(=O)C2=NC1=C(C=CC(=C1)OCCCCOC(C)=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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+"""8FD65E090B7B1A8E_C52DF746879D45E5_6039_UN""","""CC(COCC(=O)NNC(=O)C1CCC1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""B9F48ED806E198D0_E3167747DC6884F3_6039_UN""","""CC(COCCCOCC1CCCCO1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""C755E4083D3657E7_FDEEE021619CB74E_6039_UN""","""CC(COCC1=C(C=C([N](=O)=O)C=C1)F)N2CCOCC2""",21,"""4BF22414E034F634"""
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+"""D7CD72A9CC0E92FE_603F7E68B9F67E95_6039_UN""","""CC(COCC1=CSC(=N1)C2CCCO2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""593CC8E9E89D5849_3DDFA69CE3525310_6039_UN""","""CC(COCC(=O)NCC1=CC=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
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+"""8161B3150E4C598B_EF0C279997A747E2_6039_UN""","""CC(COCCC(CC(OCC)=O)(C)C)N1CCOCC1""",21,"""4BF22414E034F634"""
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+"""C617690EBFD10425_A7E66CA33BA65AC5_6039_UN""","""CC(COCC(C1=CC(=NC=C1)OC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
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+"""5F3A6326D76F98BF_6E6831B13CB0ECF4_6039_UN""","""CC(COCC(C1=CC=CC(=N1)OC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""7F1343A14452593B_6AEA7D1904A1E231_6039_UN""","""CC(COCCN1C2=C(CC1)C=CC=C2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""E888E068115AB013_B9368F221CF5768A_6039_UN""","""CC(COCC1=C(N=C(C(C)C)C=C1)C)N2CCOCC2""",21,"""4BF22414E034F634"""
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+"""D90D9E710A6911E7_224017C9B9AD5481_6039_UN""","""CC(COCC1=N[N](CC(F)(F)F)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""F12CACCBDFCFBC0B_1852FED54F329DD7_6039_UN""","""CC(COCCN(C)CC1=CC=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
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+"""5566D3E19FA41776_B79E32DAF49209DE_6039_UN""","""CC(COCC1=CC=N[N]1CC(F)(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""6F05C48EDA5FAEEC_4058A946190CFF7D_6039_UN""","""CC(COCC2COC1=C(C=CC=C1)O2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""78A41C60DA155299_282D9B36A04795BF_6039_UN""","""CC(COCC(N(C)CC1=CC=CO1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""E453C810226869CD_1ED32FC601427991_6039_UN""","""CC(COCC(=O)CCC1CCCCO1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""AAA157B8EA458C4B_D073D89DA107C046_6039_UN""","""CC(COCCC(NC1=NOC(=C1)C)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""E4DAF178A1F351DC_C38E7DB554987EAC_6039_UN""","""CC(COCC(=O)NC1=C(C=CS1)C#N)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""E5DBE0DD78CC3B4E_5C970D312B8E8D0E_6039_UN""","""CC(COCC1=NOC(=C1)C2=CC=CS2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""7EE88D9A66F3697D_A98FF864941D707A_6039_UN""","""CC(COCC(OC)CC1=CC=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""86E2B8A7F710C421_DD16BA3BCA8901B3_6039_UN""","""CC(COCCOC1=C(C=CC=C1)C#N)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""2F6DC9E3A54DAE87_2536572E8E4FE957_6039_UN""","""CC(COCC(NC(NCCCC)=O)=O)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""AC71E72F39A4B187_0823418FEC8B124D_6039_UN""","""CC(COCC2=NC1=C(C=C(F)C=C1)O2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""069E676C0D8CCC80_7B12FF311441E28D_6039_UN""","""CC(COCC1=C(ON=C1)C2=CC=CS2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""6276ACD64B5CE898_4BCF9F526670A3F8_6039_UN""","""CC(COCC1=CSC(=N1)C[S](C)(=O)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""89F4CC3B83C55C92_543290CDD0074480_6039_UN""","""CC(COCCC(CC)(CC)C(=O)OC)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""80D4F3FF0233B007_C445D3FC31FE686D_6039_UN""","""CC(COCC(C1=C(OC)N=CC=C1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""2EBA9B31CAEB522F_F45DC4594765C119_6039_UN""","""CC(COCC(C1=C(C=C(C)C=C1)C)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""627CC4D3DED6A33D_2B706B0D7983727A_6039_UN""","""CC(COCC1=CC(=C(N(C)C)C=C1)C)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""3B203C4462D4B8BE_930AEA53BB15EBD4_6039_DP""","""CC(COCC(NCC1CCCNC1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""0CE4A1DB6061E542_1D0AD9DCB067F371_6039_UN""","""CC(COCC1=CC(=N[N]1C)C(OC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""759696BEA7859FD6_2000063F6D2D5B45_6039_UN""","""CC(COCCOCC(C(F)(F)F)(F)F)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""917631B538147A74_364B7EC49A6CC3BA_6039_UN""","""CC(COCCCC1=C(OC)C=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""38ECCB0BB2184198_42DD7BD61374BDEF_6039_UN""","""CC(COCC1=C(C(OC)=O)C=CC=N1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""4C56E8A6F7B38E04_DFD9ABC4C3D1020D_6039_UN""","""CC(COCC1=NC(=CC(=N1)N(C)C)C)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""04DFBF3C36410522_01AE5FA04E5BCE94_6039_UN""","""CC(COCC(N(C)CC1=CC=CS1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""B66FBE1392C2C567_3AD7241450828A5E_6039_UN""","""CC(COCC1=NC(=NO1)C(OCC)C)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""A7C7A5D6C29084BB_A4BF3122EAB5B6ED_6039_UN""","""CC(COCC1=NC(=NO1)CC(F)(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""4ACBCADD3435726D_0536A2303A6096F0_6039_UN""","""CC(COCC(=O)C1=CC(=CC=C1)C#N)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""66F5697F3EEE9144_336667B7B798B4F5_6039_UN""","""CC(COCC1=N[N](C=C1)C2CCCC2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""4021CDC30F6D1323_6F26EF7E983F0A07_6039_UN""","""CC(COCCCSCC1=CC=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""10D0F28C09F65133_9EA0B09F2A7D2613_6039_UN""","""CC(COCC1=C(OC(F)F)C=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""5D8CC1DEF45B9DBE_AB9FA044F72B0B1F_6039_UN""","""CC(COCCCCOC1CCCCC1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""0BBA13C8215DEA92_2783C0030B76F058_6039_UN""","""CC(COCC1=CC(=C(OC)C=C1)C#N)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""1B8E8C3F39AFFC56_1ABD5046E0AEE817_6039_UN""","""CC(COCC1=CC=CC(=C1)NC(C)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""D293DF4E7747472A_32D1592609F7E7E2_6039_UN""","""CC(COCC1=CC=C(OC(F)F)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""6900E6DC4AF39416_0722DA28D753FCE5_6039_UN""","""CC(COCC(C1=NC=C[N]1C(C)C)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""095C7137732D713A_B2E428C10A6B73E2_6039_UN""","""CC(COCC1=N[N](C)C(=C1)C(F)(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""950B4FFACACDB810_C63C79543A0272D7_6039_UN""","""CC(COCC1=CC(=N[N]1C)C(F)(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""D88C824F182ECD72_4B458543A7D624F5_6039_UN""","""CC(COCC(NC(CCCCC)C)=O)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""3FA4E403971A706B_7AD17829C1FE3761_6039_UN""","""CC(COCC1=C(C=CC=C1)OC2CC2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""8DB81A5046997D44_513E65580D85C979_6039_UN""","""CC(COCC(NC1=CC(=N[N]1C)C)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""012665005ED15583_3E98C03BB3D82C19_6039_UN""","""CC(COCC(=O)CCC1=CC=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""0BC36E6B34926714_CD0D2F5BB65E4C09_6039_UN""","""CC(COCC(C1=N[N](CC)N=C1C)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""DBF218BDDD845834_9959F2A4E5D84D9D_6039_UN""","""CC(COCC1=NC(=NO1)CC(NC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""DE003644A4674F73_E19D793B91977F9E_6039_UN""","""CC(COCC1CN1CC2=CC=CC=C2)N3CCOCC3""",21,"""4BF22414E034F634"""
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+"""986EF139D45AE8E3_EECF331CF7065AB4_6039_UN""","""CC(COCCCOCCOCCOC)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""C5A39C3F66CE0AD4_6B8734C29FDE7BD6_6039_UN""","""CC(COCC1=C([N](=O)=O)C=C(C=C1)F)N2CCOCC2""",21,"""4BF22414E034F634"""
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+"""9B6F80DD000E6D22_863FFF899ADE8B9D_6039_DP""","""CC(COCC1=CC=CC2=C1CCNC2)N3CCOCC3""",21,"""4BF22414E034F634"""
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+"""253C9C307F0D4F97_50E9EA0ACDF45FF1_6039_UN""","""CC(COCC(C1=CC=C(OC)C=C1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""F524838D35B94077_61DA903A624CBE96_6039_UN""","""CC(COCC(=O)N1CC2CCC(C1)O2)N3CCOCC3""",21,"""4BF22414E034F634"""
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+"""386AD95850D5041A_547FB1C6104AC417_6039_UN""","""CC(COCC(=O)NC1CCCCCC1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""5DFCEDD7690D1B5B_0FD6BEF3CA1FEF19_6039_UN""","""CC(COCCCOC1=CC=C(F)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""B780C0669C7F4FAE_FE896296FBBB0CBA_6039_UN""","""CC(COCCOC(=O)C1=CC=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""53FCBF8EB493DC05_B32863ABF7BD7BC6_6039_UN""","""CC(COCCC[S](NC(C)(C)C)(=O)=O)N1CCOCC1""",21,"""4BF22414E034F634"""
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+"""94426B4FD76B1DFD_7907A579CE2E9787_6039_UN""","""CC(COCC1=CC=CC(=C1)C(F)(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""2C5C568CEB438E2C_D96177CF68E07336_6039_UN""","""CC(COCC1=C(F)C=C(C(=C1)C#N)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""481AA9F86D09D54B_9F43FFD352E28DC5_6039_UN""","""CC(COCC1=C(CC(C)C)C=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""24AFA8277373301E_6312D63EDEB11AA0_6039_UN""","""CC(COCC(=O)NCC1CCCCC1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""28F74FFD065E45AA_330B28FBC2D276AF_6039_UN""","""CC(COCC(N(C)C1CCCCC1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""4418163BA41A5D0E_56D61E4F9B2E1F0C_6039_UN""","""CC(COCC1=NC(=NO1)COC(C)C)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""30B75998D60BE356_0A9C301EBFEC2869_6039_UN""","""CC(COCC2COC1(CCOCC1)O2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""48A783ABD44725BB_6E3BC83733568DE8_6039_UN""","""CC(COCC1CCCC(C(F)(F)F)O1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""C9A135E7153B75C6_9A2CD04BD8E32913_6039_UN""","""CC(COCC1=NSC(=N1)C(OCC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""C26402A80E02CABF_FE44EE3AD790DD60_6039_UN""","""CC(COCCCCCCCCCCC)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""0435086366880CDD_C4114D0AFDD27F81_6039_UN""","""CC(COCC1=NN=C2C(=O)NC=C[N]12)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""CA850B315FB58268_499559A57093AAF0_6039_UN""","""CC(COCC1=NC(=C(S1)C(C)(C)C)C)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""CACAF8AE0AC6DB2E_BBAC83A6824E1D01_6039_UN""","""CC(COCC1=CC2=C(C=C1)C=NC=C2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""DDDFA30538E7E039_06A7DDB68D94FC62_6039_UN""","""CC(COCC1=C(C)C=C(C=C1C)C#N)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""42B7A9D8A80E11AE_A6FA4DD10BA8D1C6_6039_UN""","""CC(COCC1=CN=CC(=C1)C(OC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""D9DD28C9577580E9_DFFB788A4824E692_6039_UN""","""CC(COCC1=CC=CC(=C1)[S](F)(=O)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""3280F35DB302C645_22A15B4D6F833CA2_6039_UN""","""CC(COCC1=C(CC(C)=O)C=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""8219DC25269CF9CA_44959F200D670F1F_6039_UN""","""CC(COCC1=CC(=NN=C1C2CC2)C)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""FB3DAC0080AFA9DA_5B0A72BDD03B7FDD_6039_UN""","""CC(COCC1=CC=CC(=N1)C(F)(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""952940A16C6089CE_6DE3CB9D352B30DA_6039_UN""","""CC(COCCCN1CCC(F)(CC1)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""AF51C30C9B6380A7_65120F8DE34FAE9C_6039_UN""","""CC(COCC1=C(C)C=CC(=C1)[N](=O)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""67DE21BFB6D2D80A_9AAC449C071655C9_6039_UN""","""CC(COCC1=C(C=CC(=C1)C(O)=O)F)N2CCOCC2""",21,"""4BF22414E034F634"""
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+"""0517C8C80D9FF86A_9C781801FF640E8E_6039_UN""","""CC(COCC1=NC=CC(=C1)C(OC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""174FBFEF06159109_5A5AD35F8143E765_6039_UN""","""CC(COCC1=CC2=C(C=C1)COCC2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""864DFFD56871BED7_C1AFBC7997C5F2B7_6039_UN""","""CC(COCCOC1CC[S](=O)(=O)CC1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""2F262C097BD151DB_9B408ED6F8E0F89C_6039_UN""","""CC(COCC1=NSC2=C1C=CC(=C2)F)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""DFFF37FA9CB40CCD_37802A1627FC6663_6039_UN""","""CC(COCCCNC(C(CC)CC)=O)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""5A246005EDDD039A_063CA8DD4F88AF60_6039_UN""","""CC(COCC1=C(F)C=C(C=C1F)C#N)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""CCC746A1868C9C7B_E74115DC97420D5D_6039_UN""","""CC(COCC1(F)OC(=O)CC12CCC2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""452DFFD0C814E9AD_CED65A9B47C4B09B_6039_UN""","""CC(COCC1=C([N](C)N=N1)C(F)(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""2E9FB49F1945E4C0_70D0A3EA9C9ECD54_6039_UN""","""CC(COCC1=C[N](C)N=C1C(F)(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""170743FB283335DB_26825F6D55FFCDF7_6039_UN""","""CC(COCC1=CC(=C(OCC)C=C1)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""66657911FEB76A9E_C0DDA10208FEFC26_6039_UN""","""CC(COCC2=NC1=C(F)C=CC=C1O2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""481A89290CE675E0_3154FD0286D7519A_6039_DP""","""CC(COCC1OCCC12CCNCC2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""932717E07582F007_D944CBC76A13183A_6039_UN""","""CC(COCC1=CC=C([S](N)(=O)=O)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""930FC1EAADFA1999_A1D98665FB5C8E91_6039_UN""","""CC(COCC(C1=CC=C([N](=O)=O)O1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""ABA3154B27C04C54_3A281749CC9200B8_6039_UN""","""CC(COCC1=C([S](C)(=O)=O)C=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""5B830536F3D27528_2304EAB8BC169583_6039_UN""","""CC(COCC1=NC(=NO1)C(OC)(C)C)N2CCOCC2""",21,"""4BF22414E034F634"""
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+"""F755063ADCAEA879_3F296048157BF136_6039_UN""","""CC(COCC1=NCCC2=C1C=CC=C2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""9FFC0F8B26E93B37_CB77C155F050DF0B_6039_UN""","""CC(COCC1=CC=C(SC(F)F)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""746B5F475189CE31_73AEF33112BD9A04_6039_UN""","""CC(COCCC(=O)NC1=NC=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""C5F685D72BB44D15_79A825CC0D09C1D9_6039_UN""","""CC(COCC1=C(C)OC(=C1)C(OC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""29F928A9541A2857_C3144FD88BED3D93_6039_UN""","""CC(COCC1=CC=C(C=C1)[S](=O)(=O)Cl)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""26CA90F9BD39AB83_3860F6F596A0969F_6039_UN""","""CC(COCC1=CC=CC(=C1[N](=O)=O)C)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""EB09BFEF87A1C36D_CC98F90F1DE00AC1_6039_UN""","""CC(COCC1=CC2=C(C=C1)C=CC=N2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""ECB65C34243FACD3_ECE65182BF190F77_6039_UN""","""CC(COCCCOC1=C(F)C=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""F64E19238E3C8E32_B2B966DB917AE724_6039_UN""","""CC(COCC1=C(C=CC(=C1)[N](=O)=O)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""93D709ECE3F21228_D7C745E1C353D2DE_6039_UN""","""CC(COCCCNC(CC(C)(C)C)=O)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""DA319F6CED0CAE99_20BC4B9902E2920A_6039_UN""","""CC(COCCC(=O)N1CCCCCC1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""4451A82B30235ECE_C66713CC6E75E382_6039_UN""","""CC(COCC2=NC1=C(CCCCC1)S2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""6C9674EC7EF98064_924DAE025CD5100E_6039_UN""","""CC(COCC1=CN=CC(=C1)C(C)(C)C)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""FF289ADEE890521D_50BC5D7A3A47E11C_6039_UN""","""CC(COCC2CCCC1(CCOC1)O2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""9F7BD6B2D7E09B26_C35B1EB478615A5A_6039_UN""","""CC(COCC(N(C)CC1=CSC=C1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""AAE84A778386A54A_3DDD938CF64D0B34_6039_UN""","""CC(COCC1CCCC(F)(F)C(N1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""C005B9E87A424971_9613919B694BA69C_6039_UN""","""CC(COCC1=NOC(=N1)N2CCCC2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""43462E284AC8CC08_2DFEC08E33D6BEDA_6039_UN""","""CC(COCC1=C(C)OC=C1C(F)(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""D9D3E758C570B09D_A0B3EE98320086A8_6039_UN""","""CC(COCC2=CC1=C(CN(C)C1)C=C2)N3CCOCC3""",21,"""4BF22414E034F634"""
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+"""216C8251F693D79E_E81B6837B049A51A_6039_UN""","""CC(COCC1=NOC2=C1CCCCC2)N3CCOCC3""",21,"""4BF22414E034F634"""
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+"""4A4BDC7903CD6D6F_D95477407BE32362_6039_UN""","""CC(COC[C@@H](C(C)(C)C)N[S](=O)(=O)C)N1CCOCC1""",21,"""4BF22414E034F634"""
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+"""7FD903EBFF41FC32_0CDAA61F8BE7E7EC_6039_UN""","""CC(COCCCC1=C(F)C=CC=C1F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""5AC371C77537C03D_C01879A402E146CC_6039_UN""","""CC(COCC1=NOC(=C1)C2CCCC2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""C85612CFAAA0A464_51CBA859881079D5_6039_UN""","""CC(COCC1=CC=CC(=N1)C(C)(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
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+"""79CFF1F0F15B7E54_67A284F257FDD2CA_6039_UN""","""CC(COCC1=CC=C(C(CC)C)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""CA9B1FFAF1D5F5AD_6B6339A485521785_6039_UN""","""CC(COCC1=CC=CC2=C1OC(=N2)C)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""2C785F5780560719_B1DDAF6D37F2FEF3_6039_UN""","""CC(COCC(NC(N=[S](C)(=O)C)=O)=O)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""52441D2A09B33FD8_8F7654719E8D1551_6039_UN""","""CC(COCC1=C(C(F)(F)F)N=CC=N1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""A6A7BD2D6FE5CDE9_D4823311A751A1EC_6039_UN""","""CC(COCC1=CC=CC(=C1)[S](C)(=N)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""BE5751BED6FCCDAA_38EBE6EE8960799C_6039_UN""","""CC(COCC1=NOC(=N1)C(OCC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""FBEE7722A8487A9A_29D5E02257602368_6039_UN""","""CC(COCC1=N[N](C)C=C1[S](=O)(=O)Cl)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""B79421695D1A9CB8_16B5ECC83ABEE336_6039_UN""","""CC(COCC1=CC(=N[NH]1)C(OCC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""B28C12C81C8D79C0_175A7681C7EF7A5D_6039_UN""","""CC(COCC2CC1(CCCC1)C(=O)O2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""924726A3D256FA1E_73BD8E4A5E755147_6039_UN""","""CC(COCC1=N[N](C)C=C1[S](=O)(=O)N)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""88C12F4F0092DEED_7690AFF82B8DFC71_6039_DP""","""CC(COCC2CCC1(CCNCC1)O2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""2128531B3E2E6FFC_17E420C86634CEA2_6039_UN""","""CC(COCC(OC1CN(C)CCC1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""DF76B523B9968062_286B74836630116F_6039_UN""","""CC(COCC1=CC(=NC(=C1)OC)OC)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""8E7DF863B9B1A293_E5589607243F2349_6039_UN""","""CC(COCCC1(C(O)=O)CCOCC1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""243AED86F49624CE_BF432068F389723B_6039_UN""","""CC(COCC1=C(C(OCC)=O)C=NO1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""356F7371D5E68FBB_8F3ECE9F979D0A0E_6039_UN""","""CC(COCC1=CC(=NC(=N1)C2CC2)C)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""83896BC825CEF9BD_7C33C70C16FB75A7_6039_UN""","""CC(COCC1=CC(=NC(=N1)OC)OC)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""A625AE8AD4E9F61E_12A7BC7CA6305B56_6039_UN""","""CC(COCC1=C(C(C)(C)F)C=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""18AC13E4B862BEBB_1E436348ECC46E95_6039_UN""","""CC(COCC1=C(C(OCC)=O)C=N[NH]1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""5C7CE34DC46C0DF7_AA2B8364AE845A5A_6039_UN""","""CC(COCCOC1(CCOCC1)C#N)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""B4C45243C7975D6F_381E4FC4C5A3B677_6039_UN""","""CC(COCC#CC1=CC=CC(=C1)OC)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""4F0AAFB31FC801B7_529B1EFFCF1F4FC0_6039_UN""","""CC(COCCCO[S](C(F)(F)F)(=O)=O)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""10F95A91E64110F8_C3A5E9373FF77B65_6039_UN""","""CC(COCC[S](=O)(=O)C1=CC=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""F434F61F26887CA5_C849F2830967B053_6039_UN""","""CC(COCC1=CN=C(OC)C=C1OC)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""DADF22847BC8F011_43D01FAEB1C1E673_6039_UN""","""CC(COCC1=CN=C(C(OC)=O)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""4B39059C462CED23_E55F5C0A613E934D_6039_UN""","""CC(COCC1=C([S](F)(=O)=O)C=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""591DAF8BA1C3C30D_3DAF80DA7C9B71C4_6039_UN""","""CC(COCC1=NC=C(C(C)(F)F)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""B80E0DD4B6724A06_98FA1A4EF3529387_6039_UN""","""CC(COCC1CN1CC2=C[N](C)N=C2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""CF801ADCD2C60535_0CB8176A7709F58C_6039_UN""","""CC(COCC1=NC(=C(C=C1)[N](=O)=O)C)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""CDD4D0542A40AD2A_720448EC237DCD31_6039_UN""","""CC(COCC1=CC=CC(=N1)OC(F)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""4D5B155C38090EDB_351183EBDB1DF00E_6039_UN""","""CC(COCC2=C[N]1C=CC=C(F)C1=N2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""87B7405073E76E4F_6001CF259D63E3EF_6039_UN""","""CC(COCC1=NN=C(O1)C2=CC=CO2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""BCA99BAB95FB60A2_08A7C162E2AD5A68_6039_UN""","""CC(COCC(=O)C1CC2=C1C=CC=C2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""403CF62A3239389A_2075141BF99E33A5_6039_UN""","""CC(COCCN1CCN(CC1)C2CC2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""2DB390AB85231E2F_06BA57CC14EB1BA7_6039_UN""","""CC(COCC(=O)N1CCCCCCC1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""837A4DEC6F82AF00_4D96C20E5CF700BD_6039_UN""","""CC(COCC(NNC(C(C)(C)C)=O)=O)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""C5DF50A48465B31B_EBE9A15C5ECF74C6_6039_UN""","""CC(COCC(C1=C(C)[N](C(=C1)C)C)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""6E6A94F8E88063EB_265CD3A28CB48DAA_6039_UN""","""CC(COCC1=C(SC(F)F)C=CC=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""73A2BA00AA3ABA8D_4E8E2C538D6B23EE_6039_UN""","""CC(COCC1=CC(=C(O1)C)C(OC)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""968F62A82A46DE86_E599D5344D6733B4_6039_UN""","""CC(COCCC1=CC=C([N](=O)=O)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""F04F577A46740DBC_87373661AD05FAFC_6039_UN""","""CC(COCCCCC(N[S](C)(=O)=O)=O)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""77EDF607DACEB52A_72EF97D18C392451_6039_UN""","""CC(COCC(=O)NC(=O)C1=CC=C[NH]1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""DD1230978B09EEA4_6F2C296BEDA08B09_6039_UN""","""CC(COCCOC1=C(C=CC(=C1)C)C)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""AE7E4C82422826A2_01F64B2848FC15CA_6039_UN""","""CC(COCC1=CC=CC(=C1)OCCC)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""78A3C6BC1C74748A_32EB69A06EF29719_6039_UN""","""CC(COCC1=C([N](=O)=O)C=CC=C1F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""5D181990700F4926_70FB9A49DD9501F2_6039_UN""","""CC(COCCCN(CC)CC(F)(F)F)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""1B2FE778EA55B258_00B5FF7C139D9D67_6039_UN""","""CC(COCC1=CN=C(C(C)(C)C)N=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""71CBB00B9BE5DDA6_08EB663974222225_6039_UN""","""CC(COCC1=NC=C(C(OC)=O)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""259D13428A09B90B_6A210771D8F5A084_6039_UN""","""CC(COCC(N(C(CC(C)C)C)C)=O)N1CCOCC1""",21,"""4BF22414E034F634"""
+"""0D93EA3EE4D4D9D8_990DEBF548C79AAF_6039_UN""","""CC(COCC(N1CC(CC)OCC1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""5C5263FA587EFD44_7765B9F44A26E46F_6039_UN""","""CC(COCCC1=CC=C(C(N)=O)C=C1)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""F8C01356085F9056_D47901DC5F27D7F9_6039_UN""","""CC(COCC(C12CC(C)(C1)OCC2)=O)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""B124AB44934EF25B_1A41D66CE97DDB84_6039_UN""","""CC(COCC1=C2C(=CC=C1)N=CC=C2)N3CCOCC3""",21,"""4BF22414E034F634"""
+"""D2FEC916A1B09442_F0CB07514D81B257_6039_UN""","""CC(COCC(C1CCC(C)(C)CC1)=O)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""E94830973DDC7815_3D88CFEBE7D74DF9_6039_UN""","""CC(COCC1=C(C=C(C(N)=O)C=C1)F)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""CB2904BF3FB24C1E_1E62D910398579EE_6039_UN""","""CC(COCC1=C(C=N[N]1C)[S](=O)(=O)Cl)N2CCOCC2""",21,"""4BF22414E034F634"""
+"""36304FCDE71350E8_8FF6E3921C1459A9_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCCCCCC)C2""",21,"""59FF07884161D3CA"""
+"""42B8FA665943D036_3645ADBCCD1DB0B4_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2=CC=C[NH]2)C3""",21,"""59FF07884161D3CA"""
+"""F488224C5D3F792E_31E3601D851EE136_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(NC(OC)=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""ED241586BB892ED5_9FC54F99D397DE5F_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(NNC(C)=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""8EB51CEB6DB36152_31268B4A3F8C7996_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCOCC(F)(F)F)C2""",21,"""59FF07884161D3CA"""
+"""28EFA245A4146468_805292FD1BD61B48_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCCOC(C)=O)C2""",21,"""59FF07884161D3CA"""
+"""1EEDA93E4E65BEFA_A35D8C487F227FC5_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(C(OCC)=O)=C)C2""",21,"""59FF07884161D3CA"""
+"""A4F0C9192EB569B5_F1025E30A7815937_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CSC(=N2)CC)C3""",21,"""59FF07884161D3CA"""
+"""A423447A06915204_5F738B468959DDCA_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC(=NO2)CC)C3""",21,"""59FF07884161D3CA"""
+"""454E40C7EFDB04A3_1F5B65A323C85C73_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(N(C(C)C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""354EC4098051E84A_E48A1A024272B55F_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(NC(NC)=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""35437D3B0EA5870D_489A2D5970F910F8_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCC(NC(C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""D2C69878044C3D3E_ED4560041A2DEC73_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCN2CCCC2=O)C3""",21,"""59FF07884161D3CA"""
+"""062905397C43010D_7EEC498E2D6ED5EC_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCOC2CCCC2)C3""",21,"""59FF07884161D3CA"""
+"""31A66846463B5CC5_F42B50037DC9662E_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCC(N(C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""1B2EFBB6BD207C40_706EAE3ED1579C1B_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NOC(=N2)CC)C3""",21,"""59FF07884161D3CA"""
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+"""CA73C83D7E21324D_BE00E681C29E51B0_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC[N]2C=CN=C2C)C3""",21,"""59FF07884161D3CA"""
+"""0F79CD6659D90474_2C07C311C995BB9D_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC(=C(O2)C)C)C3""",21,"""59FF07884161D3CA"""
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+"""DD18CA9B8D43DEE1_74718F917595C676_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC[S](CCC)(=O)=O)C2""",21,"""59FF07884161D3CA"""
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+"""DDCFCD4570F8D2B6_E55CBDDFC22DE8EC_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2OCCN(C)C2)C3""",21,"""59FF07884161D3CA"""
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+"""280D0192C05A9523_D4D9B90DE5FA90C2_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=C(C)N=CS2)C3""",21,"""59FF07884161D3CA"""
+"""D1706D6D9C68DA81_80BB045CD5060CBD_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCN2CCOCC2)C3""",21,"""59FF07884161D3CA"""
+"""DCAD65927FC2E727_8D950F628CCE3B45_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCN[S](CC)(=O)=O)C2""",21,"""59FF07884161D3CA"""
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+"""61268AAE8838188E_D574B39BA222C472_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCC(OC(C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""2BF5D5903EC56109_248740A2535B7D28_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC=C(CC)O2)C3""",21,"""59FF07884161D3CA"""
+"""BD7EB0C873541211_BB6C129AA8B6965E_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2ON=C(CC)C2)C3""",21,"""59FF07884161D3CA"""
+"""7512ABB659B6B9B9_C0340F1AA6ADBAA3_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCC2NC(OC2)(C)C)C3""",21,"""59FF07884161D3CA"""
+"""5A3F98A7EB9B96E1_7EB062DB7DB5ABB1_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCC[S](CC)(=O)=O)C2""",21,"""59FF07884161D3CA"""
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+"""618A4877930802C1_C358A1D21A63AEBD_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2CCOC2=O)C3""",21,"""59FF07884161D3CA"""
+"""673EDAEB7C579012_0143CA1CF81BBD9F_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2CCCCC2)C3""",21,"""59FF07884161D3CA"""
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+"""981F96C40C2546DE_94B2EA1FB619E471_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(C)OC(O2)=O)C3""",21,"""59FF07884161D3CA"""
+"""DC59D43B3D495981_36C30989CDD53941_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(N(C)C2CC2)=O)C3""",21,"""59FF07884161D3CA"""
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+"""011D1F6EAFB9C1C6_29C2410D543A1313_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=C[N](C)N=C2)C3""",21,"""59FF07884161D3CA"""
+"""EA674DD1EAB44975_FF37DF214EA56669_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CN=C(C)C=C2)C3""",21,"""59FF07884161D3CA"""
+"""2837371716EFF25B_0E5670ECBE282DC3_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCC[S](C)(=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""0E00C3205065A576_9AF9D59160CE793B_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=CC(=C2)N)C3""",21,"""59FF07884161D3CA"""
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+"""241A61CCB2A8DA5A_ACB01B2260DCC205_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCN2CC(C)CC2)C3""",21,"""59FF07884161D3CA"""
+"""35AE7299E5BAC0C3_3A46365A0E623222_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCN2CCSCC2)C3""",21,"""59FF07884161D3CA"""
+"""823EB14810519CDA_66F7AB66712C3F95_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCOCCN(C)C)C2""",21,"""59FF07884161D3CA"""
+"""7266B0F23B4F849C_CCB4C2840AA6808D_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(C)C=CN=C2)C3""",21,"""59FF07884161D3CA"""
+"""E820CBC248C39487_F89981CEF40B058D_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCSCC(C)C)C2""",21,"""59FF07884161D3CA"""
+"""FC6C860C01F76031_CFD1BB2E5FC3BB82_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCCC(F)(F)F)C2""",21,"""59FF07884161D3CA"""
+"""5E139445CDB2B500_308E464322B84B8C_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=CN=CC=C2)C3""",21,"""59FF07884161D3CA"""
+"""1C2F6BBA75B1CB18_AB25434688407BBE_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(OC)(OC)OC)C2""",21,"""59FF07884161D3CA"""
+"""6651204B02F17055_8504206C257C7576_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC(=O)NC2CC2)C3""",21,"""59FF07884161D3CA"""
+"""B9B7AB2BC5652BFD_E44F19CE040C18A7_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)NCC2CC2)C3""",21,"""59FF07884161D3CA"""
+"""FFD2046C08270506_9BA2024E8E56E73C_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCC(NC(N)=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""C47950E7FD56C374_6B24F312395785EF_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC=C[N]2CC)C3""",21,"""59FF07884161D3CA"""
+"""30BD542E5FBD1C31_52D438531F596798_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCC[S](NC)(=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""3C3A318D42954A22_93EAADA749B26E9F_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=N[N](C(=C2)C)C)C3""",21,"""59FF07884161D3CA"""
+"""4026E99A765C7645_E5B1397C4E828B37_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC(=C(S2)C)C)C3""",21,"""59FF07884161D3CA"""
+"""95EA57F8ACB3990A_8E87FAD6155188AE_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC=C(C)C=N2)C3""",21,"""59FF07884161D3CA"""
+"""E40FAF6309BFEFA6_736E733581B36DED_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC[S](C(C)C)(=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""5B63B5D0976083A6_1D0E1EB4708D15A5_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=CC(=N2)C)C3""",21,"""59FF07884161D3CA"""
+"""1E7C67E5B5B6FC7D_457346717946238F_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2CCCC(=O)N2)C3""",21,"""59FF07884161D3CA"""
+"""333B99B0676D2964_D530428AA34F0CA7_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(C)C=CC=N2)C3""",21,"""59FF07884161D3CA"""
+"""504C6698D5EFDBDC_EF4247609057358B_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(OCC(C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""A30940DF9EA3CC77_B8E7A8CDD88B0750_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=CSC(=N2)C)C3""",21,"""59FF07884161D3CA"""
+"""BC3B845BF2C85ADF_FF95796767C42496_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(C)[N](N=C2)C)C3""",21,"""59FF07884161D3CA"""
+"""3FB0E0FEE868121E_A097583643876233_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(NCC(F)F)=O)C2""",21,"""59FF07884161D3CA"""
+"""CE68D1D476AC60B1_102B33392A3BC3B1_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC=CC(=N2)C)C3""",21,"""59FF07884161D3CA"""
+"""73A2C9C650FE9098_C44ADD4DD1518EC9_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)N2CCCC2)C3""",21,"""59FF07884161D3CA"""
+"""93CE3EBA41697D83_4F66C9281B54E58D_6039_DP""","""C[N]1C=C(C=N1)N2CCC(COCC(NCC(O)=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""F6B2999705D646DC_1C9984BB3B270C1D_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(OCCCC)=O)C2""",21,"""59FF07884161D3CA"""
+"""54D57DB6A4F7D0CB_8A262E1E96FE44CF_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCOC(N(C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""E533DE6033B125FF_39C9C9BBAF284C19_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2CCOC2)C3""",21,"""59FF07884161D3CA"""
+"""DDB53337E3D63799_7C2EF022F12D8DAA_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=CN=C[N]2C)C3""",21,"""59FF07884161D3CA"""
+"""E56FCB6C96F78867_3C0AE064427AB29C_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC=C(F)C=C2)C3""",21,"""59FF07884161D3CA"""
+"""220B36EBC7229822_5B735900FFD8BF1E_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CN=CC(=C2)F)C3""",21,"""59FF07884161D3CA"""
+"""7723D934FD1CF953_D2BC84FFE5EA30FA_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCCC2CCCNC2)C3""",21,"""59FF07884161D3CA"""
+"""A97B5277D75CA6EE_2CFE5A4AD0088E7F_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CN=CC(=C2)C)C3""",21,"""59FF07884161D3CA"""
+"""92345233A6322567_506990A8FA52BA7C_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCC(N(OC)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""975C39CA06793DAE_90C1AD51AC6C3733_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=CC=N[N]2C)C3""",21,"""59FF07884161D3CA"""
+"""F7B73FFC2276888A_16F61C960C66AD43_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2=NC=CS2)C3""",21,"""59FF07884161D3CA"""
+"""A31A8D1F02C69A56_7B451FDF4118FF69_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2=CSC=N2)C3""",21,"""59FF07884161D3CA"""
+"""8BA7CDA848E9319D_1F7BC715FBC6B612_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(F)C=CC=C2)C3""",21,"""59FF07884161D3CA"""
+"""B2C945D617A514D5_C56C2893930B60F7_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC=N[N]2CC)C3""",21,"""59FF07884161D3CA"""
+"""C70A5FECC7EA48A4_BF9642567C49F106_6039_DP""","""C[N]1C=C(C=N1)N2CCC(COCCCCCCCN)C2""",21,"""59FF07884161D3CA"""
+"""C6C41ED977B9E530_53CDAEA25DA6AF58_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2CCCC2)C3""",21,"""59FF07884161D3CA"""
+"""780B089E46377AA8_037BFA17C22EFFF2_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCSCCOC)C2""",21,"""59FF07884161D3CA"""
+"""6A1B3BC7D90A8406_F9FBC67E2A28A7FD_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2C[S](=O)(=O)C2)C3""",21,"""59FF07884161D3CA"""
+"""29C04061C21E6DFD_4C3E8CEFFDB1F65F_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NNC(C=C2)=O)C3""",21,"""59FF07884161D3CA"""
+"""3D37E367320AF594_78A500BA947E9CEF_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=NC(=N2)C)C3""",21,"""59FF07884161D3CA"""
+"""12ADCE00F5C517F9_24D4923A80139730_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CN=C(C)N=C2)C3""",21,"""59FF07884161D3CA"""
+"""452BC607C0F3EF70_40E6DDE15425AE34_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=CC=NC=C2)C3""",21,"""59FF07884161D3CA"""
+"""0470422F659EE2A3_67C84D5A3447132A_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=NC=C[N]2C)C3""",21,"""59FF07884161D3CA"""
+"""06EC2F809CFFD3E3_07066AAFF18D9375_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(C(OC)(C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""4DB1E76CBF4C458A_44AA055D0DDC581F_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(C)O[Si](C)(C)C)C2""",21,"""59FF07884161D3CA"""
+"""C88D45B4C82C9342_077ACE705B75FE23_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(CC(C)(C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""916C07ED0256CEF6_BA9FCF0366E6645C_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(C(CC)(C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""0C84D27C2C6105C9_E4FDCC13A99EC58E_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(C)N=CC=C2)C3""",21,"""59FF07884161D3CA"""
+"""853C6977C94EFC50_FA58F1AB1BB11675_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCN2CCNC2=O)C3""",21,"""59FF07884161D3CA"""
+"""1F33305BA9638370_FE586753932BCD2E_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(OCC)OCC)C2""",21,"""59FF07884161D3CA"""
+"""A34BE8AA5267D80D_305B51E07201B824_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2(OC)CCC2)C3""",21,"""59FF07884161D3CA"""
+"""1EC6B33DA15076A5_A655A5B09D437FF6_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2CCNC2=O)C3""",21,"""59FF07884161D3CA"""
+"""45C6F636B5AB68F2_E39599EE2F644254_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC(=NC=N2)C)C3""",21,"""59FF07884161D3CA"""
+"""66583F5AF74B4882_669815E9C7A77D06_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(SN=C2C)C)C3""",21,"""59FF07884161D3CA"""
+"""85F071F3E40C6274_BC8031D49449BFB0_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC=C(F)C=N2)C3""",21,"""59FF07884161D3CA"""
+"""B4909F78B65E2E5C_9F19DA25D87F9E9D_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=N[N](CC)C=C2)C3""",21,"""59FF07884161D3CA"""
+"""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"""
+"""5B0E25FED6B141EC_8A968E3EE3CA8430_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCC(OCC)=N)C2""",21,"""59FF07884161D3CA"""
+"""FD966C7819264A17_5005BBC6CC7A0D59_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=C(C#N)S2)C3""",21,"""59FF07884161D3CA"""
+"""A3425BF27D15BE71_7702397492548C77_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CON=C2CC)C3""",21,"""59FF07884161D3CA"""
+"""7193F60D6B928E0E_BEBDA8E2BAC0E957_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCC(C(OC)=O)C)C2""",21,"""59FF07884161D3CA"""
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+"""BFDFAAA4333DE9D7_A617AB2D778C3A49_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2CN(C)C(O2)=O)C3""",21,"""59FF07884161D3CA"""
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+"""00C283F27EC6BF41_C820F4917AD80468_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2OC2CCCC)C3""",21,"""59FF07884161D3CA"""
+"""709B39AA57F1C636_E16D19C1B0C210AD_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(N=C(C)O2)C)C3""",21,"""59FF07884161D3CA"""
+"""B45FB553BA9D0FDE_7D8EDECB6D9F61B1_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCCN2CCNCC2)C3""",21,"""59FF07884161D3CA"""
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+"""357DFBE1FA0BF9CC_597D44CA39ED943B_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCC(C)(C)C#N)C2""",21,"""59FF07884161D3CA"""
+"""00B1A1CF025B6DB7_67480959974B3EF8_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(N=C(C)S2)C)C3""",21,"""59FF07884161D3CA"""
+"""BA74D824564D8614_D03293CA4676248C_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCC[S](=O)(=O)Cl)C2""",21,"""59FF07884161D3CA"""
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+"""43AB3B35D8AC9986_FF166C3688C31AC1_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C[N](N=C2C)C)C3""",21,"""59FF07884161D3CA"""
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+"""7AB5A007406AEE13_28DE82A8BA4D07CB_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=N[N](CC)N=C2)C3""",21,"""59FF07884161D3CA"""
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+"""639E6BF63D6A2AA5_91E6AD502F9A1D03_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(OC)CC(C)C)C2""",21,"""59FF07884161D3CA"""
+"""281B578C4B491C36_59A3E6830349AFD4_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCOCC2CCC2)C3""",21,"""59FF07884161D3CA"""
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+"""746C1B6CE1515B2C_CAF4EB483FBDA5A6_6039_UN""","""C[N]1C=C(C=N1)N4CCC(COCC2CN2CC3CC3)C4""",21,"""59FF07884161D3CA"""
+"""641143C120BFAB40_A3912D59FE350D3C_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C[N](CC)N=N2)C3""",21,"""59FF07884161D3CA"""
+"""73EB619839BCB07D_D6A8C8F1569CB2A0_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(N=[S](C)(=O)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""A3CDF6D79340DCFD_3216A0B6237D3AEB_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCN2CCOC2=O)C3""",21,"""59FF07884161D3CA"""
+"""C2CF1FAF348AE352_DA0AA76E0682DE2A_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCCC2CCOC2)C3""",21,"""59FF07884161D3CA"""
+"""1004224B332A921B_798715343E4DCF5E_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2CN2CC(C)C)C3""",21,"""59FF07884161D3CA"""
+"""7718D10D2F6AF0B7_F74DF5C163666265_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC(C)(C)C2CC2)C3""",21,"""59FF07884161D3CA"""
+"""8E23E73950F7F84C_A19EDA50F7C93E89_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCCC2=NN=N[NH]2)C3""",21,"""59FF07884161D3CA"""
+"""4DFAB953CAF38CEF_538C97EF50E99C2B_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=NOC(=N2)C)C3""",21,"""59FF07884161D3CA"""
+"""88E12319BCF599A9_AC003BB54E7C0300_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCOC2CC2(F)F)C3""",21,"""59FF07884161D3CA"""
+"""245B94508F709D38_5A6951135773D793_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2CCC[S]2(=O)=O)C3""",21,"""59FF07884161D3CA"""
+"""899EAE3A7D111AF4_5705BA6A36B5DC72_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C[N](CC)N=C2)C3""",21,"""59FF07884161D3CA"""
+"""39E4CBF7F986AFB6_2E886DCF9B621E11_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(OC)C2CCC2)C3""",21,"""59FF07884161D3CA"""
+"""DE00FE754367F696_905683B5F1FCA602_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=NC=CC=C2)C3""",21,"""59FF07884161D3CA"""
+"""8FDE87DD6FDDFA35_3E5778263D4B06E7_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2=CC=NS2)C3""",21,"""59FF07884161D3CA"""
+"""6C72E6FF6DB2D31E_DD89592522FCB30A_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=C[N](C)N=N2)C3""",21,"""59FF07884161D3CA"""
+"""8FBB42F04F0A6D71_EFAEEDCBEF401A7E_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2=COC=C2)C3""",21,"""59FF07884161D3CA"""
+"""EB5435D207F66C12_F7F03B6D2E39E581_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(OCC)C2CC2)C3""",21,"""59FF07884161D3CA"""
+"""0E62C66177E950AA_8300DE05DB93B6EC_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCC(CCC)C)C2""",21,"""59FF07884161D3CA"""
+"""14B8A2939EBAA372_B4482844654815D8_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(C)C=NC=C2)C3""",21,"""59FF07884161D3CA"""
+"""4E29F85229BEE4EA_F8FD531CB9EE37E8_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC(=NC=C2)F)C3""",21,"""59FF07884161D3CA"""
+"""DCC6228E3D7E3103_62D68EF073B7224C_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=CC(=C2)F)C3""",21,"""59FF07884161D3CA"""
+"""BEA58A7A2731E54A_F75164D3CB614EE2_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NN=C(CC)S2)C3""",21,"""59FF07884161D3CA"""
+"""798F471FD25836DE_AFA709329FDC5084_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC(=C([NH]2)C)C)C3""",21,"""59FF07884161D3CA"""
+"""99CD979EAF01A7BE_F6F007D75600C021_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(C)N=CC=N2)C3""",21,"""59FF07884161D3CA"""
+"""419AB9024212E21D_84AEE5B795C2830B_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC(=NC=C2)C)C3""",21,"""59FF07884161D3CA"""
+"""2C0EA04C83DD1FF1_266EB56FBC26027A_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCSC(C)(C)C)C2""",21,"""59FF07884161D3CA"""
+"""1C1885210DE2C4EB_86B11A5B338EF7DA_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2OCC(C)(C)C2)C3""",21,"""59FF07884161D3CA"""
+"""B7DB3AA4E5277AF0_42194F6B8EE26875_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=NN=N[N]2C)C3""",21,"""59FF07884161D3CA"""
+"""F846D257DA7EC0B6_D5DB20DF313B3192_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCOC(C(C)=C)=O)C2""",21,"""59FF07884161D3CA"""
+"""C9A25C9BD59F1A8D_AD638E9FDC6A3C2D_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCCC(OC)=O)C2""",21,"""59FF07884161D3CA"""
+"""C56A9D0EFDA7097F_C182834AE7626903_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(N=C(C)[NH]2)C)C3""",21,"""59FF07884161D3CA"""
+"""79ECD6BF130BF0D6_27CB558A7D0A673A_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CSN=C2OC)C3""",21,"""59FF07884161D3CA"""
+"""C5DC650F55C1FA68_16C37594A8AA9406_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=C(C#N)O2)C3""",21,"""59FF07884161D3CA"""
+"""AD19BBDBD6968347_6022126851EF3060_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(CC(OC)=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""4356EA6618F39F97_611EE201DCDDF876_6039_UN""","""C[N]1C=C(C=N1)N4CCC(COCC[C@@H]2C[C@H]2C3CC3)C4""",21,"""59FF07884161D3CA"""
+"""F693DA08A4C82338_E73BB7C9E3FA35AC_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCC(OCC)=O)C2""",21,"""59FF07884161D3CA"""
+"""F644E89C50B60D05_4A803AF21230E336_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCCC2=NC=C[NH]2)C3""",21,"""59FF07884161D3CA"""
+"""FE760B5F5B15BFA2_D14468E723A5F283_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(N(CC)CC)=O)C2""",21,"""59FF07884161D3CA"""
+"""0EB8C32281E622D5_03D5773E42C9E3EB_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(C)C=CC=C2)C3""",21,"""59FF07884161D3CA"""
+"""87C0C25F7B7CC426_3D875EDE2B0A3712_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(NC(CC)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""A55AC1EBD75DA928_6A0CB1B0609F4EDB_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(C(OCC)=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""1A53738B93B695E7_7284A18260125CA4_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCOC(F)(F)F)C2""",21,"""59FF07884161D3CA"""
+"""A4A12BA154F5B614_C513747E1EF5E966_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=CC(=C2)O)C3""",21,"""59FF07884161D3CA"""
+"""374F9862ADA496A9_F3B8D1A7F4C78106_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=C(F)C=C2)C3""",21,"""59FF07884161D3CA"""
+"""2B996B7BD8001CC7_72BAB13F20E2CC3A_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(F)C=CN=C2)C3""",21,"""59FF07884161D3CA"""
+"""D1CC0D495BFB1596_63D01DD729F18FAA_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=C(C)C=C2)C3""",21,"""59FF07884161D3CA"""
+"""E242C0611D3BF5B1_6EBC9F875B755F38_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=CC(=C2)C)C3""",21,"""59FF07884161D3CA"""
+"""27A5064A086AF240_EA0B246A4B340765_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NN=C(C)[N]2C)C3""",21,"""59FF07884161D3CA"""
+"""CB4E0A4E0E46416D_4A1AE9EE375B720C_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(NCC(C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""3E0F20E6E4CFCE34_8130A2F52571FFA0_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(NCCCC)=O)C2""",21,"""59FF07884161D3CA"""
+"""8578F2C288CEBFA7_335C7B88249FB5ED_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCCC2CCCC2)C3""",21,"""59FF07884161D3CA"""
+"""92B1C5D519164AB3_938DF3FD7268CC58_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCOCCOC)C2""",21,"""59FF07884161D3CA"""
+"""A70FA25A57DB9B13_2987CB4CFDA632F2_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCCC(C)(C)C)C2""",21,"""59FF07884161D3CA"""
+"""E0A7698CD0F68FD2_57932FA32D3645BE_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=NN=C[N]2C)C3""",21,"""59FF07884161D3CA"""
+"""28A43CFC11976584_CB143FC1D9E10646_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCC(C(C)C)=O)C2""",21,"""59FF07884161D3CA"""
+"""CABDCE43E1A1E1C2_ADD047019F73BED2_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC[S](C(F)(F)F)=O)C2""",21,"""59FF07884161D3CA"""
+"""2D83902EB5BC9631_739A3CFADD1A682B_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCOCCOCC)C2""",21,"""59FF07884161D3CA"""
+"""CF9F724F94E42E69_D24608457DD7E430_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CN=C(CC)O2)C3""",21,"""59FF07884161D3CA"""
+"""ECCAEE6B4371D80E_9DD8058C65F6F7EA_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCOC2CCOC2)C3""",21,"""59FF07884161D3CA"""
+"""FA0B650612876265_F51E796F357831AD_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2=NN=C(C)O2)C3""",21,"""59FF07884161D3CA"""
+"""F7FC9B2730F3F5C3_38898FA3576D28DF_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=CC(=N2)O)C3""",21,"""59FF07884161D3CA"""
+"""BEDA02C531BBD9AA_D06800C4EF2CD393_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCCCCC#C)C2""",21,"""59FF07884161D3CA"""
+"""3EB541558E14D61B_6F02BDB4346154D7_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=N[N](C=C2C)C)C3""",21,"""59FF07884161D3CA"""
+"""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"""
+"""D11C93C6728E3F75_50CF7D81A44798BA_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2OCC(F)(F)C2)C3""",21,"""59FF07884161D3CA"""
+"""8AB70BDDD9901428_5CEDD47BAB492959_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2=CSC=C2)C3""",21,"""59FF07884161D3CA"""
+"""7F95F3CD1D063C34_90E31C1E285501C3_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2=CSN=C2)C3""",21,"""59FF07884161D3CA"""
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+"""38DAD4EA52C3C4B4_78830C7B7BB5F4D2_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(=O)NCCC#N)C2""",21,"""59FF07884161D3CA"""
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+"""628C200151C6E7F4_B039BF616EA0308D_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(SC=C2)C#N)C3""",21,"""59FF07884161D3CA"""
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+"""B206FC97986FA16B_76A5638A4F2443A1_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2=CSN=N2)C3""",21,"""59FF07884161D3CA"""
+"""B1E731CDAE8802A8_42F66C501199B529_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC(=O)C2=NOC=C2)C3""",21,"""59FF07884161D3CA"""
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+"""2F9098D1BCEC5E16_D060C64A31EB6486_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(C)C=N[N]2C)C3""",21,"""59FF07884161D3CA"""
+"""DBD9C9A964FCE3AD_8AD629955B36DBA0_6039_DP""","""C[N]1C=C(C=N1)N2CCC(COCCOCCC(O)=O)C2""",21,"""59FF07884161D3CA"""
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+"""1387EBA00350CD22_8A58DC62528A97D7_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC[N]2N=CC=C2C)C3""",21,"""59FF07884161D3CA"""
+"""C987DBB32B3D2721_8C53D8B7486A2B3B_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCC2=NOC(=N2)CN)C3""",21,"""59FF07884161D3CA"""
+"""75E32D5258AB854D_4636B1033F1ECC26_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC=CC(=C2)C)C3""",21,"""59FF07884161D3CA"""
+"""C52027235BFFAAA8_E38E7ADB6CEE6456_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCCC2OCCNC2)C3""",21,"""59FF07884161D3CA"""
+"""6F46BCFB5569ABAB_C19EAD43789013A3_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(F)N=CC=C2)C3""",21,"""59FF07884161D3CA"""
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+"""B363989FD38EC595_C533AC9755B03191_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC=C2CCOCC2)C3""",21,"""59FF07884161D3CA"""
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+"""AE344D1D6BD87C84_613502271ECA8F20_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2COCCO2)C3""",21,"""59FF07884161D3CA"""
+"""F54F06A1D98FE4B5_151EA0046E12D87F_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCC2=NOC(=C2)CN)C3""",21,"""59FF07884161D3CA"""
+"""CFFCDB0AB1632026_54A169FFA55EF9A1_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC(C)(C)CO2)C3""",21,"""59FF07884161D3CA"""
+"""AA6CA95977B819F7_0BAC9985133F11F0_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC#CC2=CN=CS2)C3""",21,"""59FF07884161D3CA"""
+"""E3DA68EEF2032C2D_780FF5418E0C6D4A_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC(=CS2)CC)C3""",21,"""59FF07884161D3CA"""
+"""FFCB75F40D2C669A_4B54E5A608F8BC08_6039_DP""","""C[N]1C=C(C=N1)N2CCC(COCCC(C(OC)=O)N)C2""",21,"""59FF07884161D3CA"""
+"""CB7E7A414AA80CB6_D594DAC87B0AA063_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCCC2=NN=CO2)C3""",21,"""59FF07884161D3CA"""
+"""91C40A68A7BD7B46_4C80E715F4D1F4FE_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCCOCC2CC2)C3""",21,"""59FF07884161D3CA"""
+"""AEC83B99728711CA_07B7F97201AC49EC_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2N(C)CCCC2)C3""",21,"""59FF07884161D3CA"""
+"""44A11AEFE80011B9_6B1A0C32222D0B26_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCN(CCC)CC)C2""",21,"""59FF07884161D3CA"""
+"""24CFEC12C7DB5907_A03DEE920C46F589_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCC[S](N)(=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""67D1890C3B31116D_B08098F9C6D6BD2B_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(CCC(O)=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""C8C7593C9D6BACA9_79553BFA81C8E66B_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCOC(OCC)=O)C2""",21,"""59FF07884161D3CA"""
+"""699CC99450502C2F_925A7FA3A0BD582C_6039_DP""","""C[N]1C=C(C=N1)N2CCC(COCCCCCCCO)C2""",21,"""59FF07884161D3CA"""
+"""D0B99BF10E5161A6_7FD7F728CEE142CE_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC(=C[N]2C)C)C3""",21,"""59FF07884161D3CA"""
+"""C371688F8D03BC54_C639E2B54BB917C7_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC(=NS2)CC)C3""",21,"""59FF07884161D3CA"""
+"""F6932826AAFAFFF0_B5483B1D591A0020_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(CC(O)=O)(F)F)C2""",21,"""59FF07884161D3CA"""
+"""0BD276F8CC4BE472_728FB1BECF93E648_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2OCCC2C)C3""",21,"""59FF07884161D3CA"""
+"""6B131EEF6A01C088_07E86639F5424353_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NCC(C)(C)O2)C3""",21,"""59FF07884161D3CA"""
+"""224CE5C1979A6ECD_4371E459656C2EF6_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=C(C)OC(=N2)C)C3""",21,"""59FF07884161D3CA"""
+"""06DFE6A8174284D1_BBC2EC9637E5D72A_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCSCCCCC)C2""",21,"""59FF07884161D3CA"""
+"""5313E1C57A4D5A12_9B32C9DAC97DA364_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2CCC(C)O2)C3""",21,"""59FF07884161D3CA"""
+"""D49C824D1B2E72F4_1BDFDC1AC5F19A50_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCN2C(C)CCC2)C3""",21,"""59FF07884161D3CA"""
+"""16839D78C745C90D_1A072FDBF6CFE571_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NOC(C)(C)C2)C3""",21,"""59FF07884161D3CA"""
+"""32D299F9E244CB25_8DA2D1008BC42A6B_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(C(C)(F)F)(F)F)C2""",21,"""59FF07884161D3CA"""
+"""D4C7B78BC97E27F9_38A4F9F7FB24EB84_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2CCC(C)CO2)C3""",21,"""59FF07884161D3CA"""
+"""B50D853D067AB9F3_B9B86DF6E79FF598_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCOC(C)(C)C#N)C2""",21,"""59FF07884161D3CA"""
+"""1A1767D5ECDBABE5_A5DF42018459832C_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CN=C(CC)S2)C3""",21,"""59FF07884161D3CA"""
+"""84DCFEF1C8953C78_87C09FA380283DE8_6039_UN""","""C[N]1C=C(C=N1)N4CCC(COCC3=NC2(CC2)CO3)C4""",21,"""59FF07884161D3CA"""
+"""68A8B680C6E8C1A4_A6B7B93ED1E66191_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCCC(OC)=N)C2""",21,"""59FF07884161D3CA"""
+"""335EDB146B72044F_29EAE1209F83B1C2_6039_UN""","""C[N]1C=C(C=N1)N4CCC(COCC[C@]23C[C@H]2CCC3)C4""",21,"""59FF07884161D3CA"""
+"""6AE858C267E506BE_F9937C0BFC2284A2_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCC(C2(N)CCC2)=O)C3""",21,"""59FF07884161D3CA"""
+"""8FC3EF4E7AFD1F80_E84126BB13CE7DA6_6039_UN""","""C[N]1C=C(C=N1)N4CCC(COCC2CN2C3CCC3)C4""",21,"""59FF07884161D3CA"""
+"""110734BF3EDE40F8_A9C145041BA64EFB_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(N(CC)CC)C)C2""",21,"""59FF07884161D3CA"""
+"""5FD84BBF201C602C_61C28590C8E20735_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCC([C@@H]2CCCN2)=O)C3""",21,"""59FF07884161D3CA"""
+"""493AB51114569862_82B7449AE08EF394_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NOC(=C2)CC)C3""",21,"""59FF07884161D3CA"""
+"""C399F6FE5B628AD1_0005130014B99AA5_6039_DP""","""C[N]1C=C(C=N1)N3CCC(COCC([C@H]2CCCN2)=O)C3""",21,"""59FF07884161D3CA"""
+"""16C2419ED36DAB86_E5876A9061D84CB5_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCCCCC2CC2)C3""",21,"""59FF07884161D3CA"""
+"""D285AE5DDB6EEC5C_4E362490400B9B9E_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCC2CCCCO2)C3""",21,"""59FF07884161D3CA"""
+"""0566CC304A560587_77EA88ACD1D2C326_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCCC2=CON=C2)C3""",21,"""59FF07884161D3CA"""
+"""83178E6F5F6B1CD2_95963CCDEDA78C38_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CC=C[N](=C2)=O)C3""",21,"""59FF07884161D3CA"""
+"""ABAC1F82B74CCD7A_4EAB555FAE6B5735_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NC=C(C)C=C2)C3""",21,"""59FF07884161D3CA"""
+"""F2C1B984BB18BA2E_C52C6AF51B547414_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCCCN[S](C)(=O)=O)C2""",21,"""59FF07884161D3CA"""
+"""E11A51C9CF1C0619_69C4B1D4C55743E1_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC(C(C)=NO)=NO)C2""",21,"""59FF07884161D3CA"""
+"""0DF337866612C4D5_AFFF2F2E86D79125_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=NN(C)C(N2)=O)C3""",21,"""59FF07884161D3CA"""
+"""9631F8A71AF7D67E_444E5E1916A48DFF_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCCC2=CSC=C2)C3""",21,"""59FF07884161D3CA"""
+"""C1F87E2EA368AA3E_07CB5DD69127A1A7_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCC2=CN=C(F)C=C2)C3""",21,"""59FF07884161D3CA"""
+"""9DE58C571CCEE233_82D5BFA03D56C403_6039_UN""","""C[N]1C=C(C=N1)N3CCC(COCCOCCC2CC2)C3""",21,"""59FF07884161D3CA"""
+"""6F7DE1ABE42216E6_95BE83F8C44D9CB1_6039_UN""","""C[N]1C=C(C=N1)N2CCC(COCC#CCOCOC)C2""",21,"""59FF07884161D3CA"""
+"""BF7FF3DB614A5D71_011F2CD476FFEDA4_6039_UN""","""CC(OCC(NCC(OC)=O)=O)C2=NC1=C(C=CC=C1)[NH]2""",21,"""927015E9494BE6EB"""
+"""944377829ECA7A8B_54A1AC9FB5F372D2_6039_UN""","""CC(OCC(=O)N1CCNC1=O)C3=NC2=C(C=CC=C2)[NH]3""",21,"""927015E9494BE6EB"""
+"""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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+"""CBB363B266BA2513_A35D274E6FBA6E15_6039_DP""","""O(C(C1CCCCC1)C2=NN=C[NH]2)CCCCCCCO""",21,"""68F85F658E66E5F3"""
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+"""20136DE089971000_99F8A3823840590A_6039_UN""","""CN(C)C1CC(C1)OCC2=CC(=NO2)C3=CC=C(F)C=C3""",21,"""E22A3BF850C98CF7"""
+"""9566B8F466E2E386_B8398238E037BA37_6039_UN""","""CN(C)C1CC(C1)OCC(N2CCCC(NC(C)=O)C2)=O""",21,"""E22A3BF850C98CF7"""
+"""14CA893AD44ECCB3_1C06B009BC502A6A_6039_UN""","""CN(C)C1CC(C1)OCC(N=C2C=CNN2CC(C)C)=O""",21,"""E22A3BF850C98CF7"""
+"""F66D151F0D4E4E89_730776606311D7BC_6039_UN""","""CN(C)C1CC(C1)OCC(N(CC(C)C)CC(F)(F)F)=O""",21,"""E22A3BF850C98CF7"""
+"""7C9DC344C94D92BC_C5484D2A1787ED6A_6039_UN""","""CN(C)C1CC(C1)OCC2=CC=CC(=C2)OCC(F)(F)F""",21,"""E22A3BF850C98CF7"""
+"""BFEF8EEFB8D6C94D_8B1F13E6FBBA0752_6039_UN""","""CN(C)C1CC(C1)OCC(N2CCCC(C(F)(F)F)C2)=O""",21,"""E22A3BF850C98CF7"""
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+"""501883DC0287B30C_A2D71B617B2AF454_6039_UN""","""CN(C)C1CC(C1)OCCC[Si](OCC)(OCC)OCC""",21,"""E22A3BF850C98CF7"""
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+"""AD20C04B6DCFCC18_120305D678456975_6039_UN""","""CN(C)C1CC(C1)OCC2=NOC(=N2)C3=CC=C(F)C=C3""",21,"""E22A3BF850C98CF7"""
+"""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"""
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+"""562E6652CCE5EE0E_77B104B8084025B7_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C=C(C(OC)=O)C=C2)OC""",21,"""E22A3BF850C98CF7"""
+"""B101DD447F5C3DF1_3A97A295182BF684_6039_UN""","""CN(C)C1CC(C1)OCCOC2=CC=CC(=C2)C(C)(C)C""",21,"""E22A3BF850C98CF7"""
+"""0FCF17209F347E14_DAD8CEC1FC1D59CD_6039_UN""","""CN(C)C1CC(C1)OCC(=O)C[S](=O)(=O)C2=CC=CC=C2""",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"""
+"""A74EE85E75B4BD23_93E56C83084489AA_6039_UN""","""CN(C)C1CC(C1)OCCCN2CCC(C(OC)=O)CC2""",21,"""E22A3BF850C98CF7"""
+"""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"""
+"""2CD45403A11747ED_B27C9AC3ED6A8D03_6039_UN""","""CN(C)C1CC(C1)OCC2=C(C(O)=O)C=C(C=C2)[N](=O)=O""",21,"""E22A3BF850C98CF7"""
+"""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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+"""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"""
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+"""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"""
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+"""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"""
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+"""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"""
+"""26EEE38D9CD6FAF8_5DA32E2DDD4D1D74_6039_UN""","""CN(C)C1CC(C1)OCC2=CC(=NO2)C3=CC=C(C)C=C3""",21,"""E22A3BF850C98CF7"""
+"""D54235E08A026920_7FF063036C69BCEA_6039_UN""","""CN(C)C1CC(C1)OCC2=CSC(=N2)CC3=CC=CC=C3""",21,"""E22A3BF850C98CF7"""
+"""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"""
+"""CCE93BD34297969E_8625AFF457CD2932_6039_UN""","""CN(C)C1CC(C1)OCCC(NC2=CC(=C(F)C=C2)F)=O""",21,"""E22A3BF850C98CF7"""
+"""1E6F74141F8583B1_E734582D304B55F5_6039_UN""","""CN(C)C1CC(C1)OCC(NC2=NN=C(CCCC)S2)=O""",21,"""E22A3BF850C98CF7"""
+"""B331394E078CC01F_BBE8A6F52B317677_6039_UN""","""CN(C)C1CC(C1)OCC(=O)NCC#CC2=CC=CC=C2""",21,"""E22A3BF850C98CF7"""
+"""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"""
+"""B1B90F7585B17E6A_8825FE9F1948E68A_6039_UN""","""CN(C)C1CC(C1)OCC(C2=CN=C(C(F)(F)F)C=C2)=O""",21,"""E22A3BF850C98CF7"""
+"""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"""
+"""70C2B2C71415D978_7EFF1E95324D9E34_6039_UN""","""CN(C)C1CC(C1)OCC(N(C(C)C2=CC=CC=C2)C)=O""",21,"""E22A3BF850C98CF7"""
+"""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"""
+"""609B028FA83DC3A5_FE8BFB3ED8786FFB_6039_UN""","""CN(C)C1CC(C1)OCC(C2=CN=C(OC(F)F)C=C2)=O""",21,"""E22A3BF850C98CF7"""
+"""CA977B448196D7D8_5F5D4B941CDAF629_6039_UN""","""CN(C)C1CC(C1)OCC(=O)C2CCOC3=C2C=CC=C3""",21,"""E22A3BF850C98CF7"""
+"""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"""
+"""B6CDED1319EB9B85_89087A2C54188B1C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(=O)C3=CC=C[NH]3""",21,"""E6B2D018D864E862"""
+"""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"""
+"""77874A436BA242D2_7ECF54DA7E6752AB_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(N=C(C)[NH]3)C""",21,"""E6B2D018D864E862"""
+"""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"""
+"""EE40E9CE07CFE675_E6F2C3DD0EC41A8E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC#CC3=CC=NS3""",21,"""E6B2D018D864E862"""
+"""2F5E21E1642A09A9_E4ACA2D53A02110B_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CCCCCO3""",21,"""E6B2D018D864E862"""
+"""812A133982F8A46F_EEA67D7565B70FF5_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CCC(C)(C)O3""",21,"""E6B2D018D864E862"""
+"""1FA3545789764B83_35150BF2CB8FAC7F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC[N]3N=CC=C3C""",21,"""E6B2D018D864E862"""
+"""D5A5AFB3D8E90070_331E0F27D16F1093_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NOC(=N3)CN""",21,"""E6B2D018D864E862"""
+"""BA13D77BA546B9F9_F97B6693A61BF78E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC=CC(=C3)C""",21,"""E6B2D018D864E862"""
+"""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"""
+"""A48F7DA2AA7B4CEA_7A7E7B07CCB50A39_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC=C3CCOCC3""",21,"""E6B2D018D864E862"""
+"""FE8E86A06E6FE355_C4F4FF61CC2CCCDE_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3CCCOC3""",21,"""E6B2D018D864E862"""
+"""2F40112389E56418_DE78D5B787CFB488_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3COCCO3""",21,"""E6B2D018D864E862"""
+"""6F954DCD0B6C6F36_AA537794F717E3D7_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NOC(=C3)CN""",21,"""E6B2D018D864E862"""
+"""24AAA5D628DE7388_EBECBE6F3C5BC209_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC(C)(C)CO3""",21,"""E6B2D018D864E862"""
+"""10B0E441E2FA51AB_B4E14E158A3A2A58_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC#CC3=CN=CS3""",21,"""E6B2D018D864E862"""
+"""6E5B4C4C134AA4FD_C74222D1170956E2_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC(=CS3)CC""",21,"""E6B2D018D864E862"""
+"""5ADE2515F4598FEC_F419323691FD87A0_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC(C(OC)=O)N""",21,"""E6B2D018D864E862"""
+"""05D89042AA82E129_6AD90D58E20F9BCB_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC3=NN=CO3""",21,"""E6B2D018D864E862"""
+"""6B2F8765C3C99229_F3CD30856DD4CF56_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCOCC3CC3""",21,"""E6B2D018D864E862"""
+"""776580B9B766C3CF_B8FA2EE298A97244_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3N(C)CCCC3""",21,"""E6B2D018D864E862"""
+"""AF6826312A9D06E0_D457DBA2BB28308E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN(CCC)CC""",21,"""E6B2D018D864E862"""
+"""775E13987AD30A7A_1F7039029543CE21_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCC[S](N)(=O)=O""",21,"""E6B2D018D864E862"""
+"""517848693D35B074_0FCD4F695FD38683_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(CCC(O)=O)=O""",21,"""E6B2D018D864E862"""
+"""37869ED906DB5910_C618EC6A18CDDDC3_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOC(OCC)=O""",21,"""E6B2D018D864E862"""
+"""93C5CF7F865DB52D_2D17A83339B86384_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCCCCO""",21,"""E6B2D018D864E862"""
+"""C5C98C3C2FC8DC51_C09A20B857E47966_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC(=C[N]3C)C""",21,"""E6B2D018D864E862"""
+"""5F0C0F0334BE68E2_79743525D2BC2C6F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NC(=NS3)CC""",21,"""E6B2D018D864E862"""
+"""3E9858B7EE1E803E_0A05EC8DC01F3B88_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(CC(O)=O)(F)F""",21,"""E6B2D018D864E862"""
+"""E4A2EDE326529396_CDC2662E5696DDE0_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCC3OCCC3C""",21,"""E6B2D018D864E862"""
+"""D3CDD4CBCD207C61_B8A5B1A96C4778FB_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NCC(C)(C)O3""",21,"""E6B2D018D864E862"""
+"""29692A3B6B2F0C21_FC3C33C9FC69155E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=C(C)OC(=N3)C""",21,"""E6B2D018D864E862"""
+"""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"""
+"""34140D66B9A8EB02_A4920B8A5CF4A1F8_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCN3C(C)CCC3""",21,"""E6B2D018D864E862"""
+"""85FEDB0E9E49BD99_A54AF84B6FCADED9_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=NOC(C)(C)C3""",21,"""E6B2D018D864E862"""
+"""EE2C3956F01DCA66_32EF069012C111C3_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(C(C)(F)F)(F)F""",21,"""E6B2D018D864E862"""
+"""1603E1E5EAFB43D1_87E92E676221D02C_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CCC(C)CO3""",21,"""E6B2D018D864E862"""
+"""7E4934F1F3864D61_06F5BA667E9ACE30_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCOC(C)(C)C#N""",21,"""E6B2D018D864E862"""
+"""E1F4413D4D0410CD_1A9295911D5CB884_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CN=C(CC)S3""",21,"""E6B2D018D864E862"""
+"""1CEB2A80C1B4DD11_388D4833192D0640_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC4=NC3(CC3)CO4""",21,"""E6B2D018D864E862"""
+"""8CC617AC4243D766_19FA6EAE48E35A39_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CCCCC(OC)=N""",21,"""E6B2D018D864E862"""
+"""69FB3FB947BDCED4_96A736B006868A6A_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC[C@]34C[C@H]3CCC4""",21,"""E6B2D018D864E862"""
+"""CE6CBBC45332AFC9_46DEAB9B6527BF0A_6039_DP""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(C3(N)CCC3)=O""",21,"""E6B2D018D864E862"""
+"""F78B92CAC4E48A05_570CF12B8ACB460E_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3CN3C4CCC4""",21,"""E6B2D018D864E862"""
+"""5F18E56820D44D4F_168C929482A37553_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC(N(CC)CC)C""",21,"""E6B2D018D864E862"""
+"""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"""
+"""66E1F7AA68576B0F_B8868A4608229A0F_6039_UN""","""O(C1CC(C1)C2=CC(=CC(=C2)F)F)CC3=CN=C(F)C=C3""",21,"""E6B2D018D864E862"""
+"""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"""
+"""0C74D854A1271F9A_E9C976A8CC477A87_6039_UN""","""CC(OCC1=NN=C(O1)C3=CC2=C(CCCC2)S3)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""ED7DEC0EE5CCBF17_25F20A33CA761BF2_6039_UN""","""CC(OCC(C1=CC=C(NC(CCC)=O)C=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""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"""
+"""F7A1098245DC3460_C10AF61F39B1EC5F_6039_UN""","""CC(OCC2=NN=C(C1=CC=C([N](=O)=O)C=C1)O2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""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"""
+"""BE418F9AEA82D68D_2773BC713BA2F478_6039_UN""","""CC(OCC2=NC1=C(C=CC(=C1)C(O)=O)C(=O)N2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""44020638DB71B25A_26A2305A35791211_6039_UN""","""CC(OCC(NC1=CC=CC(=C1)C(NCC)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""944837C8493E2A7B_4529C6E3CA396B9E_6039_UN""","""CC(OCCOC1=CC=C([S](N(C)C)(=O)=O)C=C1)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""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"""
+"""AF92C4D36FCA42A7_28ABF14437CE91DA_6039_UN""","""CC(OCC(N1CCN(C(C(C)C)C#N)CC1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""1F54F01B0EA3CC49_5D659539A417CD2F_6039_UN""","""CC(OCC(C1=CC(=C(C=C1)OC(F)F)OC)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""088B776D4D21B736_1C190590AA6B4091_6039_UN""","""CC(OCC(NCCCOC1=C(F)C=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""B02D0F423CE8E932_B437E2C178416A9E_6039_UN""","""CC(OCC(N(CC)C(C)C1=CC=C(C=C1)F)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""AD668C0FD9F19DD3_C99A2A790001D7BA_6039_UN""","""CC(OCC(N(C)CC1=C(C=CC(=C1)C#N)F)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""99DE9C5E30736E19_722EC1383D709AC9_6039_UN""","""CC(OCC(N(CC1=CC=C(C)C=C1)C2CC2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""0D24457B6B120189_DD673D2D13FBFEEF_6039_UN""","""CC(OCC(NC(C(NC)=O)C1=CC=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""F2C07158E58CD86E_62725C0186E10CCD_6039_UN""","""CC(OCC(C2=C(F)C=C1NC(CCC1=C2)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""3AF847CFB1D91D1A_A73FE2788DAA5E8C_6039_UN""","""CC(OCC(NCCCN1CC(OC(C)C1)C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""9E9C3EE76071617E_CBC7555C8C38003E_6039_UN""","""CC(OCC1=CSC(=N1)C2=CC=C(C(N)=O)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""30F8490164488FF8_A5CD571087CA0931_6039_UN""","""CC(OCC1=CC=C(C=C1)OCC2=CC=NC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""AF8F77E07323E998_E0B6C488A2A6AD2C_6039_UN""","""CC(OCC(=O)N1CCN(CC1)C2=NC=CN=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""F3718ABFB44C1B03_BFA01EC0312CE1CE_6039_UN""","""CC(OCCCCOC1=C(C(F)(F)F)C=CC=C1)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""61FCD1B7E7925149_5A76A49E6F2BC5F6_6039_UN""","""CC(OCC1=CC2=C(C=C1)OC(=C2)C(OCC)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""F92DF7B140A965A6_A84DF901A8DDF299_6039_UN""","""CC(OCC(C2=CC1=C(OC(C)C(N1)=O)C=C2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""4F4E37457AB986E2_9E3F075D7763E482_6039_UN""","""CC(OCC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""53AFAE437C67AC85_1E3C3D210787F7CF_6039_UN""","""CC(OCC(=O)NC1=NC(=CS1)CN2CCCC2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""49D9FE0084C1517E_C44C2032899DDF9C_6039_UN""","""CC(OCC1=C(OC(C)C)C=CC2=C1C=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""203E73FD54874008_71630E470E0A23B0_6039_UN""","""CC(OCC(OC1=C(C(=C(F)C(=C1F)F)F)F)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""06021E5BE367D83B_21CD075725CC50F0_6039_UN""","""CC(OCC(=O)NNC(=O)C1=CC(=CC=C1)C#N)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""9DE0B52478BB5420_52BADFCA64D4291B_6039_UN""","""CC(OCC(=O)NNC(=O)C1=CC=C(C=C1)C#N)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""8293931F709AE376_6C994242A1C24C29_6039_UN""","""CC(OCC(=O)NC(=O)NC1=CC(=CC=C1)C#C)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""FD181CA824569D73_972D18C4097156DE_6039_UN""","""CC(OCC(=O)NC1=CC2=C(C=C1)OCC(=O)N2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""9A4217685EBF6A67_FF528C21820B8F11_6039_UN""","""CC(OCC(NC1=C(C)C=CC(=C1)[S](=O)(=O)N)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""55C1A77A77C1AE5A_50E1C1F676D979CB_6039_UN""","""CC(OCC1=NC(=NO1)C2=CC(=C(C(=C2)F)F)F)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""7CA978DA08A034E7_08B6B96D3B8A3388_6039_UN""","""CC(OCC(=O)CN2C(=O)C1=C(C=CC=C1)C2=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""B77DDBFE09EA598C_CA73E84775AF262E_6039_UN""","""CC(OCC1=CC(=C(C=C1)OC2=CC=CC=C2)F)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""81914375E39F56A3_FA15CB5C112D947A_6039_UN""","""CC(OCC(NNC(CC1=C(C)C=CC=C1)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""DFC2548A3D75FE57_75B60FE936A2A10E_6039_UN""","""CC(OCCC(NC1=CC=CC(=C1)C(F)(F)F)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""300B5DCB5A318E38_2BC7FEF0724F9559_6039_UN""","""CC(OCC1=CC=C(C=C1)C(=O)C2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""92DC077CF8D87F59_E55A6E224C519E11_6039_UN""","""CC(OCC(C2=CC1=C(NC(C1(C)C)=O)C=C2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""D65B24626C7B8824_4FC0FD58C9AD83AF_6039_UN""","""CC(OCC(NC1=C(C(N)=O)C2=C(S1)CCC2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""17604FFC7856612D_F170888B1115F841_6039_UN""","""CC(OCC(NC(NC1=C(C=C(C)C=C1)C)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""A86BC1FF86A9F81D_6D695D8CAB80AD4B_6039_UN""","""CC(OCC(=O)C1=CC=C(C=C1)C2CCCCC2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""AFF5C5387E67CF40_D3CA329BBA5E4CEB_6039_UN""","""CC(OCC(C1=CC(=C(SC)C=C1)NC(=O)C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""DD40B48B3BA256A3_759AE02355208E05_6039_UN""","""CC(OCC(N(CC1=C(F)C=CC=C1)C2CC2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""3651050303D17FBF_B9E3A00FD379F6F8_6039_UN""","""CC(OCC(N(C(CC)C)C1CC[S](=O)(=O)C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""E1827529C3D3D0E0_376BA8C6C6689522_6039_UN""","""CC(OCC(C1=CC=C(N(C)[S](=O)(=O)C)C=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""F6A27271868634AE_37829F71641E609C_6039_UN""","""CC(OCC(C)=C(C#N)C2=NC1=C(C=CC=C1)S2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""1E28D7FDA571E69D_AC3F77AD5457922C_6039_UN""","""CC(OCC(C1=C[N](C)C(=C1)C(=O)C(Cl)(Cl)Cl)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""09EEA4A24F2B91F1_6C1A78A9781BA836_6039_UN""","""CC(OCC(NC1=CC(=C(C(OCC)=O)S1)C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""AF3707D6E928D3CF_5F62BB2203C00C84_6039_UN""","""CC(OCC3=NC1=C(C2=C(S1)CCCC2)C(=O)N3)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""03E7360D8B09EBE4_6F72B78C75C90FB3_6039_UN""","""CC(OCC1=C(C(OCC)=O)C2=C(O1)C=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""44A8447FF96FBDD1_7CA32A4A2EDAF734_6039_UN""","""CC(OCC(NC1=C(C(OCC)=O)C=N[N]1C)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""8FB6ACF9EB3B2AFA_41C099C603FC510B_6039_UN""","""CC(OCC(=O)N1CCN(CC1)CC2=CSC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""A6A4FD045D1A0EAF_CFD7955B6D6EFA03_6039_UN""","""CC(OCC(=O)N1CCN(CC1)CC2=CC=CO2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""A3F2D58F8D94C3BA_5671B5A5EC6BDF93_6039_UN""","""CC(OCC(C2=CC1=C(N(C)C(=O)CC1)C=C2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""A68B5A6A905E7D82_3613DBB358602A6C_6039_UN""","""CC(OCC(NC2=NN=C(C1=C(C)C=CS1)O2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""A2C58605630C7572_A57D86793563826F_6039_UN""","""CC(OCC(NC1=C(C)C=C(C=C1C)SC#N)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""43C024E9862503F3_3B0CE9386D91E7AE_6039_UN""","""CC(OCC(N1CCC2=C1C=C([N](=O)=O)C=C2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""B1F360FB9EC4467C_CC7F423E1EA9C2C1_6039_UN""","""CC(OCC1=NC(=NO1)C2=CC=C(C(C)C)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""CEEF0AB07012113C_321520DDBDAE10C2_6039_UN""","""CC(OCC(NCC1=CC=C([S](N)(=O)=O)C=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""A706A5AC28149C5B_F9C391DDC428C4DA_6039_UN""","""CC(OCC1=CC(=CC(=C1)C(=O)OC)C(OC)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""63046F870B545994_2C5C7EAA0AE76103_6039_UN""","""CC(OCC1=CN=C(C=C1)OCC2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""D7AA9387CF183F3D_BE0ACF2CD71ABF9D_6039_UN""","""CC(OCC(NC1=CC=C(C(OCC)=O)C=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""BF449AF0014F330B_F9F63393F9491790_6039_UN""","""CC(OCC2C[N]1C(=NN=C1S2)C3=CC=CC=C3)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""21AE5081A2DAC23E_076409BF87FFE344_6039_UN""","""CC(OCC(C1=CC2=C(C=C1)NC(N(C)C2)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""F7787A10B9AEFBAB_69FD52B6F1EAAF59_6039_UN""","""CC(OCCCN1CCN(CC1)C2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""169B6A03D9D1538A_3336FFDEED512E13_6039_UN""","""CC(OCC(NCC(C(C)C)C1=CC=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""2A16F5DFC4973E05_63746B3526569C37_6039_UN""","""CC(OCC(=O)NC1=C(C2=C(S1)CCCC2)C#N)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""6C09CDF70BEDD291_52F7ADE9DE0828C5_6039_UN""","""CC(OCCCC(NC1=CC=CC(=C1)[N](=O)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""F902DC7B7390DFA5_F400DE92997D9650_6039_UN""","""CC(OCCC(=O)NC2=C1C=CC=CC1=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""8689506E70B2483C_6C9414260E239D08_6039_UN""","""CC(OCC(=O)NC1=CC=N[N]1CC2=CC=CS2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""6FD05BB82A798C17_D2B85657C2616F70_6039_UN""","""CC(OCC(=O)NC1=NN=C(O1)C2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""88338970B08C064B_6511DDBD5C29BE4E_6039_UN""","""CC(OCC(N(C1=C(F)C=CC=C1)CCC#N)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""FFE58B753C1B59A3_1D377676713EB77A_6039_UN""","""CC(OCC2=NC1=C(C=CC=C1)C(=O)N2CC#N)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""721FC9D518C35F2C_B95CD293950FFAFE_6039_UN""","""CC(OCCCC2=NC(C1=C(SC(=C1C)C)N2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""AD279FA1C0922304_56C69DC6AB22D350_6039_UN""","""CC(OCC2=CC=C(N1CCC(OC)CC1)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""05210076A50AB20C_988B3C72F1E332E0_6039_UN""","""CC(OCC(NNC(C1=CC(=C(S1)C)CC)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""1CF2FFDE33626E46_D48677013199C131_6039_UN""","""CC(OCC1=NC(=NO1)C2=CC3=C(C=C2)OCO3)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""3308C68E87B93C56_A87F0BF2AAB6EA0B_6039_UN""","""CC(OCC(C2=CC1=C(C=C(OC)C=C1)C=C2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""5D5570132D0BC691_7705A9C91E24BE7F_6039_UN""","""CC(OCC(C2=C1OCC(C1=C(OC)C=C2)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""562CF7B807B5199C_621C9B68FA703AF1_6039_UN""","""CC(OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""04079E5EA8C1CD9A_2B9854C7A8A47AD7_6039_UN""","""CC(OCC(=O)NC1=C(C=NO1)C2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""467D872A6BB431CE_F51B2DFBEC361059_6039_UN""","""CC(OCCCON2C(=O)C1=C(C=CC=C1)C2=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""0D9D436AA7B66FE4_92B2A4823FE19AC0_6039_UN""","""CC(OCC(C1=CC=C([S](N(C)C)(=O)=O)C=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""656EEF097DEF77BB_F33D9AEF1F05E413_6039_UN""","""CC(OCC1=CC(=CN=C1)OCC2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""F4167D7035D2F67A_5BAC3D9311F72FD4_6039_UN""","""CC(OCC1=COC(=N1)C2=CC=C([N](=O)=O)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""F481BABC5FBC8524_187E591E43AAC55A_6039_UN""","""CC(OCC(NC(C(C)=O)CC1=CC=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""F3E8B4F7FA870344_D698FF6DD6D20379_6039_UN""","""CC(OCC3=NC1=C(OC2=C1C=CC=C2)C(=O)N3)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""365962874747CA49_FE819E4C4435C075_6039_UN""","""CC(OCC(=O)NNC(=O)CC1CC[S](=O)(=O)C1)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""3A40F3BB3EA5AB36_404E9E96D9F395A7_6039_UN""","""CC(OCC1=CSC(=N1)C2=CC=C(C(O)=O)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""CB2DCD1D14ABE86C_B2A139A7D7FC1EC4_6039_UN""","""CC(OCCC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""B7F167F88DD24AF7_F1ACB102FF42F319_6039_UN""","""CC(OCC2=NN=C3N(C)C(=O)C1=C(C=CS1)[N]23)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""F6B5CAA709784527_465781518748301B_6039_UN""","""CC(OCCC(NC1=C(C)C=CC(=C1)[N](=O)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""21D016B41B3A15DC_81F4B8B60BE589DD_6039_UN""","""CC(OCC2=CC=C(OCC1=NC=C[N]1C)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""CF640F96C8AAD074_8FCAC822A1B4F671_6039_UN""","""CC(OCC(NC(C1=CC=C(C)C=C1)C2CC2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""8E7918861FD7A4DC_5790226C44C0E68B_6039_UN""","""CC(OCC(NC1=CC=CC(=C1)C(N(C)C)=O)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""E65647243D0D8678_74C1E13DDCBFFB27_6039_UN""","""CC(OCC(N(C)CCOC1=C(C=CC=C1)F)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""C68C999128FF9D9F_CC84AEC0F791E051_6039_UN""","""CC(OCC(=O)NC1=C(N=CC=C1)N2CCCC2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""CCB0FD2F0300D943_8CF8813E784D72DB_6039_UN""","""CC(OCC(C1(NC(C(F)(F)F)=O)CCCC1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""C11A3179A06300B1_44C7EF881A6D2849_6039_UN""","""CC(OCC(=O)NCCC1=C[NH]C2=C1C=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""E2F80BED840B6316_56071E0857EA256A_6039_UN""","""CC(OCCC(N(CCCCC)CCCCC)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""774775F9A4F92CD3_7A0F488D85CBFB0F_6039_UN""","""CC(OCC(=O)C1=CC=C(C=C1)N2CCOC2=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""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"""
+"""92AF0CE731C35C03_DDEC7FC88D95DB9A_6039_UN""","""CC(OCC1=C(C=CC=C1)OCC2=CC=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""9D44517F6F6BA462_1CEDEFCF636ABD68_6039_UN""","""CC(OCC(C1CCN(C(C(F)(F)F)=O)CC1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""8EB141477F9297C3_00FFE0EC232D1E0E_6039_UN""","""CC(OCC#CCN2C(=O)C1=C(C=CC=C1)C2=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""9F71DD54870FD7BF_E9BC91945EA4F21E_6039_UN""","""CC(OCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""B99CEBD4668DD440_2BD827EF4B6B9BD1_6039_UN""","""CC(OCC1=C(C=C(C(OC)=O)C=C1)C(F)(F)F)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""C436A7559A486290_91A465A4922DC020_6039_UN""","""CC(OCC(=O)NC1=CC=C(C=C1)N2CCCC2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""2D2362C0F88EEBFD_873E0E3651CE539A_6039_UN""","""CC(OCC1=CSC(=N1)COC2=CC=C(C)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""3C013F0FA0BBEBAC_024E1A66E16AA58C_6039_UN""","""CC(OCC(N(C(C)(C)C)CC1=CC=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""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"""
+"""E167110C029BC903_BE6869DD4A3A8F74_6039_UN""","""CC(OCC(NC1=C(C=CC(=C1)[S](C)(=O)=O)F)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""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"""
+"""F32359C8C734E52D_75FEC3B1A102EEAB_6039_UN""","""CC(OCC1=C(C(OCC)=O)C(=CO1)C(F)(F)F)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""D3FE612F9BC60870_DDF54B4B91D9F27C_6039_UN""","""CC(OCC(C(C(OCC)=O)CCC(=O)OC)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""CF1670E4C8D6C85B_30CA17EC6A815EB9_6039_UN""","""CC(OCC1=CSC(=N1)C2=CC=C(C(C)C)C=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""4F3E1E1775690E11_163D5D80C0CC1842_6039_UN""","""CC(OCC2=NC1=C(C(=C(S1)C(=O)O)C)C(N2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""D94C3AB870A2741E_C7CE638650C0E6E3_6039_UN""","""CC(OCC(NC(C)C1=CC2=C(C=C1)OCO2)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
+"""C6F762BD74CB981A_CC9FCE3695954CBD_6039_UN""","""CC(OCCCC(NC1=C(C(C)=O)C=CC=C1)=O)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""1995B64BD72F6EC9_C037ADA0E5E72DEB_6039_UN""","""CC(OCC1=CC=C(C=C1)OCC2=CN=CC=C2)C(=O)O""",21,"""D708779EEBF1CAE9"""
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+"""B2E79CF43698537F_38F2A8FB3D2423F9_6039_UN""","""CC(OCC1=CSC(=N1)C2=CC=CO2)C3=CC=C(C=C3)C""",21,"""439EB42AE927897D"""
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+"""C81A15229DB43151_6A897D2DDA6048B9_6039_UN""","""CC(OCCC(C1=CC=C(F)C=C1)=O)C2=CC=C(C=C2)C""",21,"""439EB42AE927897D"""
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+"""991AC2C1C250B9E8_DE2EDB3371C4B3C4_6039_UN""","""CC(OCC(NC1=NN=C(CC)S1)=O)C2=CC=C(C=C2)C""",21,"""439EB42AE927897D"""
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+"""C3E88E2AA0FAAB7B_71D32981E8674E13_6039_UN""","""CC(OCC(CC1=C(F)C=CC=C1)=O)C2=CC=C(C=C2)C""",21,"""439EB42AE927897D"""
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+"""907263DC7A779E85_FEB259DEF76ABB3C_6039_UN""","""CC(OCC1=CC=C(C(F)(F)F)C=C1)C2=CC=C(C=C2)C""",21,"""439EB42AE927897D"""
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+"""37D4CA83A57B3486_AE44F3F6810E3F19_6039_UN""","""CC(OCC1=COC(=N1)C2=CC=CS2)C3=CC=C(C=C3)C""",21,"""439EB42AE927897D"""
+"""8CBC98C53E39B793_70C7CD10CDF1BB99_6039_UN""","""CC(OCC1=NC(=NO1)C2=CSC=C2)C3=CC=C(C=C3)C""",21,"""439EB42AE927897D"""
+"""E0E5C6F3A30A3C6E_9441574C8E210C7F_6039_UN""","""CC(OCC1=NOC(=N1)C2=CC=CS2)C3=CC=C(C=C3)C""",21,"""439EB42AE927897D"""
+"""1E01C458DE4629DE_1AF46C60463E36A5_6039_UN""","""CC(OCC(NC(CCC(C)C)C)=O)C1=CC=C(C=C1)C""",21,"""439EB42AE927897D"""
+"""394079CD6B387B2D_311E230B561E992E_6039_UN""","""CC(OCCOC1=CC=C(C=C1)C#N)C2=CC=C(C=C2)C""",21,"""439EB42AE927897D"""
+"""BF2C1E5B8A421747_83A314054041D516_6039_UN""","""CC(OCC(=O)NCC1=NC=CC=C1)C2=CC=C(C=C2)C""",21,"""439EB42AE927897D"""
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+"""830295CCA514E7E9_330770122E75C806_6039_UN""","""CC(OCC1=C(C)C=CN=C1)C2=C(C=CC=C2)C(F)(F)F""",21,"""A64CB51E65B29B41"""
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+"""712FA2A25BC1E8A5_CF3DF4D5066B0307_6039_UN""","""CC(OCCC1=CN=CC=C1)C2=C(C=CC=C2)C(F)(F)F""",21,"""A64CB51E65B29B41"""
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+"""530F3BA1ACFB3354_D2E24943CA288145_6039_UN""","""COCC(C)OC1=CC=C(C=C1)COCC2=NC=CN=C2""",21,"""045B7C961974274A"""
+"""B4479F55DBD4AAF7_9647155A6D360DFE_6039_DP""","""COCC(C)OC1=CC=C(C=C1)COCC(C2(N)CC2)=O""",21,"""045B7C961974274A"""
+"""6B9F0B7318C8D955_0D7B8127F94BF865_6039_UN""","""COCC(C)OC1=CC=C(C=C1)COCCC[Si](Cl)(Cl)Cl""",21,"""045B7C961974274A"""
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+"""FEECF13C7DE96DA0_03E20C8C327D157B_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCCCC[N]2N=CC=C2""",21,"""79304C93FD5F3B82"""
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+"""729778462587199F_6B3E4BD9CE290061_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(=O)NNC(=O)C2CC2""",21,"""79304C93FD5F3B82"""
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+"""EB940AD282C783D4_905B4AAF72BADF31_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC3=C(C=C2)CCC3""",21,"""79304C93FD5F3B82"""
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+"""26C3A41DAF89E610_C0E308A4187119A5_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2OCCN(C(C)C)C2""",21,"""79304C93FD5F3B82"""
+"""06BBB849B00043C5_DDAE62ABBA3AD0F5_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C[N](C)N=C2[N](=O)=O""",21,"""79304C93FD5F3B82"""
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+"""F1D3F958B4A604F2_F9ABC65BEDB7E6C0_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(N2CCCC2(C)C)=O""",21,"""79304C93FD5F3B82"""
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+"""D534D117F6E9D59F_50F30434BAA5E953_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(CCC(OCC)=O)=O""",21,"""79304C93FD5F3B82"""
+"""AFC7DD2DB1BD4442_A4C9287D1C6FC73D_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCCCC[S](CC)(=O)=O""",21,"""79304C93FD5F3B82"""
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+"""EFA7B781320653F2_271F96526329DC36_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC(=C(C=C2)C#N)F""",21,"""79304C93FD5F3B82"""
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+"""98944873A63E8752_CC737489B55A568E_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC3CCC2(CC2)C(=O)O3""",21,"""79304C93FD5F3B82"""
+"""715DAEC1CF21FD1B_2E6283CFB57BA2D6_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCC2=C(CC)C=CC=C2""",21,"""79304C93FD5F3B82"""
+"""A7FB7A927435AD24_14C28D2570AB7755_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC3CC2=C(C=CC=C2)O3""",21,"""79304C93FD5F3B82"""
+"""9A607B9CE7D0A698_EEF8D32761D60185_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NN=C3[N]2CCCC3""",21,"""79304C93FD5F3B82"""
+"""82EBB732B6D88A18_69DF48C195613BB3_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(=O)C2CCCCCC2""",21,"""79304C93FD5F3B82"""
+"""37D55B62DC2957E2_EB17B58152DD56DD_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NOC(=C2)C(C)(C)C""",21,"""79304C93FD5F3B82"""
+"""FD703484A391AA3F_1D004D68A65525E8_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(N2CCC(C)CC2)=O""",21,"""79304C93FD5F3B82"""
+"""B8D4C88DCBFCA003_AB9AF38AFFD5D870_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(N=C(OC)N=C2)C""",21,"""79304C93FD5F3B82"""
+"""F612DD29A2C44DB9_717147A0EC804245_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NC=N[N]2C(C)(C)C""",21,"""79304C93FD5F3B82"""
+"""48CBD2F9CDB00A8E_4F3DCCFF99BF8D4D_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2N(C(C)C)CCCC2""",21,"""79304C93FD5F3B82"""
+"""97CC10865EC8DE1E_3EB11D142A25EBC0_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCCCC2CCOCC2""",21,"""79304C93FD5F3B82"""
+"""1FF061E568352044_A8A144A0A9340794_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCCC2=CC(=NO2)CC""",21,"""79304C93FD5F3B82"""
+"""4DE873B1BEB0233A_BC2C94B3EAE56FB1_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(C2=CN=CC(=C2)F)=O""",21,"""79304C93FD5F3B82"""
+"""379744C481E27BFC_C8A134E073F7C49E_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(C(C(OC)=O)(C)C)=O""",21,"""79304C93FD5F3B82"""
+"""45B78BA7EA56491F_2736A8784E818410_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(C(OC)=O)C=NO2""",21,"""79304C93FD5F3B82"""
+"""15EEEF8F8E82F4A2_0CA8D80033E483F6_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NN=C3[N]2CCOC3""",21,"""79304C93FD5F3B82"""
+"""9C1CCB898985E085_0C9DE09FBBDD337A_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(OC)C2=CC=CC=C2""",21,"""79304C93FD5F3B82"""
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+"""2712519D7C14D2B7_8231E251E7792228_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CN=C(N(C)C)C=C2""",21,"""79304C93FD5F3B82"""
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+"""21C19991445137F9_761613A2C1F8A102_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCN2CC(C)CC(C2)C""",21,"""79304C93FD5F3B82"""
+"""2006B80468F33B77_4759EA0D1A7A9599_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCC2=C(F)C=CC=C2F""",21,"""79304C93FD5F3B82"""
+"""395869B6FEC632E6_E2524FF7CC2EB377_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(C2=N[N](CC)N=C2)=O""",21,"""79304C93FD5F3B82"""
+"""6630098BC20BFF4D_602877F18473D807_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=N[N](C(C)(C)C)N=N2""",21,"""79304C93FD5F3B82"""
+"""F3CEBD5877DF48AF_CBF654E118BCAB4B_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCN2NC(=O)C=CC2=O""",21,"""79304C93FD5F3B82"""
+"""02C950B5BA2C0EBB_3825F619F6D8CBA1_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(C2(C(OC)=O)CC2)=O""",21,"""79304C93FD5F3B82"""
+"""3A6E287174F0AD9D_7678D279DC3ED38A_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCN2C(CN(C)C2=O)=O""",21,"""79304C93FD5F3B82"""
+"""C0D3298E06CE4D78_5E1C362CA70E4598_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC3=N[N]2CCCCC2=C3""",21,"""79304C93FD5F3B82"""
+"""C9B8EC286C4029F4_8CA16FAAEB3B80E2_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2CN=C(C(C)(C)C)O2""",21,"""79304C93FD5F3B82"""
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+"""F4DA8FEB8F407328_73837126B751F334_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCSC2=CC=CC(=C2)F""",21,"""79304C93FD5F3B82"""
+"""E16374F8ACFA9047_8D79D17390464402_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCOCC2=CC=CC=C2""",21,"""79304C93FD5F3B82"""
+"""A515E8C13D98D1AC_6D8F92777E9DCBCF_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC[P](N(C)C)(=O)N(C)C""",21,"""79304C93FD5F3B82"""
+"""A8286F3008FC3F20_4F536E3AA6F5F634_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(N=[S](N(C)C)(=O)C)=O""",21,"""79304C93FD5F3B82"""
+"""10273D9B0D8C9134_CF9CDC406C24CB9C_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCSC2=CC=CC(=C2)C""",21,"""79304C93FD5F3B82"""
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+"""F243E2AF3ADAF4AE_38B6DDD6012DD095_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=COC(=C2)[S](N)(=O)=O""",21,"""79304C93FD5F3B82"""
+"""3F09B6A41BF6040B_509CED0592B5E72D_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(OC)C2CCCCC2""",21,"""79304C93FD5F3B82"""
+"""E19B3E055389E667_C911DE2A65790D2A_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC(=C(C=N2)C)OC""",21,"""79304C93FD5F3B82"""
+"""04A6196686A89BB6_0935B5AF08D62AA1_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC(=NO2)C(F)(F)F""",21,"""79304C93FD5F3B82"""
+"""AA45ED7C220CFFA4_0807D523FA87024F_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC=CC(=C2)C(C)C""",21,"""79304C93FD5F3B82"""
+"""BA79BB20E45A9ACF_0FECDFC968A957D7_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=COC(=C2)[S](C)(=O)=O""",21,"""79304C93FD5F3B82"""
+"""E6627C5CEC7BDB82_81C018D743138864_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCC#CC2=NC=CC=C2""",21,"""79304C93FD5F3B82"""
+"""26CD3360FF216693_C1ECFE06FA8C0E1D_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC(=CC=C2)N=[N]#N""",21,"""79304C93FD5F3B82"""
+"""1FCD6ABBBF93B6BB_CF977CA188F6E6C2_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NC(=NO2)C3CCC3""",21,"""79304C93FD5F3B82"""
+"""0EA2520D96B53585_C17C11B5FF746D18_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC(=C(C)C=C2)C#N""",21,"""79304C93FD5F3B82"""
+"""4875EC961612C544_33BEF8FB99207C38_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(N=C(C)C=C2C)C""",21,"""79304C93FD5F3B82"""
+"""C9BA445C30C83F0E_5718C48FACCEC847_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC=CC(=C2C)OC""",21,"""79304C93FD5F3B82"""
+"""1596AF48AC899AD3_41CF527184D163DC_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NC(=NO2)CC3CC3""",21,"""79304C93FD5F3B82"""
+"""73ECD6FE2118FCDC_EF9D2D396D239001_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC=C(C(C)(C)C)O2""",21,"""79304C93FD5F3B82"""
+"""F55F4BE850DC774E_3421D91A8FFD0792_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(C=CC=C2)N=[N]#N""",21,"""79304C93FD5F3B82"""
+"""0B4F8A9054199858_07EDC70259459F96_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(C(OC)=O)C=CS2""",21,"""79304C93FD5F3B82"""
+"""954AEFA9B4790CA7_3290692FAF2E9A36_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(=O)NC2=NC=CC=C2""",21,"""79304C93FD5F3B82"""
+"""FAED9EBAC7FF1A7A_DF9C323CA0A43EE0_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC3CC2(CCCC2)CO3""",21,"""79304C93FD5F3B82"""
+"""0AC938659E84BA17_13257EA55921B95D_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(C2=C(F)C=CC=C2)=O""",21,"""79304C93FD5F3B82"""
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+"""E847C9B31E1A6E32_A377FCDE72756F33_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(COC)C=CC=C2""",21,"""79304C93FD5F3B82"""
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+"""79C40EA2A8A6C9CC_573A26B17A389C38_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NCC(C(OC)=O)O2""",21,"""79304C93FD5F3B82"""
+"""57C195CA0B47ECA3_3C5A8708C16880A0_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCNC(=O)N2CCCC2""",21,"""79304C93FD5F3B82"""
+"""2CA606C5A7D21436_2CBB9AFA627F7E46_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NOC(=C2)CC(C)C""",21,"""79304C93FD5F3B82"""
+"""B797CAE139889EC0_9FF408BFE4B96F4C_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=N[NH]C(=C2)C(OC)=O""",21,"""79304C93FD5F3B82"""
+"""D195FF9FBABA18CD_975B2F50693F5DE1_6039_DP""","""CC1=C(C(=CC=C1)C)CCOCC(N2CC(C)NCC2)=O""",21,"""79304C93FD5F3B82"""
+"""57ABAF0C4184FF7D_43D9F56D63B9307A_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC3=CC2=C(C=CC=N2)S3""",21,"""79304C93FD5F3B82"""
+"""7556C088E6A18FA4_CA4A22EFAD0A351E_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC(=NC(=C2)C)OC""",21,"""79304C93FD5F3B82"""
+"""9DE7A42BF82856C9_8E12AE7C39A29555_6039_DP""","""CC1=C(C(=CC=C1)C)CCOCC2CNCC3(O2)CCC3""",21,"""79304C93FD5F3B82"""
+"""31CDD81164207903_840D940B52734FE8_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC(=NC(=N2)OC)C""",21,"""79304C93FD5F3B82"""
+"""AF75DEDA13FDF890_A179366951602500_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCN2CCCO[P]2(N)=O""",21,"""79304C93FD5F3B82"""
+"""C2006621655310E8_661E3AB1BCDDA83B_6039_DP""","""CC1=C(C(=CC=C1)C)CCOCC2=N[NH]C3=C2CNCC3""",21,"""79304C93FD5F3B82"""
+"""624042AA19BFB627_A176F960E427BB79_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C3C(=N[NH]2)CCCC3""",21,"""79304C93FD5F3B82"""
+"""9E940A6A1AFEDFA9_1BC466A54BB0CE79_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCC2=C([N](N=C2C)C)C""",21,"""79304C93FD5F3B82"""
+"""E315ED6AE4CC769C_AEFD258619650120_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(C(OC)=O)SN=C2""",21,"""79304C93FD5F3B82"""
+"""7CD65ABF8A38475D_A8B79F4A8ECD6722_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(C(F)F)C=NC=C2""",21,"""79304C93FD5F3B82"""
+"""6B5BF26E03558511_2479586385EE7130_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(C(F)(F)F)SC=C2""",21,"""79304C93FD5F3B82"""
+"""F2B60283F8B9E3B6_BDAF106EBDA7479A_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(C2(C(F)(F)F)CC2)=O""",21,"""79304C93FD5F3B82"""
+"""6BA1B6651D490026_8D65EE3262B2A03C_6039_DP""","""CC1=C(C(=CC=C1)C)CCOCC2CNC3(CO2)CCC3""",21,"""79304C93FD5F3B82"""
+"""9E76B8D3F760D15F_C9164C6A8B8CC584_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(C(C)(C)C)OC=N2""",21,"""79304C93FD5F3B82"""
+"""D3173E6C12F0AF0E_C9196F68139EC87C_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCOCCOCCOC""",21,"""79304C93FD5F3B82"""
+"""5386080204DF13C3_01D1DA0E7B2D56BF_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NN=C(C(F)(F)Cl)S2""",21,"""79304C93FD5F3B82"""
+"""DF25BCED726F9313_23C09141E6CEFC0C_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCC(C(OCC)=O)(F)F""",21,"""79304C93FD5F3B82"""
+"""B870D08F3D1A1AEE_4F14A9164B43E310_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(SN=C2OC)OC""",21,"""79304C93FD5F3B82"""
+"""57530495DD90AD26_4076F6461AEBDC04_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NOC(=C2)CC3CC3""",21,"""79304C93FD5F3B82"""
+"""62A92628500B5B4C_01B119DD1A27EEC7_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC3=C(C=C2)OCO3""",21,"""79304C93FD5F3B82"""
+"""ED84416C402846E0_6A387D90CD024B3D_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NC(=C[NH]2)C(F)(F)F""",21,"""79304C93FD5F3B82"""
+"""CFFFBB23A5ECBDBA_1339F65C34371692_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NO[C@@H]3CCCC[C@H]23""",21,"""79304C93FD5F3B82"""
+"""ED4B26E2CA2A2732_9E307521783F5E88_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC=NC(=N2)COC""",21,"""79304C93FD5F3B82"""
+"""CB75F61019BFED08_0A256962C931AC67_6039_DP""","""CC1=C(C(=CC=C1)C)CCOCCC3CC2CCC(N2)C3""",21,"""79304C93FD5F3B82"""
+"""F09A9A9D77CDCC55_AA3B7F4652A9C8D6_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC=CC(=C2)C(N)=O""",21,"""79304C93FD5F3B82"""
+"""8DA373A06B5BDF9A_6F53D8D1A212F0AD_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC=C(C(OC)=O)S2""",21,"""79304C93FD5F3B82"""
+"""DB9459A865EEDCCB_77830FC7343CCFBD_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(NCCCC(O)=O)=O""",21,"""79304C93FD5F3B82"""
+"""689A572A26750AB1_1FC3DBBA7A4685DB_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(=O)NCC2=CC=CS2""",21,"""79304C93FD5F3B82"""
+"""AC57D9380C1ABB1E_558F030DA5440213_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC=CC3=NON=C23""",21,"""79304C93FD5F3B82"""
+"""855547CC1B5D673A_45670253C481B033_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC3=C[N]2C=CC=NC2=N3""",21,"""79304C93FD5F3B82"""
+"""D424E90342105A00_DAF57C930827D4B6_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCOC2CCCCC2C""",21,"""79304C93FD5F3B82"""
+"""59FBA353161398C7_084BDC66FA437A1C_6039_DP""","""CC1=C(C(=CC=C1)C)CCOCC3=CC2=C(C=C[NH]2)C=C3""",21,"""79304C93FD5F3B82"""
+"""38C794CBA0C3149B_8F31F28098B834CB_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=C(C(=NO2)C)[N](=O)=O""",21,"""79304C93FD5F3B82"""
+"""FA2F297BD379B1F0_6939991AAD14B590_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCOC2=CC=C(C)C=C2""",21,"""79304C93FD5F3B82"""
+"""ACD14BA4B06E4C47_62BB28B564EFA88B_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCCOCC(C(F)F)(F)F""",21,"""79304C93FD5F3B82"""
+"""CE5E6C01AA8E570F_845F5FAE1BA343E3_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC(NC(NCCC)=O)=O""",21,"""79304C93FD5F3B82"""
+"""08AF3267CACD0EBA_224C39E4D153DF35_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NN=C([N]2C)C3CC3""",21,"""79304C93FD5F3B82"""
+"""8D4935C9C842BD5A_752674242432EBBA_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=NN=C(S2)C3CCC3""",21,"""79304C93FD5F3B82"""
+"""E332D2EA43C0E148_BE13DD5461B9E198_6039_UN""","""CC1=C(C(=CC=C1)C)CCOCC2=CC=CC(=C2)C(F)F""",21,"""79304C93FD5F3B82"""
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+"""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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+"""890621EFDFADAEC0_99AA3CC19EC484EC_6039_UN""","""CCC(CC)(COCC(N(C)C1=NC=CS1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
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+"""A59400AFE7E33766_E506410913769925_6039_UN""","""CCC(CC)(COCC1=CC=C(N(C)C)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
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+"""587A39F49ECB312A_F5EB9F99F8B4ECE9_6039_UN""","""CCC(CC)(COCC[N]1C=C([N](=O)=O)C=N1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""84267D49D096BB30_9D377F1AC4C44D9E_6039_UN""","""CCC(CC)(COCC1=NC(=NO1)CCOC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
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+"""FD80224BDEE15839_AF36050A5C105A89_6039_UN""","""CCC(CC)(COCC[N]1N=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A680B969A81ACDC8_78487675C1B0D1C7_6039_UN""","""CCC(CC)(COCCCCC[N]1N=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""AD42C8CD59EF0B40_C5D2DD0A6338424D_6039_UN""","""CCC(CC)(COCC(C(OC)=O)NC(=O)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A8064972692D1F4D_109431203DE4C4DD_6039_UN""","""CCC(CC)(COCC(=O)NNC(=O)C1CC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""9C3D7DC5B1924802_25BEC2B4745B8815_6039_UN""","""CCC(CC)(COCC(C1=C[N](N=C1C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F6DBAE1EC64C507B_83912A64596C71E6_6039_UN""","""CCC(CC)(COCC(=O)NC1=CC=NC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1431F405A03D1EAA_A5929355F4C13C10_6039_UN""","""CCC(CC)(COCCC1=CC=C(CC)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""49EED55B16D964B3_EBF1305681771B8D_6039_UN""","""CCC(CC)(COCC1=CC2=C(C=C1)CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B79B6D87B1D8EC1B_9DB16501788B0400_6039_UN""","""CCC(CC)(COCCOCC1CCCCO1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7FC42AE4CA6445FE_BB49725DEBBCDD19_6039_UN""","""CCC(CC)(COCC1OCCN(C(C)C)C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E5AD805E344927AB_A604185249F71449_6039_UN""","""CCC(CC)(COCC1=C[N](C)N=C1[N](=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""51E3F760B4DF26A0_9805902F191E2BC5_6039_UN""","""CCC(CC)(COCCCOC1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A950660BFC40A140_06E51F739829F5B6_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1)N(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""18D145FC3887E4D7_172F6BC347D36F08_6039_UN""","""CCC(CC)(COCCOC1CCCCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5A1CAB542D0235C0_6D79C7A89C3850DB_6039_UN""","""CCC(CC)(COCC1=C(N=C[N]1C)[N](=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BCB58A3E320DA637_047569E4827BCEA5_6039_UN""","""CCC(CC)(COCC2=NC1=C(C=CC=C1)S2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E845D4FB09D015BE_5AEB2108C0ED0F7B_6039_UN""","""CCC(CC)(COCCN(C)C1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8860D3CA7D4EEB55_278FBB05080329D4_6039_UN""","""CCC(CC)(COCC1=CC=CC(=N1)OCC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""17A5EE3BADC86BC2_1330DD8CF2E2FCE3_6039_UN""","""CCC(CC)(COCC1=NC(=NO1)C(OC)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7FB889BBCE05AB77_1EC74D0EDF7F5BA4_6039_UN""","""CCC(CC)(COCC[P](OCC)(=O)OCC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""243695629132C257_3964CE84726531B0_6039_UN""","""CCC(CC)(COCC1ON=C(C(OC)=O)C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""9E74873378D3F8D4_4BB2414A7355A9DE_6039_UN""","""CCC(CC)(COCC1=NC(=CS1)C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""83CAFACAEF0F8144_CBCAC6B771F8201E_6039_UN""","""CCC(CC)(COCC2=NC1=C(N=CC=C1)[NH]2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B3AEA81EAFA64973_C75005648ACFF706_6039_UN""","""CCC(CC)(COCC[N]1C=C(C(O)=O)C=N1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A73C457AA09B3664_B62DF9FDB266AA4B_6039_UN""","""CCC(CC)(COCCCNC(C(F)(F)F)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""96CD6C4F67E0675C_201CBD5A9A3CB0F7_6039_UN""","""CCC(CC)(COCCNC(=O)C1CCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""EBEA83FFE9B98B42_BDD82E6333B1CEC3_6039_UN""","""CCC(CC)(COCC1=CC=CC2=NSN=C12)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BFE6A447AC11F247_2DF8865AB8E7B6B5_6039_UN""","""CCC(CC)(COCCC1=CC(=C(F)C=C1)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""9F341B809F200F81_029C6B2234BF7EB8_6039_UN""","""CCC(CC)(COCC#CC1=CC=C(F)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""2C14862EBE4DA6E8_A013A0B451210163_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1)COC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""D07BEB6A179B5B7A_A69AC24DCD7F95D2_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1)C(O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5E05DA3A8A3679F2_8ED34E4AC086DDBD_6039_UN""","""CCC(CC)(COCC(=O)NC1CCSC1=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""30FFDA727BFEF7D1_921C1B12DF097ED8_6039_UN""","""CCC(CC)(COCC1=C(C=C(F)C=C1)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CF98D1A208C4D788_DBA864EE1D5A856C_6039_UN""","""CCC(CC)(COCCCCC[N]1C=CN=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C27D0CDA1009572A_640DE6DD5BAB0B05_6039_UN""","""CCC(CC)(COCCCOC(NC(N)=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""76F4C253E62F77FC_8FD6A4901E6D6289_6039_UN""","""CCC(CC)(COCCCC[N]1C=CN=C1C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A10C7DA51535BE8B_BEE4A1F1BE589AAA_6039_UN""","""CCC(CC)(COCC1=NC(=NO1)C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FAAA22B24D18054C_D7FAF5842747F537_6039_UN""","""CCC(CC)(COCCC(N(C)CCC#N)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FA4B3DF4A3A64EBA_CCD0D868ACEC315F_6039_UN""","""CCC(CC)(COCC(N(CCCC)CC)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""844A83F52131D604_7F379CB2774612BD_6039_UN""","""CCC(CC)(COCCC(=O)N1CCCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""DF6C521AA1540F18_7DBE0DCB98733F26_6039_UN""","""CCC(CC)(COCC1=C(OC)C=CC(=C1)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A2C8E4280EC5F903_85D72FE2BA8862CA_6039_UN""","""CCC(CC)(COCCC(=O)N1CCOCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E8ADD019980E2064_706D40D500BC9478_6039_UN""","""CCC(CC)(COCC2=CC1=C(C=CC=C1)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""33138F0B6896D127_0236DCBA4EC6A6D2_6039_UN""","""CCC(CC)(COCC(N(CC)CCC#N)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A0D2AFDB05B85248_9BE822EEF4F39E96_6039_UN""","""CCC(CC)(COCC1=NC(=CS1)C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""60FF844FD2B6A7F9_766FA0FB2FD5D212_6039_UN""","""CCC(CC)(COCC1=NC=C(OCC)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BC23946D0743F5CF_D49DC5473B2AC58C_6039_UN""","""CCC(CC)(COCCC1CC(CC(C)C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1B31E6AD387EDE99_2DEDE778FADE6EBD_6039_UN""","""CCC(CC)(COCC(C1=C(N=C(C)O1)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E57CD7C61E3866C7_06FA340BA0836664_6039_UN""","""CCC(CC)(COCC(=O)NC1=NC=CN=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7FF148F36AE35BAD_4717D2AA70F644FB_6039_UN""","""CCC(CC)(COCC(=O)NC1=CN=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A2D7C6DD432110E5_1744BAA792F84583_6039_UN""","""CCC(CC)(COCC1=CC=CC(=N1)N(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""9B5336A275F6742D_BA90971BDB1933CF_6039_UN""","""CCC(CC)(COCC1=NN=C(C)[N]1C2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6F4A115F2C0D6602_28812DF09FED83D6_6039_UN""","""CCC(CC)(COCC2=CC1=C(C=CC=C1)S2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E64C646EB16305AB_11DF7D3CAAF8D993_6039_UN""","""CCC(CC)(COCCN1CC2CCC(C1)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A7F35AE2F9B131A2_127EC41E69087977_6039_UN""","""CCC(CC)(COCC1=CSC(=N1)C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""DA8F51B587253D23_1D22DA2CEE5A9C23_6039_UN""","""CCC(CC)(COCC1=NOC(=N1)C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0DC5934C0CB639FB_6BDA8685A146CB4F_6039_UN""","""CCC(CC)(COCC1=CC=CC(=N1)C(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""73415600365AD870_00DEDAA30C6050EF_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1F)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""627F06EC801AFB22_83B708677DCDA596_6039_UN""","""CCC(CC)(COCC1=NN=C([N]1CCC)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B0647D9DEB3171B9_554AF3F4854FADD1_6039_UN""","""CCC(CC)(COCC1=NN=C(C(C)C)[N]1C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6059FEF88642E53C_239E6D67883BB64A_6039_UN""","""CCC(CC)(COCC1=NC(=CC(=N1)OC)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""91C95E9845BD70ED_ABCF6383789FBC84_6039_UN""","""CCC(CC)(COCC(N1CCN(C)CC1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""503835A9047A55A6_A0308D749C4B8AFA_6039_UN""","""CCC(CC)(COCCCC1=CC=CC(=C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""01397C6FB10BED15_216AA9C818DB7F5D_6039_UN""","""CCC(CC)(COCC1=CC(=NC=C1)N(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""46DB2167F907F4EC_BE2CB048BA68DFA1_6039_UN""","""CCC(CC)(COCC1=NC(=CC(=C1)OC)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""9DFDB15D5A7811D8_D26DDB8C68AB6F76_6039_UN""","""CCC(CC)(COCC(NCCCN(C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A4ADB85F8D86CE89_480E311D1FE53E33_6039_UN""","""CCC(CC)(COCC1=NC=C([N]1C)[N](=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5648FA732D4C9937_D485A4FFC684C0F4_6039_UN""","""CCC(CC)(COCC2=NC1=C(N=CC=C1)S2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""69506EF616021BF6_522E2E2663D5428E_6039_UN""","""CCC(CC)(COCC1=CC=C(CCC)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F21617CB0A200710_EFFB615AF4D6A20C_6039_UN""","""CCC(CC)(COCCCC1=CC=C(C)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B47E187B8E7EE308_030DDE7716475E8B_6039_UN""","""CCC(CC)(COCC1=CC=C(C(F)F)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FEAECAF15AC6B4E2_0EF23C45BC452689_6039_UN""","""CCC(CC)(COCC(=O)NCC1=CC=CO1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5947BE22661B35A0_D40F411F67C70890_6039_UN""","""CCC(CC)(COCCCOC1CCCCO1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""9EA335D51C2C9D87_F85B6F78C2A81DF8_6039_UN""","""CCC(CC)(COCC(=O)NC1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""64EDAB72F86F5327_C0D1F317A3BE6486_6039_UN""","""CCC(CC)(COCC(=O)N(CC=C)CC=C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""65184969E11E0856_07DACE77900DAECA_6039_UN""","""CCC(CC)(COCC1=NN=N[N]1C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""3F7ABE215A138293_283487ADF0547107_6039_UN""","""CCC(CC)(COCC1=NN=N[N]1CC2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""360D6AE16E889C8E_33B62CB5AE149BB1_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1)[N](=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8CB20368AB52F188_26C3298740410121_6039_UN""","""CCC(CC)(COCC1=CC=C([N](=O)=O)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""9C013EF48765B185_FF5A859253B8524A_6039_UN""","""CCC(CC)(COCC1=C[N](C)N=C1C(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1C22510F021DE5BC_39FEF78AA46A2E91_6039_UN""","""CCC(CC)(COCCCCC1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7B6C70C6F9BBA381_5A0B2BDDC06AFE1D_6039_UN""","""CCC(CC)(COCC(N(CC)CC(=C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A587CADBD21C2E80_3ABCB5030F888BE6_6039_UN""","""CCC(CC)(COCC1=C(C)C=C(C=C1)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""21914F3F84FB2EF2_8236D6D5D3AEFE18_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1C#N)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A1102EC0122104D8_FC6C8C382B4A78CD_6039_UN""","""CCC(CC)(COCC1=C(C(F)(F)F)[NH]N=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""3EB50E78A1D4A14D_095DF0E95415D908_6039_UN""","""CCC(CC)(COCCN1CC[S](CC1)(=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""81F8EFBC4988528D_023733952B40CB3C_6039_UN""","""CCC(CC)(COCC1=NN=C([S](C)(=O)=O)S1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""923ABACAA7D9113D_8201BCA21E7A227C_6039_UN""","""CCC(CC)(COCC(N1CCCC1(C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""DD4E4951132A896E_C607CDF667FF9A08_6039_UN""","""CCC(CC)(COCC(=O)NC1(CCC1)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""AD93622CFEC5B051_7750C2765FADFE9A_6039_UN""","""CCC(CC)(COCC2CCC1(CCCC1)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""135946BB5B2B18F9_2B597ECD49682DEF_6039_UN""","""CCC(CC)(COCC(CCC(OCC)=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B7E5FDAD484C53F7_DF635284EFA20381_6039_UN""","""CCC(CC)(COCCCCC[S](CC)(=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4C547FB48C5F2FD2_B52AB7F7DBB07D72_6039_UN""","""CCC(CC)(COCC(=O)C1CC2CCC1C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""DF169FE40ECC367F_EB1CBC6AA6D22C2F_6039_UN""","""CCC(CC)(COCCCCN1CCOCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B966B7CC93D3233E_5CB5ECAB90E4188A_6039_UN""","""CCC(CC)(COCC1=CC(=C(C=C1)C#N)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1A5DD3D1734CDF77_25712ADB10BFA579_6039_UN""","""CCC(CC)(COCCCCC1(C)OCCO1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F7EF0F25D8D6D6AA_B7D90E7046979232_6039_UN""","""CCC(CC)(COCC2CCC1(CC1)C(=O)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BCCD8C9585055A43_55C8F93646B6666A_6039_UN""","""CCC(CC)(COCCC1=C(CC)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""61992F2EA09C6742_6F68F7DC8366B3E9_6039_UN""","""CCC(CC)(COCC2CC1=C(C=CC=C1)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""54C5EB974CEBB292_9552A9DE921BC539_6039_UN""","""CCC(CC)(COCC1=NN=C2[N]1CCCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E9AF875EABCB831B_1275323866ACFF0F_6039_UN""","""CCC(CC)(COCC(=O)C1CCCCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""739FD51CE2A1F1E4_90BDCF78A1109261_6039_UN""","""CCC(CC)(COCC1=NOC(=C1)C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""D7200DFCEAF5A5DA_66AA37915598E154_6039_UN""","""CCC(CC)(COCC(N1CCC(C)CC1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CC541581DDFAFBE6_D03089730C181CCC_6039_UN""","""CCC(CC)(COCC1=C(N=C(OC)N=C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""309FD920BCABE690_0ADB3D591F4D86F9_6039_UN""","""CCC(CC)(COCC1=NC=N[N]1C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""82F27E184AE901A2_3497B6066A7249F1_6039_UN""","""CCC(CC)(COCC1N(C(C)C)CCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""3E6105F6C5E77F7B_451B67EDD9E82F7C_6039_UN""","""CCC(CC)(COCCCCC1CCOCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A0ABF0531BB8CBB0_D30B3E595AF9C328_6039_UN""","""CCC(CC)(COCCCC1=CC(=NO1)CC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""36A801C0B1EADE06_C786EE4A1928AB0D_6039_UN""","""CCC(CC)(COCC(C1=CN=CC(=C1)F)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""19C52C9E190EDE60_B30B4E19803A0022_6039_UN""","""CCC(CC)(COCC(C(C(OC)=O)(C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0EB56E08EB4723EE_5C9CD281BD4C40AC_6039_UN""","""CCC(CC)(COCC1=C(C(OC)=O)C=NO1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0C27F441B9CD1959_7702A2F9C029474A_6039_UN""","""CCC(CC)(COCC1=NN=C2[N]1CCOC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4338DE4CF009E1A6_77379A664810F7C6_6039_UN""","""CCC(CC)(COCC(OC)C1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1CB314CCDDC5CBE5_F311A715E7023F15_6039_UN""","""CCC(CC)(COCC(C1=NC=CC(=C1)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6E45DEE43C9B423A_55F15ACDBB1AB056_6039_UN""","""CCC(CC)(COCC1=CC=C(COC)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C42FF6C11C9597D4_A2C90CFE416E0919_6039_UN""","""CCC(CC)(COCC1=N[NH]C(=N1)C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""99CCD59179B8E7C9_EECBCFDC26FC9E32_6039_UN""","""CCC(CC)(COCC1=NOC(=N1)CCOC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1CAD024F6F093271_6F92129ADF2C5E7D_6039_UN""","""CCC(CC)(COCC2=CC1=NON=C1C=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A6B80288DA799E54_624D322559BCF89B_6039_UN""","""CCC(CC)(COCC(C1=C(C)N=CC=C1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A4B01C1DA05225D4_282F888F91906AD2_6039_UN""","""CCC(CC)(COCC1=CC=N[N]1CC(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CB3E4FD7D027AB06_011E7086BAD1DC8B_6039_UN""","""CCC(CC)(COCCSCC1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""252429844F7C446D_5D14F95349CAA407_6039_UN""","""CCC(CC)(COCC1=CSC(=C1)C(OC)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5DA67360902BA9BD_061050DC81E0B1A0_6039_UN""","""CCC(CC)(COCC(CC(C)(C)C1CC1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1D3048F6A1C2E0C7_1D859EB1BD145F02_6039_UN""","""CCC(CC)(COCC(=O)C1CC[S](=O)(=O)C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5F5545880E968C0D_8EDF6BB609434CF0_6039_UN""","""CCC(CC)(COCC(=O)NCC1CCCO1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""3B63F7EEFC40A6DF_8E4805E4E6A0876B_6039_UN""","""CCC(CC)(COCC(=O)N1CCCCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A34B103D3521D0C1_F6C70EBCF0279839_6039_UN""","""CCC(CC)(COCC(N1CCCC(C)C1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""400FD32EC0DE7187_4772FAEC5281CBBF_6039_UN""","""CCC(CC)(COCC(N1CCCCC1C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""61B8E23A40EF0AD9_CDEB4CF29215336C_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1)C(C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B7BEC91612542B34_0C8CDE396561A61B_6039_UN""","""CCC(CC)(COCC1=C(C(O)=O)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FA63DBC1C641B0B3_3700C77BB78EC2BC_6039_UN""","""CCC(CC)(COCC1=CC(=CO1)C(OC)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""48D041BBDCB13996_D60526F951869368_6039_UN""","""CCC(CC)(COCC(NCCCCCC)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E592786A132B57D7_0BC1E37A19D930CC_6039_UN""","""CCC(CC)(COCC(NCCCOCC)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""54902FC7BD707861_A58C388B860769E1_6039_UN""","""CCC(CC)(COCC[S](=O)C1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""AA1A8EB5E0E47EF6_C71AD361443FA63F_6039_UN""","""CCC(CC)(COCC(NNC(C(C)C)=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""AC84330995466857_74B3212B69142946_6039_UN""","""CCC(CC)(COCC1=NC=N[N]1CC(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""687F6DA774CFCBF0_54E08E0328252111_6039_UN""","""CCC(CC)(COCCCC1=C(C)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6AD8FA9237DC3673_A60262B828FFF827_6039_UN""","""CCC(CC)(COCC(C1=C(F)C=NC=C1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""382D36754C2156A8_1212C6A8A2A40165_6039_UN""","""CCC(CC)(COCC1=NC(=CO1)C(OC)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""D51CEF284EC1471C_3A05A37DD481C505_6039_UN""","""CCC(CC)(COCC1=NC(=CS1)C(OC)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E9CE694B069856A5_1F7F9D7F924AD932_6039_UN""","""CCC(CC)(COCC1=CC(=C(OC)C=C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""669C53148706076E_F1BFDBD8000724E4_6039_UN""","""CCC(CC)(COCC(=O)N1CCNC(=O)C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C284937A219636ED_FB07E8C81B31BD79_6039_UN""","""CCC(CC)(COCC1=C([N](=O)=O)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F7CFC24D9EF6B4A9_0D8179F909AB90A4_6039_UN""","""CCC(CC)(COCC(=O)CC1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7E71FBDB042F0859_89DBB2C3C619AA4D_6039_UN""","""CCC(CC)(COCC1=C(N=C(CCC)O1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B48465D8A0F90F2E_4E5BB546975C5A8B_6039_UN""","""CCC(CC)(COCC1=CC2=C(C=C1)COC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E4D98DB98B989E7B_9D301E8AA3723F5E_6039_UN""","""CCC(CC)(COCCCC1=CC=CC(=C1)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""11163FCF417B750A_62CC461152551F41_6039_UN""","""CCC(CC)(COCC(C1=C(ON=C1C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A4D85B106F68948E_ED5576DF06D01F83_6039_UN""","""CCC(CC)(COCCC1=CC=CC(=C1F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1FEC7E1147898EA3_261234B91447AFC3_6039_UN""","""CCC(CC)(COCCCN1CCN(C)CC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""35C0B408803F1617_A31B0D156E6160B3_6039_UN""","""CCC(CC)(COCCNC(NC(C)(C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B441E87A0CA60620_7847A70D26478114_6039_UN""","""CCC(CC)(COCC(C1=CN=CC(=C1)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""069CEB59AD1CF3B9_FAAA03EC96C1AF9A_6039_UN""","""CCC(CC)(COCC1=NN=C(O1)C2CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CD3C9F2753408B87_3031100440B810D3_6039_UN""","""CCC(CC)(COCCC(=O)C1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""055BA28A4ED16894_8BE674228084B9E0_6039_UN""","""CCC(CC)(COCC1=CSC2=NCCCN12)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CE28B41E933E93D0_503A2AF4A9D9E1BD_6039_UN""","""CCC(CC)(COCCCCC[N]1N=CN=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""86528BCB9CB20817_2C5E2E585906F4B2_6039_UN""","""CCC(CC)(COCC1=C(C=CC(=C1)F)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E93728CFCF5574B5_6399659C2F5ED07D_6039_UN""","""CCC(CC)(COCC1=C(N(C)C)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C4F3207D22981474_333D2FEB5840D3F2_6039_UN""","""CCC(CC)(COCC1=CC=C(C(C)=O)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6409C27DEE399DAD_1BB28E1217A0D937_6039_UN""","""CCC(CC)(COCC1=CSC(=N1)C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5460130FC5AF15C4_2B24E2CADFA7D8B5_6039_UN""","""CCC(CC)(COCCOC1=CC=CC(=C1)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A31520945F3C898F_C1AB776B27BBCB2D_6039_UN""","""CCC(CC)(COCCC[N]1N=C(C)C=C1C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FA93A3366E757651_350CF4A16E192CB9_6039_DP""","""CCC(CC)(COCC1=NC(=NO1)C(N)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7F8AB91E9155ECF3_CC7313AE8F953387_6039_UN""","""CCC(CC)(COCC1=NOC(=N1)C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""D3E0246E852B61AD_0EE88D7D899ACA9C_6039_UN""","""CCC(CC)(COCC(N(C)CC(F)(F)F)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1EC68BB558F9524A_F99B98A814B4E694_6039_UN""","""CCC(CC)(COCC1=CN=C(N(C)C)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C5E50F96EB9EA81D_7592AB011A20DC67_6039_UN""","""CCC(CC)(COCC1=CC=C(C(OC)=O)O1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5F18E5348A486561_469222E34E77E333_6039_UN""","""CCC(CC)(COCCN1C(NC(C)C1=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""437ED4D639663FF9_3670B612E6CEC829_6039_UN""","""CCC(CC)(COCC1=CC=C(C=C1)N=[N]#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""EE670A586EA05999_BE3EB16700C763EA_6039_UN""","""CCC(CC)(COCCCC(NCC(C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""D75A689DD275BFCB_C392662BFE13B336_6039_UN""","""CCC(CC)(COCC1=CSC(=N1)C(OC)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8D9FD659C70FBDE6_532724D04EFA1ABA_6039_UN""","""CCC(CC)(COCC2CN(C1CC1)C(=O)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""ADC676FD350204BA_A16556367931C81E_6039_UN""","""CCC(CC)(COCCC1(CCCCC1)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0198716FFC5962AC_53C4E384A6847DF0_6039_UN""","""CCC(CC)(COCCCCCCCC(O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8CE1F88A09E69CB3_1046CC7E50F87EF0_6039_UN""","""CCC(CC)(COCCN1CC(OC(C)C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7CEB24E51415801C_5461E76CFA0D9524_6039_UN""","""CCC(CC)(COCC1=CC=C(C=C1)CC#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""65A2F68F0E7243F3_2E7A66DCFF192F6B_6039_UN""","""CCC(CC)(COCC1=NN=C(C(F)(F)F)S1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""89579AEA050F856C_0DBC695B323565BE_6039_UN""","""CCC(CC)(COCCN1CC(C)CC(C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F7CFB96EB5C0D3C9_3CF390F4E9B75125_6039_UN""","""CCC(CC)(COCCC1=C(F)C=CC=C1F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E7CAB156EF8BB63A_99F8350E3FE377CB_6039_UN""","""CCC(CC)(COCC(C1=N[N](CC)N=C1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6A70AE2D744CCE89_1B820D0877BE1CBB_6039_UN""","""CCC(CC)(COCC1=N[N](C(C)(C)C)N=N1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""28FE6D36597669F5_B05C2E18EB716FF7_6039_UN""","""CCC(CC)(COCCN1NC(=O)C=CC1=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""73D9937F19463009_438F8CE005150F1D_6039_UN""","""CCC(CC)(COCC(C1(C(OC)=O)CC1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CD3166F4A2B530D7_0DD2A8802FF31736_6039_UN""","""CCC(CC)(COCCN1C(CN(C)C1=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7C6E5093DD688FCA_25B64CD554C38124_6039_UN""","""CCC(CC)(COCC2=N[N]1CCCCC1=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""166B8924C5E2D3D3_F70B155318F6445E_6039_UN""","""CCC(CC)(COCC1CN=C(C(C)(C)C)O1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6B1B3862B64A9860_2C71858E02D23DC7_6039_UN""","""CCC(CC)(COCC1=C[N](C(C)(C)C)N=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F12B044C4EB95A9C_62AA3FB073015F61_6039_UN""","""CCC(CC)(COCC1=CC2=C(C=C1)C=N[NH]2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""248D7DFC95E0BB21_08290BDF449C3788_6039_UN""","""CCC(CC)(COCCSC1=CC=CC(=C1)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1AFD697B8A932704_F6D3AB8A638B80BE_6039_UN""","""CCC(CC)(COCCOCC1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4B0B6ECEFE121326_1625E88E8D500F73_6039_UN""","""CCC(CC)(COCC[P](N(C)C)(=O)N(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""40C1845EDCB9DD78_34F914C355383288_6039_UN""","""CCC(CC)(COCC(N=[S](N(C)C)(=O)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""290EC85AE027072D_B436A6B99FE90F20_6039_UN""","""CCC(CC)(COCCSC1=CC=CC(=C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C15FD14F09600A1E_6B015E82E05F9DC8_6039_UN""","""CCC(CC)(COCC1=NC(=N[N]1C)C2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""50E6B26B5432C0E6_431CA72FF2E01429_6039_UN""","""CCC(CC)(COCC1=COC(=C1)[S](N)(=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B9826A60D74299D2_2B3697FC61782391_6039_UN""","""CCC(CC)(COCC(OC)C1CCCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5F9B801958E35D05_B2BBA4D396B4C996_6039_UN""","""CCC(CC)(COCC1=CC(=C(C=N1)C)OC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""36DF756AC4324190_729FCF56FB1BEE1D_6039_UN""","""CCC(CC)(COCC1=CC(=NO1)C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E7C190CD167721D5_73ADAFDA094AC6F3_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1)C(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0CFA9EBC29A6BE31_7446A5309B64936B_6039_UN""","""CCC(CC)(COCC1=COC(=C1)[S](C)(=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B99896A4B1B00CB6_FA6A622EB0DE4CD8_6039_UN""","""CCC(CC)(COCCC#CC1=NC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F42A43E36FFB1728_BA4684FF0941CAA1_6039_UN""","""CCC(CC)(COCC1=CC(=CC=C1)N=[N]#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E57B40422025BC82_B43D06587B3B227E_6039_UN""","""CCC(CC)(COCC1=NC(=NO1)C2CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""EF17234FF188F563_BAD66B4C0CB9A9A4_6039_UN""","""CCC(CC)(COCC1=CC(=C(C)C=C1)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""28A8506E2C37633A_481482026AEDB884_6039_UN""","""CCC(CC)(COCC1=C(N=C(C)C=C1C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C8DBDB1058181595_2CB2BE765F030CFB_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1C)OC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E6A1BCFDD8BCBCB8_3A652888771CA760_6039_UN""","""CCC(CC)(COCC1=NC(=NO1)CC2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7DC91A0FCD1EB228_943757C09EEE54BD_6039_UN""","""CCC(CC)(COCC1=CC=C(C(C)(C)C)O1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5918E320CA482549_4F8BA3E37C30C32E_6039_UN""","""CCC(CC)(COCC1=C(C=CC=C1)N=[N]#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C87F499071C07CB0_7C47BDFBAA885B2A_6039_UN""","""CCC(CC)(COCC1=C(C(OC)=O)C=CS1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0140BFBC10800F72_493A13D65CE35E8A_6039_UN""","""CCC(CC)(COCC(=O)NC1=NC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""04B80123024BCCC4_A43648C55369FA5C_6039_UN""","""CCC(CC)(COCC2CC1(CCCC1)CO2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""930993098FAE5730_688F045CAAEC7DE1_6039_UN""","""CCC(CC)(COCC(C1=C(F)C=CC=C1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0526DDD8E00AA13D_93D7574896ADF02A_6039_UN""","""CCC(CC)(COCC1=CC(=CS1)C(OC)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B7AC92FBCE51417B_10E98C5D8BC21CF8_6039_UN""","""CCC(CC)(COCC2=NC1=C(CCOC1)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E4B0F04EEA344FD8_197F23EB0357B747_6039_UN""","""CCC(CC)(COCC1=CC(=CO1)C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""24508DD5A96545A7_E6583AB337802334_6039_UN""","""CCC(CC)(COCC2=NC1=C(CCCC1)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""13FF6442D2AF9C98_8ED243433C468227_6039_UN""","""CCC(CC)(COCC1=C([N](=O)=O)N=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""38025A5880A2FFFA_CB50ED1D9434FC62_6039_UN""","""CCC(CC)(COCC1=NOC(=N1)C2CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""EA74B9C0BACB499E_B21C74F45286B81A_6039_UN""","""CCC(CC)(COCC1=NC=C[N]1CC(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E47B493F1BD5EE03_C7DF37767CF8CD23_6039_UN""","""CCC(CC)(COCC2CCC1(CCC1)CO2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1D35B27F1F7FE8B2_F7E5B8254319B61B_6039_UN""","""CCC(CC)(COCC1=CN=C(N=C1)C2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""3A97D4FCE74F7651_0AE79E995E8D555A_6039_UN""","""CCC(CC)(COCC1=COC(=N1)C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""3B60F0477EBCD318_47E53B8448A4CD39_6039_UN""","""CCC(CC)(COCC(=O)NC1=NC=CC=N1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E306937E8A53C412_3899D587F4A935A1_6039_UN""","""CCC(CC)(COCC1=CC(=C(OC)C=C1)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5E865372EEB519A8_01756C86E9A12A3D_6039_UN""","""CCC(CC)(COCC1=CC2=C(C=C1)[NH]C=N2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B5D2B399265230C2_00DEDED0D1809958_6039_UN""","""CCC(CC)(COCCOC1=CC=C(F)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""394EC93AEBBCD3A3_BC039C3A97005138_6039_UN""","""CCC(CC)(COCC(C1=CC=CC(=C1)F)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0765DC39792A58EF_8425E5A6DC4141B0_6039_UN""","""CCC(CC)(COCC1=COC(=N1)C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CE95E3CB7FBC29C3_F21EB5685061850B_6039_DP""","""CCC(CC)(COCC2CC1(CNC1)C(O2)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F250E3A314CB748F_C64DCEBAE33F54CB_6039_UN""","""CCC(CC)(COCCSC1=C(F)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""562B145F0F745F54_B0628AF4EA734697_6039_UN""","""CCC(CC)(COCC1CCC(C(F)(F)F)O1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""70A7812BB4E4AC04_BF937BBCE7525E5D_6039_UN""","""CCC(CC)(COCC1=CC(=CC(=C1)C#N)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6CB32D3C326428ED_BC0A604A31E2CD42_6039_UN""","""CCC(CC)(COCC(=O)NC1CCCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B7115E6010EDB943_69E97B9413F00B0D_6039_UN""","""CCC(CC)(COCCOC1=C(F)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8353F9F942D45764_ED441A5A330AB9DB_6039_UN""","""CCC(CC)(COCCOC1=CC=CC(=C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""469306489BF69B59_10423E1F7591F953_6039_UN""","""CCC(CC)(COCC1=C(SCC)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""2042F5EBD112504E_C1CE95D5F457467F_6039_UN""","""CCC(CC)(COCC1=NC(=CO1)C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""41273A88661EC75D_921BDCBFBFE94A83_6039_UN""","""CCC(CC)(COCC1=C[N](C(C)C)N=C1C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""73F239773988DFB3_B7440508DAF44C1C_6039_UN""","""CCC(CC)(COCC2CCCC1(CCC1)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E562D46777963C5F_A71549E8E7EEFA0C_6039_UN""","""CCC(CC)(COCC1=NOC2=C1COCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""996C7AAE3C099DC7_3BBC503C0AF7E052_6039_UN""","""CCC(CC)(COCC1=CC=C(B(O)O)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""941AB57089C3314F_2C4C5B0EC810A523_6039_DP""","""CCC(CC)(COCC2OCC1(CCNC1)C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C5A368C7C5F2DF47_26521A41705511C9_6039_UN""","""CCC(CC)(COCC1=CC=N[N]1C2CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E34850A258C4780A_1083D0B211058552_6039_UN""","""CCC(CC)(COCC1=C(C(C)C)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""628737FA50BD774F_C0CA2C3F60C903BC_6039_UN""","""CCC(CC)(COCC(=O)C1=CC=CNC1=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""AE778EB16AA99E08_45D61372462C040E_6039_UN""","""CCC(CC)(COCC(C1=C(N=C(C)S1)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BB3120D2E4D66E3A_CE5B81F0C78F14FD_6039_UN""","""CCC(CC)(COCCCCC1(CCC1)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A74D7FF79AF8B682_74693745199EA8DA_6039_UN""","""CCC(CC)(COCC1=C(ON=C1C)C2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7E3E24464E2F6782_7AAE07D4EC61AD14_6039_DP""","""CCC(CC)(COCC1OC(CC12CNC2)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4C71547402101A5F_6A740E08FDA6958B_6039_UN""","""CCC(CC)(COCC1OC(=O)CC12CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C52A5FF12AB9D301_A51902060EECEC84_6039_DP""","""CCC(CC)(COCCC1(C(O)=O)CCOC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CF75B65E729F6976_E7F706AEDE92EA33_6039_UN""","""CCC(CC)(COCC(CC(OCC)=O)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E674653387294980_4793ADABAD18A74B_6039_UN""","""CCC(CC)(COCC1=C(CCC)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4D77CFAB498F0B9E_894F6A0EAF7EF4AC_6039_UN""","""CCC(CC)(COCCN1CCC(F)(CC1)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F1B9424805882DF1_BE46904A58889197_6039_UN""","""CCC(CC)(COCC(=O)NC1=NN=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E94B34493A13581D_D07F06B44E69415A_6039_UN""","""CCC(CC)(COCC1=N[NH]C2=C1COCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""2334A634BF3D046B_DDC6E967468F14D9_6039_UN""","""CCC(CC)(COCC1=C(C(F)F)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""7FC8715EE22B0A51_99B20020F72F8A39_6039_UN""","""CCC(CC)(COCC1=CSC(=N1)COCC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A5FDA7EAEB1138CC_2FF3BE025D6B722F_6039_UN""","""CCC(CC)(COCC2=C1C=CC=CC1=NO2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""ECEC177F41B3B05D_457E39ECF0C028CA_6039_UN""","""CCC(CC)(COCC1=CC2=C(C=C1)[NH]N=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C0FEDBE925052DA4_1A1EBB2D2D31449F_6039_UN""","""CCC(CC)(COCC12OCC(C)(CO1)CO2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E0CBE0FE0D6B2375_29A2C57C8280B816_6039_UN""","""CCC(CC)(COCC1=C([N](C)N=N1)C(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""048B1E8EA6ABEF1C_4476825E6ABFFBC3_6039_UN""","""CCC(CC)(COCC1=CC(=NC=C1)OCC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""AB28BB57F3571C53_93E8EFFA8540390F_6039_DP""","""CCC(CC)(COCC1=NC(=NO1)C2CNC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A6070AE91FBC7BDE_4476E81A2088B248_6039_UN""","""CCC(CC)(COCC[S](CCC(O)=O)(=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FF94C6BA6130D46D_9ACC99398DB033AA_6039_DP""","""CCC(CC)(COCC1=N[NH]C2=C1C=CC=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""DD90C3A09554C259_0B18480C309FA7AF_6039_UN""","""CCC(CC)(COCCO[S](C(F)(F)F)(=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8CD27528CFBA2C4B_4E7F9CC2BEA6273B_6039_UN""","""CCC(CC)(COCC2=C1SC=CC1=CC=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""79FDF70B74A69FE5_BB826B87DC99DC71_6039_UN""","""CCC(CC)(COCC1=CC=CC2=NC=N[N]12)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6969E3BF02486525_A9A7703398203109_6039_UN""","""CCC(CC)(COCC1CCC(F)(F)C(N1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B6EF11CBD9941FCB_B4923313A1A03968_6039_UN""","""CCC(CC)(COCC1=CC=C[N]2C1=NC=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6F0386AC02BA0C27_1692531CEA0720B5_6039_UN""","""CCC(CC)(COCC2CC1COCCC1O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""19FE5AEB8623C2DE_6F1A301166DFAB04_6039_UN""","""CCC(CC)(COCC(=O)CCC1CCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FE7EB76D8D3B4449_C7C7410380B6BD8F_6039_UN""","""CCC(CC)(COCC(C1=C(C)SC(=C1)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""39DDA115789985BE_77B86BA16EBCE701_6039_UN""","""CCC(CC)(COCCC[S](CCOC)(=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0EAF79517DBF890C_0C217A48AF6C3B06_6039_UN""","""CCC(CC)(COCC1=CSC(=N1)NC(C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""26132880E09C19FC_F991491D90048AF4_6039_UN""","""CCC(CC)(COCC1=NN=N[N]1C2CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8233A445819CAA8B_C74745200B0DA934_6039_UN""","""CCC(CC)(COCC1=NOC(=N1)CC(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1D6D89DB9C416E06_70F320F2569B9709_6039_UN""","""CCC(CC)(COCCOC1=C(C)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""2E9CA0D1734019CC_DB7F44DD2635C3F0_6039_UN""","""CCC(CC)(COCC1=NN=N[N]1CCCC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4CF2A7BF91137FB1_EC1F480369CAB14D_6039_UN""","""CCC(CC)(COCC1=NN=C(C(F)(F)F)O1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""43D8546C7143AB02_105991AB611578CD_6039_UN""","""CCC(CC)(COCC1=CC(=C(F)C=C1)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A3EE72C4151B8798_3FA3A3C4C30A3B3F_6039_UN""","""CCC(CC)(COCC1=C([S](C)(=O)=O)SC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""D65A500366D6B70F_4234CBED4AC551C4_6039_UN""","""CCC(CC)(COCC1=CC=C([S](C)(=O)=O)O1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""D6833B1B387E3D04_1A148D0D3F7AEE00_6039_UN""","""CCC(CC)(COCC1=NSC2=C1C=CC=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""545C6C3FCA843608_7E409611948D99A3_6039_UN""","""CCC(CC)(COCC1=C(OC=N1)C2CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""08F8E1C7EACD430C_4DEA0FC554B0D6CF_6039_UN""","""CCC(CC)(COCCOC1(CCOC1)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0CC9FCC09F562012_DC20A5C2A1CE2F98_6039_UN""","""CCC(CC)(COCCC1C2CCN(C1)CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""EDEB1F8485E562EE_AE398F4B8D31B1EB_6039_UN""","""CCC(CC)(COCC2=CC1=NC=N[N]1C=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""96657A7CC303FD2A_0A2F5EB35B69419F_6039_UN""","""CCC(CC)(COCC1=CC(=NO1)C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""826AC48DEACF9FEC_EA7276A14473ACBD_6039_UN""","""CCC(CC)(COCC1NC(=O)CC12CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""283265FF0F1832DF_7FDD1B2C01FA6D26_6039_UN""","""CCC(CC)(COCC2=NC1=C(CCCC1)[NH]2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8D422A15E9740566_E3A3EFC5BFCB6580_6039_UN""","""CCC(CC)(COCC1CCCC(O1)C2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F790311B3635010E_08D8EF8CF681BE96_6039_UN""","""CCC(CC)(COCC2=NC1=C(CCCC1)S2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BB906C73764B1636_A86C6536BBE17719_6039_UN""","""CCC(CC)(COCC2=CC1=NSN=C1C=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4C614E7C4818856E_FC28306B565D5327_6039_UN""","""CCC(CC)(COCC1=CC(=CC=C1)C2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""10E84BC579086965_D8E18DF8F43B0383_6039_UN""","""CCC(CC)(COCC(OC)C1CCCOC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F152248C49BAE25A_B3D13AC8BDCEC383_6039_UN""","""CCC(CC)(COCC1=CC=CC(=N1)CCC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""24F14493F6180FE8_B3829FB6EF14EE02_6039_UN""","""CCC(CC)(COCC1=CN=C(OC)C=C1C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6F8307C73ADC9C78_1B945AF08176A5D0_6039_UN""","""CCC(CC)(COCC1=CC=CC2=NC=C[N]12)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BFD56058ABC40999_C5B40CF8DB5C19E3_6039_UN""","""CCC(CC)(COC[C@@H]1O[C@H]1C2=CC=CC=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BBBD5C8BDBE4C36E_4B4C9E3A368CF519_6039_UN""","""CCC(CC)(COCC(C1=CC(=NC=C1)F)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""010340CA42FA5668_C356E2E0F59D6379_6039_UN""","""CCC(CC)(COCCC1=CC=CC(=C1)OC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6A11E9A2B27B81E1_74CCDD20C4A760B3_6039_DP""","""CCC(CC)(COCCOC1=CC=C(O)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5D2F07A20CFE8766_51886E27A8306D26_6039_UN""","""CCC(CC)(COCC2[N]1C=CN=C1CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FBDFB1185A5AD7E7_C3035023A1CE03CC_6039_UN""","""CCC(CC)(COCC1ON=C(C(C)(C)C)C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""939EC2D12DEE5174_67D72B6A6BE61C0E_6039_UN""","""CCC(CC)(COCC2CCC1(CCOC1)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4C7FFF8CA995BE41_3DCFFFFB8316E413_6039_UN""","""CCC(CC)(COCC(C1=N[N](C(=C1)C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FB9BC724273B3E0B_1A8B0892DB5A689B_6039_UN""","""CCC(CC)(COCC2=NC1=C(COCC1)S2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F288AAA7500B4F6F_A262B47E34B7551C_6039_UN""","""CCC(CC)(COCCC1CC(C)(C)NC1=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""51187F8490A0186B_3FC4E1D4495EBFCC_6039_UN""","""CCC(CC)(COCCC1=C(OC)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""AF78AFA8F1246540_CAFE430E5D2EFB4C_6039_UN""","""CCC(CC)(COCC(N(C)C1CCCC1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""DDDA16A649326EBB_D457EDE2C63D0051_6039_UN""","""CCC(CC)(COCC1=C(C=CC(=C1)OC)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""EFDBE58C3FFB87E5_84B912072EC2DEDA_6039_UN""","""CCC(CC)(COCC1=NC=C(C(O)=O)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""207946D678C580BE_7CD84D4FE8EAA7CE_6039_UN""","""CCC(CC)(COCC(C1C(C)(C)C1(C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B220F7C42AEF6321_8C2A2A12AB8F806B_6039_UN""","""CCC(CC)(COCC1=CC(=CC=C1)CC=C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""81CEF1B623E94793_2C921DE0B248CF94_6039_UN""","""CCC(CC)(COCC1=C(C=CC(=C1F)C)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F954B3AB81009A0E_4BE55468C502855E_6039_UN""","""CCC(CC)(COCC1=C(C(C)C)ON=C1C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""618212900FE874EC_D4C4B7F73CCBB4D0_6039_UN""","""CCC(CC)(COCCO[Si](C(C)(C)C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5F03856C1EDB2B51_65727803D42AF56A_6039_UN""","""CCC(CC)(COCCC[S](C(C)(C)C)(=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""72B971397CF298C7_D78BB7B14E6653EB_6039_UN""","""CCC(CC)(COCC1=C(OC)C=CC=C1F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4698C1DD2273C27C_7746C58EE1F6D1B6_6039_UN""","""CCC(CC)(COCC(C1=C[N](CC)N=C1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0D2BC5B4953E7127_FD639864C5A10016_6039_UN""","""CCC(CC)(COCCOC[P](OC)(=O)OC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""098C65A0A4FD2BD0_F4B50B0D4205C89B_6039_DP""","""CCC(CC)(COCC2CC1(CCN1)C(O2)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""18BFFC47DBDF0A41_7BA423183556BC2B_6039_UN""","""CCC(CC)(COCC1=C(C(F)(F)F)OC=N1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""2905CFCBAE86DCF9_2C5CA49B6B17B51F_6039_UN""","""CCC(CC)(COCC(C1=CC(=N[N]1C)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""97C6B21489D0E7FC_E8C4B33666182D16_6039_UN""","""CCC(CC)(COCC(=O)C1=CNC(C=C1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""99C42C41921A550D_E3D759B784F3BCDE_6039_UN""","""CCC(CC)(COCC1=C(C=C(OC)C=C1)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5B0675386C7BEF96_47AE5A798DB2D4C9_6039_UN""","""CCC(CC)(COCCC1=C(C=C(C)C=C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CEBD61365418D8BC_27C28D136C4F54E5_6039_UN""","""CCC(CC)(COCC1=NC(=NO1)C(C)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A6323D1E446BE324_4B3467EA65DA5868_6039_UN""","""CCC(CC)(COCC2CC1CCCCC1O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""66E2795D0CBABDBC_36A3C4DFC681820C_6039_UN""","""CCC(CC)(COCC1=CON=C1C(C)(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""544B4C5CB36C7921_3FCB85AA99F2A531_6039_DP""","""CCC(CC)(COCC2=C(C1CNC1)OC=N2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A07572FA84E49693_99E96E9C8BF6EFBE_6039_UN""","""CCC(CC)(COCCCN1CCOCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4F8BD7B89B58C1EC_1FE2732D9BA5C6C1_6039_UN""","""CCC(CC)(COCC2COC1=CSC=C1O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""236CCB32F7CC1E43_0D674F9A6002C07E_6039_UN""","""CCC(CC)(COCC1=C(C=CC=C1)CC=C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""52DF7E827663EA9E_F65C3AF4A3C09697_6039_UN""","""CCC(CC)(COCC1=CON=C1C2CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8FBDA4E836798BD9_C6B3EEC468BEE0B9_6039_UN""","""CCC(CC)(COCCC=CC1=CC=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E4EEB09AD31E6EBD_D091CEC56EE0D9A1_6039_UN""","""CCC(CC)(COCCCN[S](=O)(=O)C1CC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""91380F2EBAFB211C_8B9E008E04A8BF98_6039_UN""","""CCC(CC)(COCC1=C[N](C(C)(C)C)N=N1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""90952A1E6EBF2A8D_8E2E5F3A79BF89AF_6039_UN""","""CCC(CC)(COCC(C1=C(C)C=CC=C1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""2C76B73DC87E1F70_8FFBCAA3E4E9C8BC_6039_DP""","""CCC(CC)(COCC2CC1(CCNCC1)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""505573F665F2F62E_706B607263A22CF0_6039_UN""","""CCC(CC)(COCCC1(C(F)(F)F)CCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8228DB7AD7ABC0C4_CF27A1641B2CEE5A_6039_UN""","""CCC(CC)(COCC1=CSC=C1C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8E833391D21DA93E_C9DDE60647311DAD_6039_UN""","""CCC(CC)(COCCN1C(C)(COCC1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CB3F10266CA6E916_DC4D9A01E8B4FAD2_6039_UN""","""CCC(CC)(COCC1=C([S](C)(=O)=O)C=CS1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BCEDC7A3A19D2B00_6CF0D5DF04C6FADA_6039_UN""","""CCC(CC)(COCC1=C(OC)C=CC(=N1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""3EB50E78A1D4A14D_8546EFA5E0043033_6039_UN""","""CCC(CC)(COCCN1CC[S](=O)(=O)CC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""89B30A7C5868FE98_9DDCBC5E3EA1451A_6039_UN""","""CCC(CC)(COCC1=NSC(=C1)C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""DD3D7752910006CD_33674B6A26A2163F_6039_UN""","""CCC(CC)(COCC1=C(N=C(OC)C=C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C208039D188FEC2A_00CA2BA5BFE7626E_6039_UN""","""CCC(CC)(COCC1=CSC(=C1)C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6048652DFD3CAB30_8758DE0520F8D821_6039_UN""","""CCC(CC)(COCCCCCC1OCCO1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C9A5AEEB97D56E7E_B0745EC139FF9FC0_6039_UN""","""CCC(CC)(COCC2CC1(CC1)[S](=O)(=O)N2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""364F8FB50F07D145_0D896B025591CD3A_6039_UN""","""CCC(CC)(COCC1=CC2=C(C=C1)N=N[NH]2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0A4D7F26249A698D_D739E6448E5A70EA_6039_UN""","""CCC(CC)(COCC1=CC=CC2=CC=N[N]12)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""376EA7188CC1B6DF_D8DD862781B8AB8F_6039_UN""","""CCC(CC)(COCC1=C(COC)C=CC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""3E1D89015B6EE0D1_234E45F414D9E494_6039_UN""","""CCC(CC)(COCCCC1=C(C)C=CN=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""4AFF65ED13173ADB_F09E262E4590E715_6039_UN""","""CCC(CC)(COCC1=NC(C(OC)=O)CO1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""D2248AC202B1E9B9_7F4687B76D3F897B_6039_UN""","""CCC(CC)(COCC1=NC(=CC=C1)CC#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CCE905B7461AF45C_C296ACAFCADCD672_6039_UN""","""CCC(CC)(COCC1=CC(=CS1)C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""5AFB21B7DE3BC6A7_F28FE7F78F51B399_6039_UN""","""CCC(CC)(COCC1=N[N](C)C=C1[N](=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F3714C9586929483_E9296BC2289FAA1D_6039_DP""","""CCC(CC)(COCC1=CC(=NO1)C2CNC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""ECF85A17F4ECB993_8CED652BA9C8998D_6039_UN""","""CCC(CC)(COCC1=CC2=C(C=C1)C=CO2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""091FF8E0CFA5947B_4B435B36390D7947_6039_DP""","""CCC(CC)(COCC(N1CCNCC1C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CD1FC4D05429D184_5A747AE1566E0EF4_6039_DP""","""CCC(CC)(COCC(NC1CCNCC1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""418D837DD6EDA3D2_B5102B0492DC4727_6039_DP""","""CCC(CC)(COCCC1(CCNCC1)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""273F10DE08639207_0DD63E7CE1C76AE7_6039_UN""","""CCC(CC)(COCC1=NN=C2C=CC=N[N]12)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""30C71A16276B6D1C_34DD6B1639138E3D_6039_DP""","""CCC(CC)(COCC2=CC1=C(CNC1)C=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F85F528AACF0CE0A_2C905C4889F55884_6039_UN""","""CCC(CC)(COCC1=NCC(C(OC)=O)O1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F9951C05506B1AC1_47F0FDF132A5441C_6039_UN""","""CCC(CC)(COCCNC(=O)N1CCCC1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""05D215B6830FD06F_5711E00391B2BAFA_6039_UN""","""CCC(CC)(COCC1=NOC(=C1)CC(C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""96418930721F7C1C_E45E72461774ABF0_6039_UN""","""CCC(CC)(COCC1=N[NH]C(=C1)C(OC)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""88D6053330548DD2_ECF155A99AF2995D_6039_DP""","""CCC(CC)(COCC(N1CC(C)NCC1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""EDAA305447511A05_38738F949074F4C6_6039_UN""","""CCC(CC)(COCC2=CC1=C(C=CC=N1)S2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A2FE64BE099EF3DA_B1E058165EC7F1A2_6039_UN""","""CCC(CC)(COCC1=CC(=NC(=C1)C)OC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BD6593080AA0C617_F5B8D485CA6F51E9_6039_DP""","""CCC(CC)(COCC1CNCC2(O1)CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""728A5B045832321B_FFA7EEF2A1BE8B54_6039_UN""","""CCC(CC)(COCC1=CC(=NC(=N1)OC)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""35625672727F339F_DAD34C90A2ADE1BC_6039_UN""","""CCC(CC)(COCCN1CCCO[P]1(N)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""EAD14D0BFA1933A9_1DB440484F106C87_6039_DP""","""CCC(CC)(COCC1=N[NH]C2=C1CNCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FB322316FF3775F4_DADC839917EA7FC5_6039_UN""","""CCC(CC)(COCC1=C2C(=N[NH]1)CCCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""820EBDB647B1CBB7_606E1C5CB87D0AC5_6039_UN""","""CCC(CC)(COCCC1=C([N](N=C1C)C)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C5E87F48D149F81A_D5575F7FEAA8C59C_6039_UN""","""CCC(CC)(COCC1=C(C(OC)=O)SN=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""B11C6D192F82FD65_D31DE5B37D00A39E_6039_UN""","""CCC(CC)(COCC1=C(C(F)F)C=NC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""71B90DEC0527C95B_5FD3229A7623B58C_6039_UN""","""CCC(CC)(COCC1=C(C(F)(F)F)SC=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""215677ED0207AA56_C6056A974E6A8326_6039_UN""","""CCC(CC)(COCC(C1(C(F)(F)F)CC1)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""ECCDA0F9251B06AD_F6CF94CB917F6480_6039_DP""","""CCC(CC)(COCC1CNC2(CO1)CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F66DA322553B2E32_B2BC369378410138_6039_UN""","""CCC(CC)(COCC1=C(C(C)(C)C)OC=N1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""413316DAA140BAD2_B2B31591E0530CC0_6039_UN""","""CCC(CC)(COCCOCCOCCOC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""936988E5F7669AEA_7A7BA0F788E09203_6039_UN""","""CCC(CC)(COCC1=NN=C(C(F)(F)Cl)S1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BEF8D1DA32C29298_586AEBB8150338B0_6039_UN""","""CCC(CC)(COCCC(C(OCC)=O)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""3DE5C8A577E93CA0_34BED3EFB88E27AC_6039_UN""","""CCC(CC)(COCC1=C(SN=C1OC)OC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""00302B2E0E521B09_3BDC8CBFE92618B8_6039_UN""","""CCC(CC)(COCC1=NOC(=C1)CC2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""ED37EF9826F703A6_7A1B6324E9EA2A7B_6039_UN""","""CCC(CC)(COCC1=CC2=C(C=C1)OCO2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F567D30D6CE84DBF_119207693ECF8F81_6039_UN""","""CCC(CC)(COCC1=NC(=C[NH]1)C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""45FF6577468D716E_68938CA5C7FAD22E_6039_UN""","""CCC(CC)(COCC1=NO[C@@H]2CCCC[C@H]12)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BCC2BA66973452A2_E59A0FD88BF29A34_6039_UN""","""CCC(CC)(COCC1=CC=NC(=N1)COC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""002635910B7BB9B2_718F139B3AFC68DB_6039_DP""","""CCC(CC)(COCCC2CC1CCC(N1)C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""935D78C3A6C698DA_D19105BFA1640C6A_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1)C(N)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""D278E713206E2537_14F9A22851DF3411_6039_UN""","""CCC(CC)(COCC1=CC=C(C(OC)=O)S1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""D49E24D7BA349661_0C29753EC7F10B01_6039_UN""","""CCC(CC)(COCC(NCCCC(O)=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""CAF5817A0EFED719_6469A143898B4167_6039_UN""","""CCC(CC)(COCC(=O)NCC1=CC=CS1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""DB382F66AD07C791_2E2579F45689C6AF_6039_UN""","""CCC(CC)(COCC1=CC=CC2=NON=C12)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""8C861D14284480FC_3ECD78AA374C748F_6039_UN""","""CCC(CC)(COCC2=C[N]1C=CC=NC1=N2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""34CD36DA0686237A_A15F066AFBEA100A_6039_UN""","""CCC(CC)(COCCOC1CCCCC1C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""971591FA5E7AE852_73E1A69F098EBEA0_6039_DP""","""CCC(CC)(COCC2=CC1=C(C=C[NH]1)C=C2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""10B2846C4447E770_F49B88796B75F077_6039_UN""","""CCC(CC)(COCC1=C(C(=NO1)C)[N](=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0119BD521F870BE6_1293E3E35ED9712C_6039_UN""","""CCC(CC)(COCCOC1=CC=C(C)C=C1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""3738EDD14C4C8E61_1911524C97226C37_6039_UN""","""CCC(CC)(COCCOCC(C(F)F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C5020CABE26E2B14_FFF52557E86E875F_6039_UN""","""CCC(CC)(COCC(NC(NCCC)=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A6E7C46590C65BCF_59E6431D229E1B89_6039_UN""","""CCC(CC)(COCC1=NN=C([N]1C)C2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C6684AA420B86078_0E8C0EDDD7FF2F06_6039_UN""","""CCC(CC)(COCC1=NN=C(S1)C2CCC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""F80E949DD230E370_C5B9A7AD92742524_6039_UN""","""CCC(CC)(COCC1=CC=CC(=C1)C(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""01F600826857DFDC_7CF3ED577CF10771_6039_UN""","""CCC(CC)(COCC1=CC(=C(C=C1)C)OC)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""E3BD52E57675D9CE_64C4DD3794C8F32E_6039_UN""","""CCC(CC)(COCC1=C(C=CC=C1)C2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""DFEA24EA11E6C385_7E1F844F53AF3E33_6039_UN""","""CCC(CC)(COCC2CC1(CCC1)C(=O)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""BEB2764F4D7AE03C_4691C28261F19CD8_6039_UN""","""CCC(CC)(COCC(NCC(C(C)C)=O)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""854E8A6E7C51645C_C38A9A01643ABBB2_6039_UN""","""CCC(CC)(COCC2=NC1=C(C=CC=N1)O2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""9EF96971BBFC1732_7EACA5D16BB09269_6039_UN""","""CCC(CC)(COCCC1=CC=C(C=C1)C#N)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""987E5978F3723F96_2CA18C1E9CB0E7D0_6039_UN""","""CCC(CC)(COCC1=CC(=C(C=C1)C#N)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""C5F831450E9ECEE2_45E80AA650F6CFCF_6039_UN""","""CCC(CC)(COCCCN1C(=O)CNC1=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""FEA9967E2C1CE700_35377E35F3A28636_6039_UN""","""CCC(CC)(COCC1=CC=C(C=C1)C2CC2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""A1970C92B75E7C20_1F6084012737A834_6039_UN""","""CCC(CC)(COCC1=NC=N[N]1CC(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""EE936F09A05B6591_570C6588FCC577C0_6039_UN""","""CCC(CC)(COCC1=CC(=C(OC)N=C1)C)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""6D8D3938B179030F_F9F2DB0FC02DECA6_6039_DP""","""CCC(CC)(COCC2=NN=C(C1CNC1)S2)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""9A31410B4C2A8C9C_262ABDEF26022070_6039_UN""","""CCC(CC)(COCC(C1=C(C)[N](N=C1)C)=O)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""0999342559F1CB02_3A2B6CEAE9D88E30_6039_UN""","""CCC(CC)(COCC1=CC=C(C(F)(F)F)S1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1AB8F50744B48F8D_1A769FB048BFBBD1_6039_UN""","""CCC(CC)(COC[C@H]1CC[C@@H](C(OC)=O)O1)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""66A3FA99D80C8776_654F718798EAEBF9_6039_UN""","""CCC(CC)(COCC1=CON=C1C(F)(F)F)C(F)(F)F""",21,"""029A366A0E92FF3E"""
+"""1DD95040E7210483_3BA73BA2CF06012E_6039_UN""","""O(CC2CCC1=NN=N[N]1CC2)CC(NCC(OC)=O)=O""",21,"""A8C8029FF0B20A61"""
+"""F2AE4108222D8C71_6E19BBE90C0A9E58_6039_UN""","""O(CC2CCC1=NN=N[N]1CC2)CC(=O)N3CCNC3=O""",21,"""A8C8029FF0B20A61"""
+"""B9949146C6B555E7_134157EE8AA79AF9_6039_UN""","""O(CC2CCC1=NN=N[N]1CC2)CC3=CC=C(SC)C=C3""",21,"""A8C8029FF0B20A61"""
+"""057BAC06D5B21A2F_570BB3A21EFAF675_6039_UN""","""O(CC2CCC1=NN=N[N]1CC2)CC(NC(NCC)=O)=O""",21,"""A8C8029FF0B20A61"""
+"""E840A603DCD958AF_57E53F399B6D3A47_6039_UN""","""O(CC2CCC1=NN=N[N]1CC2)CC(NC(C(C)C)=O)=O""",21,"""A8C8029FF0B20A61"""
+"""EFD8AA3485A64251_C314ABA79E520A02_6039_UN""","""O(CC2CCC1=NN=N[N]1CC2)CC=NNC(C(C)C)=O""",21,"""A8C8029FF0B20A61"""
+"""80CC82FDCA367922_26B6BDB47D73FABA_6039_UN""","""O(CC2CCC1=NN=N[N]1CC2)CC3=CC(=CC=C3)C#N""",21,"""A8C8029FF0B20A61"""
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+"""057282489994102C_641AD9940159853F_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCN2CCOCC2=O""",21,"""39F2C8397A413030"""
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+"""1579B8E2BD40279C_F8BE2B62DB292985_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(N=C(CC)O2)C""",21,"""39F2C8397A413030"""
+"""D658D955C94D50F2_24D702B9F866110D_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CC(=NO2)C(C)C""",21,"""39F2C8397A413030"""
+"""216398B14BA2C518_3B861D2C3C28D245_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=N[N](CCC)C=C2""",21,"""39F2C8397A413030"""
+"""2F98F60BC120F219_A8F88C543BBAAB3A_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(=O)N2CCOCC2""",21,"""39F2C8397A413030"""
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+"""75D93B9EF8F9F6AF_7806FD8293976FEB_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(=O)N2CCCC2=O""",21,"""39F2C8397A413030"""
+"""CBECD445577CC70B_5BEA6ED5C91E0F0F_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=NC=CC(=C2)OC""",21,"""39F2C8397A413030"""
+"""5C81A4D19E695278_864BF295717A6A04_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCCCN2CCCC2""",21,"""39F2C8397A413030"""
+"""7327C138A30283D2_4ABA5B3550ADD62C_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=NC=CC(=N2)OC""",21,"""39F2C8397A413030"""
+"""E1A1610DF12AECE1_69EF2073EF61AE50_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(N=C(C)C=N2)C""",21,"""39F2C8397A413030"""
+"""BCC6F4676E5062BB_DC81C5D94ED45327_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCCC(C(OC)=O)=O""",21,"""39F2C8397A413030"""
+"""91B541C497CD1422_8DAE00B489FDF0C0_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(=O)C2=NC=CN=C2""",21,"""39F2C8397A413030"""
+"""1A856DC3900D26CF_CC517534B87E788F_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC[N]2N=C(C)C=C2C""",21,"""39F2C8397A413030"""
+"""3685892ED3CEAC01_902E1DF1D96D582F_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=N[N](CC)N=C2C""",21,"""39F2C8397A413030"""
+"""875BCB17DF6308CE_4F95C4BA6806E5EA_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(OCC(F)(F)F)=O""",21,"""39F2C8397A413030"""
+"""DD43FC758D3FAEAD_05A1F6F8DAEE0CE4_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(C=CC(=C2)C)F""",21,"""39F2C8397A413030"""
+"""ABEDC65AB71A2692_FD9E50416B48CAEC_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(C2=CN=N[N]2C)=O""",21,"""39F2C8397A413030"""
+"""BBCFFE1B5191EA1A_F5C8C4794FBC5586_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=NC=N[N]2CCC""",21,"""39F2C8397A413030"""
+"""9712630C36DEB183_998472C85A49F510_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCCC2CCOCC2""",21,"""39F2C8397A413030"""
+"""423AA3DD69F62C1A_979D76894DF93B0E_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCCCCC(C)(C)C""",21,"""39F2C8397A413030"""
+"""1DDB494232BFA616_7E1B17A9246E71C4_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(C=CC(=C2)C)C""",21,"""39F2C8397A413030"""
+"""6C6254B7666176F4_64AED35FB2992F0E_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=N[NH]C(=N2)C(C)C""",21,"""39F2C8397A413030"""
+"""7CD3CC88B402AABD_3AF30907A8D47B53_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2=C(F)C=CC=C2""",21,"""39F2C8397A413030"""
+"""89823A905724000C_171397917C1D4454_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CC(=NC(=N2)C)C""",21,"""39F2C8397A413030"""
+"""910AC86322A8254A_B6971D8AA6BFCA4B_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=NC=CC(=C2)C#N""",21,"""39F2C8397A413030"""
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+"""488A270EE1B503EE_136311E49F66EA91_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC3CC2CCCC2O3""",21,"""39F2C8397A413030"""
+"""F03FF2AF4E472901_07520D75B3919129_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(C)C(NC2=O)=O""",21,"""39F2C8397A413030"""
+"""0E0EBECD8617D3E4_7B1B22524AB4271B_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2CCC(O2)C3CC3""",21,"""39F2C8397A413030"""
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+"""FD512613A60FE292_33235F86A7BAC842_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(NC(CC)CC)=O""",21,"""39F2C8397A413030"""
+"""EFCCF17DF6C3370E_B0DD5D175FD98043_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(NCCCOC)=O""",21,"""39F2C8397A413030"""
+"""599CAD881AA67195_2C58D791DD9C05BC_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(NC(CCC)C)=O""",21,"""39F2C8397A413030"""
+"""417E434787B0DCAD_38AC7952B22058CB_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(NC(C(C)C)C)=O""",21,"""39F2C8397A413030"""
+"""9FB5F833EA330BED_40D5D70E52F30A2B_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CC(=NN=C2C)C""",21,"""39F2C8397A413030"""
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+"""59BCC4A109B8D949_0825275A4B9D5B43_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=NC(=C(S2)C)OC""",21,"""39F2C8397A413030"""
+"""E629291CB7694223_90477D9641455E7C_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=NC(=CC(=C2)C)C""",21,"""39F2C8397A413030"""
+"""8A23C6BBCB85F0D6_20CDA81122B15062_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C[N](CCF)N=C2""",21,"""39F2C8397A413030"""
+"""70A52D04AC99F9D7_5E12AE707575537F_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2=CC=CC(=C2)F""",21,"""39F2C8397A413030"""
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+"""4AB19107DE0A9407_FB404B624C82AF87_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2=C(C)C=CC=C2""",21,"""39F2C8397A413030"""
+"""AEDC4CBB3FD63584_75E40E7E784A2FE0_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2=CC=C(F)C=C2""",21,"""39F2C8397A413030"""
+"""981725A1DC4C6662_F289027782FF8246_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCCC2CCCCC2""",21,"""39F2C8397A413030"""
+"""E12ECC9AEADDD530_33D721A51E5B2A90_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2CC3CCC2C3""",21,"""39F2C8397A413030"""
+"""2C938226EECE49B5_49B2F424C04EA5AE_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC3CCC2(COC2)O3""",21,"""39F2C8397A413030"""
+"""C0B05EF768A56F60_B0F61A8EC2B766A0_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(F)C=NC=C2F""",21,"""39F2C8397A413030"""
+"""DF7F6F7E448A07DD_E30768959895A2C1_6039_DP""","""CNC(=O)OC1=CC(=CC=C1)OCCC2(C(O)=O)CCC2""",21,"""39F2C8397A413030"""
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+"""B05AABAAB7D7FF0C_8816DD1DC1AF3997_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCOC2CCSCC2""",21,"""39F2C8397A413030"""
+"""4A2CA06704ECFCF7_D0ED134C02C14E64_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(C(OCC)=O)(F)F""",21,"""39F2C8397A413030"""
+"""87230D39A131E130_8DBE08E5F1748187_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CON=C2C(C)C""",21,"""39F2C8397A413030"""
+"""BB3326F864D178FE_762D4960610DF7F3_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CON=C2C3CC3""",21,"""39F2C8397A413030"""
+"""7AF46EB1F17DD570_FC5D9A4D72442721_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2=CN=CC(=C2)F""",21,"""39F2C8397A413030"""
+"""7EC5D56148DE6AF3_D900051D2A262727_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2OCCC23CCC3""",21,"""39F2C8397A413030"""
+"""833E1E45FF3253C4_414D4D64F5C29F25_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(C=C(C)C=C2)F""",21,"""39F2C8397A413030"""
+"""739107CE115FD795_0398C2C508BAAB55_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(=O)C2CCCCO2""",21,"""39F2C8397A413030"""
+"""0FA7136902925DD4_9A6C6BC8AEA3EF47_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(=O)C2=CC=NC=C2""",21,"""39F2C8397A413030"""
+"""9CDBC1AA30BD97ED_19234CBFC8D763BF_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2N(C)[S](CC2)(=O)=O""",21,"""39F2C8397A413030"""
+"""67BBAA9F65D159E6_CDFEC5B97BEDE907_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCOC2(CCC2)C#N""",21,"""39F2C8397A413030"""
+"""15D4D104DCA7FD11_4C8675480BC8A98A_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2NC(CC2(C)C)=O""",21,"""39F2C8397A413030"""
+"""E60C847260530113_DD9322B4F8B5170D_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2OCC3CCOC23""",21,"""39F2C8397A413030"""
+"""EA23A4211B0EB1E4_22E6C094E09BAE3C_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2COCC(C)(C)O2""",21,"""39F2C8397A413030"""
+"""3F48E1AA54E4963E_1C55D881690F00D8_6039_DP""","""CNC(=O)OC1=CC(=CC=C1)OCC2OCCC23CNC3""",21,"""39F2C8397A413030"""
+"""D4F5B24E1C6C90DC_AE739B292C2EAD4F_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OC[C@@H]3C[C@H]2COC[C@H]2O3""",21,"""39F2C8397A413030"""
+"""7B619C1853CFC480_2017BE48056FB74A_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC#CC2CCCCC2""",21,"""39F2C8397A413030"""
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+"""59B3E916FD4CEB2F_7E9EBB1BD326E3F4_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(F)C2=CC=CC=C2""",21,"""39F2C8397A413030"""
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+"""C85595AE53EB7F3F_01A6BFABB22F78F5_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CN=CC(=N2)OC""",21,"""39F2C8397A413030"""
+"""D92E131050F81BF8_310FE03A8A40C962_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2OC(CC2(C)C)=O""",21,"""39F2C8397A413030"""
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+"""50B905D7A5C19B03_D274600BFDDFAB86_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CC(=CC(=C2)F)F""",21,"""39F2C8397A413030"""
+"""B6851D54756D5862_45A6F293490E6911_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2=C[N](CC)N=C2""",21,"""39F2C8397A413030"""
+"""0B69DFC45A37CD8B_5F6AEBB52B3AF1B9_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC3CC2(CC2)C(=O)O3""",21,"""39F2C8397A413030"""
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+"""D35722ADB5EE96C6_8AD341FCBB66230A_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CC(=C(C=C2)F)C""",21,"""39F2C8397A413030"""
+"""3F589A1E5B752796_C87A1469A7B9077B_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2N(C)CC(C2)(C)C""",21,"""39F2C8397A413030"""
+"""7C04770A130013B9_2537194C2A2F495A_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(C2CC(F)(F)C2)=O""",21,"""39F2C8397A413030"""
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+"""0BDEA4F5B0E437AD_96BCD33FF473841D_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC(=O)N2CCCC2""",21,"""39F2C8397A413030"""
+"""FFE8486F04D8E89F_F6D5875BAEC11C3B_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CC(=CC=C2)C#C""",21,"""39F2C8397A413030"""
+"""4AD74ACF0C5CB669_5BE908F74B187B2C_6039_DP""","""CNC(=O)OC1=CC(=CC=C1)OCC([C@@H](N)C(C)(C)C)=O""",21,"""39F2C8397A413030"""
+"""1C17CB769485BF23_E6135304B08A73F0_6039_DP""","""CNC(=O)OC1=CC(=CC=C1)OCCCN2CCNCC2""",21,"""39F2C8397A413030"""
+"""1BBF696F2149AA46_6403F70CFA9BD7B7_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=NOC(=C2)COC""",21,"""39F2C8397A413030"""
+"""7D1793DA2B99BB81_D7F2699FFB79D9F6_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2OCCCC2(C)C""",21,"""39F2C8397A413030"""
+"""60AD3E5B199E94AF_58131E249DD28FC9_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2(CC2)[S](=O)(=O)Cl""",21,"""39F2C8397A413030"""
+"""BD4587492DF8D8D4_6700DE980134723B_6039_DP""","""CNC(=O)OC1=CC(=CC=C1)OCCOC2CCNCC2""",21,"""39F2C8397A413030"""
+"""2323A4CEC10D8B01_614D3B0DBE63EB1E_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC(N(CC)CC)=O""",21,"""39F2C8397A413030"""
+"""0B1ADD6581A273F1_3EA4973BB336BFD1_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(NC(CC)(C)C)=O""",21,"""39F2C8397A413030"""
+"""08413CBCACEBE65D_B1AC960196E0C3A7_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2=C[N](CC)N=N2""",21,"""39F2C8397A413030"""
+"""D71F7423444DE5FC_79F81059B0FB966B_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2=CC=CC(=C2)C""",21,"""39F2C8397A413030"""
+"""BC75566E1F1747A0_FCA597FF2D546670_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCN(C)CC(F)(F)F""",21,"""39F2C8397A413030"""
+"""E23A5E25E9DD7215_3AC97B8A70C430AC_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCN2CC(C(C)C2)C""",21,"""39F2C8397A413030"""
+"""315F2B4A1C4048C2_2868DA32E6DB6206_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=N[NH]C(=C2)C(C)C""",21,"""39F2C8397A413030"""
+"""D753B16597F1AC0B_F47DEDD925F676D1_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCN2C[C@H]([C@@H](C)C2)C""",21,"""39F2C8397A413030"""
+"""18C6A3C5CF764C29_4F2B11E3B1F7DCDC_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(C2=C[N](C)C=N2)=O""",21,"""39F2C8397A413030"""
+"""B74E5E8A59154A7F_CCAA92F5E1D803E2_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(OC)C=CC=N2""",21,"""39F2C8397A413030"""
+"""D165BD4119095696_04B7BE132EB15BA8_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(N=CC(=C2)C)F""",21,"""39F2C8397A413030"""
+"""77CFE1E6F16E5489_3813528FC17B62AB_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCN2CC(F)(CC2)F""",21,"""39F2C8397A413030"""
+"""00A898FF7BA2874F_394AF9BC100B2E4C_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CC(=NC=C2)C#N""",21,"""39F2C8397A413030"""
+"""CB21CD12067C007C_0C57345A056918D4_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCOC(C)(C)C(=O)O""",21,"""39F2C8397A413030"""
+"""169B2EC30F74F700_3033B7EC322FDACD_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC3CC2OCCC2O3""",21,"""39F2C8397A413030"""
+"""2AC957F57F742ACB_A5B9E7F7526B2988_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC(C2=CC=C(C)O2)=O""",21,"""39F2C8397A413030"""
+"""FDA965D2824F4010_C3168307EB01C968_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCCC2(C(O)=O)CC2""",21,"""39F2C8397A413030"""
+"""FAA35BBF521067EF_08F30DDFC82740EE_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(COC)OC=N2""",21,"""39F2C8397A413030"""
+"""3FA89A090BFE939C_7E3A52CE7783E933_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2CC(C)(C)OC2""",21,"""39F2C8397A413030"""
+"""D13FB86F9ABA2D41_74E1CD10C32EDD29_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2NC(=O)NC2=O""",21,"""39F2C8397A413030"""
+"""A6457A059FED6962_BC1610851346CACB_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=NO[C@@H]3COC[C@H]23""",21,"""39F2C8397A413030"""
+"""37E618CD15B19B4B_885A8075A239AEA8_6039_DP""","""CNC(=O)OC1=CC(=CC=C1)OCC(C2CCCNC2)=O""",21,"""39F2C8397A413030"""
+"""1B466ED426447D01_1B2D5A53D76C2BAB_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CC(=NO2)COC""",21,"""39F2C8397A413030"""
+"""8EFD39D0800B445B_7D1CB7A9A8498642_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=NOC(C(O)=O)C2""",21,"""39F2C8397A413030"""
+"""0D2C8D79D99F81DE_4C263D217517C055_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CC(=NC=N2)OC""",21,"""39F2C8397A413030"""
+"""33EF2DB36FC39202_7A5B38C36C1E721B_6039_DP""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(CCN)OC=N2""",21,"""39F2C8397A413030"""
+"""4791B956B08CE2F3_1F45CB35E43659F8_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCC2=CN=C(C)C=C2""",21,"""39F2C8397A413030"""
+"""A51B90217C7CDA62_E9EA0F7D171030A0_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(C)C=C(N=C2)F""",21,"""39F2C8397A413030"""
+"""B14B50E398DCD316_311A9281B077DD47_6039_DP""","""CNC(=O)OC1=CC(=CC=C1)OCC2CNC(CO2)(C)C""",21,"""39F2C8397A413030"""
+"""B2E1F06E030C3355_A05FBD9F639657AE_6039_DP""","""CNC(=O)OC1=CC(=CC=C1)OCC(C2CCNCC2)F""",21,"""39F2C8397A413030"""
+"""7C07251E1ACA51E5_155B85B553AA07DB_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCCOC(C#N)C2CC2""",21,"""39F2C8397A413030"""
+"""83E35232B810740B_A61AD392FD7C2987_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2CC(=NO2)C3CC3""",21,"""39F2C8397A413030"""
+"""E559F946BEE76FD8_1B5CAADAA0459342_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=CC=NC(=N2)OC""",21,"""39F2C8397A413030"""
+"""8801D6D78AD69620_9024BE2A6E5E98C6_6039_UN""","""CNC(=O)OC1=CC(=CC=C1)OCC2=C(ON=C2OC)C""",21,"""39F2C8397A413030"""
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+"""B58693D260A7E5BF_FA2361540D7B9637_6039_UN""","""O(C1=CC2=C(C=C1)NC(=O)C2=O)CC3=C[N](C(C)C)N=N3""",21,"""7DEECE5A372B2E4F"""
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+"""B68CD5F115170F0D_BCA22D01964337FA_6039_UN""","""O(C1=CC2=C(C=C1)NC(=O)C2=O)CC3=C(N=C(CC)O3)C""",21,"""7DEECE5A372B2E4F"""
+"""6C931A3CA9891268_60CB04DAB50C0F72_6039_UN""","""O(C1=CC2=C(C=C1)NC(=O)C2=O)CC3=CC(=NO3)C(C)C""",21,"""7DEECE5A372B2E4F"""
+"""7751C175AECDDBF2_7F9A1B4F7142CC3A_6039_UN""","""O(C1=CC2=C(C=C1)NC(=O)C2=O)CC3=N[N](CCC)C=C3""",21,"""7DEECE5A372B2E4F"""
+"""BC2B796640FA3DB5_ECE48A3776D0B545_6039_UN""","""O(C1=CC2=C(C=C1)NC(=O)C2=O)CC(=O)N3CCOCC3""",21,"""7DEECE5A372B2E4F"""
+"""0A9A8751A0183AAB_45856CF773156A5A_6039_UN""","""O(C1=CC2=C(C=C1)NC(=O)C2=O)CC3=NC=C[N]3C(F)F""",21,"""7DEECE5A372B2E4F"""
+"""8816F0FBB563AD71_3C1AFBE1DEFD7194_6039_UN""","""O(C1=CC2=C(C=C1)NC(=O)C2=O)CC(=O)N3CCCC3=O""",21,"""7DEECE5A372B2E4F"""
+"""1F28F1A15DBA67E0_1FF668B684741170_6039_UN""","""O(C1=CC2=C(C=C1)NC(=O)C2=O)CC3=NC=CC(=C3)OC""",21,"""7DEECE5A372B2E4F"""
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+"""4AE5657CB2B40C15_04C9D16D1F991454_6039_UN""","""O(C1=CC2=C(C=C1)NC(=O)C2=O)CC3=CC(=NN=C3C)C""",21,"""7DEECE5A372B2E4F"""
+"""C26E988AF270BE3F_74E0AB932DBFE5BD_6039_UN""","""O(C1=CC2=C(C=C1)NC(=O)C2=O)CC3=CC=CC(=C3)OC""",21,"""7DEECE5A372B2E4F"""
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+"""5B9C7DD19BD8A484_7AAE5B67C61732D5_6039_UN""","""O(CC(=O)CN2C(=O)C1=C(C=CC=C1)C2=O)CCC(O)=O""",21,"""F1A962FC9263A70C"""
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+"""A9BA6D656608121D_10BC438F1FE820D5_6039_UN""","""O(CC(=O)CN2C(=O)C1=C(C=CC=C1)C2=O)CC(=C)C#N""",21,"""F1A962FC9263A70C"""
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+"""7FE3E794CE31A245_E47D22D0BC8ACAC5_6039_UN""","""O(CC(=O)CN2C(=O)C1=C(C=CC=C1)C2=O)CCC#CC""",21,"""F1A962FC9263A70C"""
+"""DF606014F1E35FF7_45BEC389ACCB760A_6039_DP""","""O(CC(=O)CN2C(=O)C1=C(C=CC=C1)C2=O)CCCCO""",21,"""F1A962FC9263A70C"""
+"""05065EBD06069425_F3E939902B9D38A2_6039_UN""","""O(CC(=O)CN2C(=O)C1=C(C=CC=C1)C2=O)CCOCC""",21,"""F1A962FC9263A70C"""
+"""960E8D0DA1FDD719_F4DE64C922090AA9_6039_UN""","""O(CC(=O)CN2C(=O)C1=C(C=CC=C1)C2=O)CCCC#N""",21,"""F1A962FC9263A70C"""
+"""2539BD5DF40F2ED8_57730003B3D570BE_6039_UN""","""O(CC(=O)CN2C(=O)C1=C(C=CC=C1)C2=O)CCC(C)F""",21,"""F1A962FC9263A70C"""
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+"""4DB0C4D10F7CF531_C5C20877742317C0_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=C2)OC(C)C""",21,"""39FC264BEC36A627"""
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+"""1232649B1CB436D0_4BB7E7C8C8594A2F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N(CC)CC(C)C#N)=O""",21,"""39FC264BEC36A627"""
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+"""7783BE8F36FAD9BD_648869805E2AA21C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC(C)C(=O)N(C)C)=O""",21,"""39FC264BEC36A627"""
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+"""748CF3A906D1D4EA_EB4CFB494E0EE9DD_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(C=C2)OCCO3""",21,"""39FC264BEC36A627"""
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+"""852611147949F193_E181A75AE73CABB5_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=NC2=C(F)C=CC=C2[NH]3""",21,"""39FC264BEC36A627"""
+"""4D165755CC38A4C5_A8EF2556A8A42508_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC(=CO2)C(O)=O)=O""",21,"""39FC264BEC36A627"""
+"""FC68C578EF9DB115_A850E7EBBDB1F5C7_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC(=CO2)C(N)=O)=O""",21,"""39FC264BEC36A627"""
+"""5DA34BE597212C5D_F221E43AE2E22C22_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCCC[N]2C=C(C)C=N2""",21,"""39FC264BEC36A627"""
+"""0D623402AD19455D_65820620DF6E50A5_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC(N(CC(OC)=O)C)=O""",21,"""39FC264BEC36A627"""
+"""D6CC94260001B0F7_84F9AC92524AEB5C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC[N]2N=C([N](=O)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""0A978E60CBD13ABE_D3FFF3F1A6512215_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)C3=COC=C3""",21,"""39FC264BEC36A627"""
+"""2B1E43B7F114FCB1_74ABD49B8E4CBEB8_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CSC(=N2)C3=COC=C3""",21,"""39FC264BEC36A627"""
+"""585283157036051B_BBB517E6786DC50B_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=C[N]2C(=CC=CC2=N3)C""",21,"""39FC264BEC36A627"""
+"""FE5044B50233F0C9_64C3D27A302754C0_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC(=CS2)C(C)=O)=O""",21,"""39FC264BEC36A627"""
+"""58961C21BA6B4FDD_D8F56D6EE3E48628_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC=C[N]2CC(F)(F)F""",21,"""39FC264BEC36A627"""
+"""4B07A9AEF33093CC_593FDCA2F541175C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC2=NC=C(C(C)(C)C)O2""",21,"""39FC264BEC36A627"""
+"""F061C3198B3EE26B_5CAB84582FF68AE5_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N(CC(OCC)=O)C)=O""",21,"""39FC264BEC36A627"""
+"""AE93457BF3357C89_C0496DFC7304C515_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=C(C=C2)SC)OC""",21,"""39FC264BEC36A627"""
+"""D89CEBCBBB587E0F_2C34F85C7C0A079E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2OCCC3=C2C=CC=C3""",21,"""39FC264BEC36A627"""
+"""BE423F6DFBB5788E_9692DE39CC8D4EEC_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CSC(=N2)C(OCC)C""",21,"""39FC264BEC36A627"""
+"""44CEF646813E41E4_4FC68C8F0D3DB173_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=N[N](C(CC)CC)C=C2""",21,"""39FC264BEC36A627"""
+"""C6BB65D6072806D8_ACD59F83034C54BF_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCC2=CC=CC(=C2)OC""",21,"""39FC264BEC36A627"""
+"""0BC5DADCEF63A4CC_05F20E7424A10DD8_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC2=CC3=C(C=C2)OCC3""",21,"""39FC264BEC36A627"""
+"""6532FE5A3E786749_7917392E315F021F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCN2CCN(C(C)C)CC2""",21,"""39FC264BEC36A627"""
+"""E39F282AEF48B3E9_76B15FDBD2857033_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=C2C=CC=CC2=CC=C3""",21,"""39FC264BEC36A627"""
+"""9DE6139B829D7C6A_544C29504A4B5D09_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=C2OCCOC2=CC=C3""",21,"""39FC264BEC36A627"""
+"""73E561DE588E9134_508BB81928F380A5_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCOC2=CC=C(SC)C=C2""",21,"""39FC264BEC36A627"""
+"""BC20BAF184F98BF7_E9FE348A73B2247E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(C=C2)OCC#N""",21,"""39FC264BEC36A627"""
+"""B624ECF78C4F792D_23661FEE2766D211_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCN(CCCC)CCCC""",21,"""39FC264BEC36A627"""
+"""0F6A4085C610F638_3C7C18BCFA46678D_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC2=CC=C(C(O)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""D3E998E50E1351F2_EE77B3351DC7835F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)C[S](C)(=O)=O""",21,"""39FC264BEC36A627"""
+"""A9D2DAEB31982631_577E07B41EBF2B6A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)C3=N[NH]C=N3""",21,"""39FC264BEC36A627"""
+"""059F43B3D4F8D199_4E2D29D079714FD4_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC(=C(C=C2)F)C)=O""",21,"""39FC264BEC36A627"""
+"""F11665DA8E9C34D0_0299AB575364AA25_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=NC2=C(C=CS2)C(=O)N3""",21,"""39FC264BEC36A627"""
+"""719923766190D745_5B17A06F158AD22F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCNC(=O)C2CCCC2""",21,"""39FC264BEC36A627"""
+"""C2D4D9092D11F701_9A51DE22143C9874_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCN[S](CCCOC)(=O)=O""",21,"""39FC264BEC36A627"""
+"""3A5125149E334325_AF678BA5F65DB7B9_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(OC(C)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""6B475D7A86A8C8DE_56898867335466AC_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC(=CS2)C(O)=O)=O""",21,"""39FC264BEC36A627"""
+"""7C79A06452A00A3D_715B6FDC84E7FFFA_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NOC(=N2)C3=COC=C3""",21,"""39FC264BEC36A627"""
+"""FC52B863166E80B9_37EF6D0EC6FE64E5_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC(=CS2)C(N)=O)=O""",21,"""39FC264BEC36A627"""
+"""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"""
+"""1FA7F2C73928FC7A_7D4695B784B09E0F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=CC2=C([N](C)N=N2)C=C3""",21,"""39FC264BEC36A627"""
+"""BCE7C21B4C85880A_F5AD6AB1FE07DA39_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCNC(=O)C2=NC=CC=C2""",21,"""39FC264BEC36A627"""
+"""EE1F33DDEDE12F11_98984A56C13AFFE6_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C([N](C)N=C2)C(F)(F)F""",21,"""39FC264BEC36A627"""
+"""329E35C8E3014531_99FF3A28941CC709_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)CCC(C)C""",21,"""39FC264BEC36A627"""
+"""78C6285E6B21CF15_AB03C7EDBBE7DF56_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)C(SCC)C""",21,"""39FC264BEC36A627"""
+"""A4B4E09BA20EAFFB_7F490386C0C02EB6_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C[NH]C(=N2)C3=CC=CS3""",21,"""39FC264BEC36A627"""
+"""9F46941E622ADAE6_EF0F6D2ABB6C6C18_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(OC)C=CC(=C2)C#N""",21,"""39FC264BEC36A627"""
+"""16A5971AE34DD3FD_6E7B9C23E54F1836_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(C=C2)NC(=O)O3""",21,"""39FC264BEC36A627"""
+"""854B0C6FC58F7C80_44A13CE586406B26_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCOC2=CC=CC(=C2)OC""",21,"""39FC264BEC36A627"""
+"""EE5349973300A1BA_180F6F1861F71C1B_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(C(OC)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""4E9A3467B47E3143_AC2057B97AC100D6_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC(NCC(C)C)=O)=O""",21,"""39FC264BEC36A627"""
+"""097681B378E8F864_0EA6A2E751140968_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC2CCC(C)CC2)=O""",21,"""39FC264BEC36A627"""
+"""B55794A55C943F08_ECB90B2D2E9D4682_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)C3=CC=CO3""",21,"""39FC264BEC36A627"""
+"""5D2F881B85868095_8E4250BE8884935F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCOC2=C(C)C=CC=C2C""",21,"""39FC264BEC36A627"""
+"""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"""
+"""44E6987D5A3F9D13_B3A0ACFD0D347DBE_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(CC(O)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""1C1F2DEAA20D1859_28D7F4E25D4EF937_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NCCOCCCC)=O""",21,"""39FC264BEC36A627"""
+"""FB4EF94675583A3E_D03164C00DA9FD29_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CSC(=N2)C(OCC)=O""",21,"""39FC264BEC36A627"""
+"""5C4A3022AFCBDC72_A6ABF21E613F330F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)C3=CC=CS3""",21,"""39FC264BEC36A627"""
+"""52FD42149C3768EE_0729077A9366C524_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)NC(C2CC2)C3CC3""",21,"""39FC264BEC36A627"""
+"""BC57DC15C7237B4B_C2EEA0E9B4CF363B_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=NC2=C(SC=C2)C(=O)N3""",21,"""39FC264BEC36A627"""
+"""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"""
+"""3C8486AAA0A48BF5_B423EA94DA6F9FB8_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC(C)(C#N)C2CC2)=O""",21,"""39FC264BEC36A627"""
+"""4483642E6E47B979_110E69CAD609D252_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=NC2=C(C=CC(=C2)F)O3""",21,"""39FC264BEC36A627"""
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+"""8F2DFACFF7F2D942_B6AC64A86CBC7EBF_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N(C)C2=CC=CC=C2)=O""",21,"""39FC264BEC36A627"""
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+"""AA3B0596C8A10924_49637C3F8BD18FFF_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC2=CC=C(F)C=C2)=O""",21,"""39FC264BEC36A627"""
+"""6DA922BD8BCC3F18_6061FD6BC1A4CD39_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC(C2=CC=C(C)C=C2)=O""",21,"""39FC264BEC36A627"""
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+"""EB591A39D8AFA72E_9ECEAC722BCB5682_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(SC(C)C)C=C2""",21,"""39FC264BEC36A627"""
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+"""5589CE52FB734392_50BCDC06796B64C3_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NN=C([N]2C)C3CCC3""",21,"""39FC264BEC36A627"""
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+"""C307DCB42749AA79_1F5F5B2F60F08E87_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC(C(C)C)C(=O)O)=O""",21,"""39FC264BEC36A627"""
+"""64232238FDD49127_FD86B0D10294737F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=NC2=C(C)C=CN=C2[NH]3""",21,"""39FC264BEC36A627"""
+"""5CE2ECE629B17407_E6DEA235CA460E5D_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(N=C(C)S2)C(F)(F)F""",21,"""39FC264BEC36A627"""
+"""3F5D21C1A51F56A9_D8DBC541037EF492_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(C=C2)[NH]C(=N3)C""",21,"""39FC264BEC36A627"""
+"""FB3F631BD4A30717_0F4A3D0CAE6038E5_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC[N]2C=C(C(OC)=O)N=N2""",21,"""39FC264BEC36A627"""
+"""D1EA34AEF7BAE4EC_B7F5D1095ED71255_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC2=CC=CC(=C2)F)=O""",21,"""39FC264BEC36A627"""
+"""1AEC03D413F09F8C_D56506E0155CC1A4_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC=CC(=C2)OC)=O""",21,"""39FC264BEC36A627"""
+"""0B161509C2F27E7D_0BA4CB8C134B6679_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC2CCCCC2C)=O""",21,"""39FC264BEC36A627"""
+"""D63747EE1732C3FC_65B8561556FA41DB_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(C=C2)N=CC=C3""",21,"""39FC264BEC36A627"""
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+"""99BADBE28C0E47F1_A66605EB83090A53_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC3COC2(CCCC2)O3""",21,"""39FC264BEC36A627"""
+"""05126445F99A1B27_9C59EA2A3CF3A45A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=C([N](=O)=O)C=C2)F""",21,"""39FC264BEC36A627"""
+"""9DE39C0490511D3A_5664446A5BFACA3F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(C(NC)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""B51FAB74BEFD8354_24A05F9EFF862069_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC[N]2C(=CN=C2C)[N](=O)=O""",21,"""39FC264BEC36A627"""
+"""304A8DB0A0D8D804_A82B6DD464A51E7E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC=CC(=C2OC)OC""",21,"""39FC264BEC36A627"""
+"""05CC6515FE17A2B5_81403F81202DCB62_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=C(OC)C(=C2)F)F""",21,"""39FC264BEC36A627"""
+"""9897BB373CD2729D_189EF0B78DB22192_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3CCC2(CCCCC2)O3""",21,"""39FC264BEC36A627"""
+"""CC11AF53734666C0_0AF2AF3385E87ADF_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2CCC(F)(F)CC2)=O""",21,"""39FC264BEC36A627"""
+"""709D305CC9116BCC_B9FB343EE1C519AF_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC=C(C(F)(F)F)C=C2""",21,"""39FC264BEC36A627"""
+"""E1D1EDAAD364383F_60A242173701B10E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C([Si](C)(C)C)C=C2""",21,"""39FC264BEC36A627"""
+"""5DFC500B050D0B6C_6733EAEB09EE19AD_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NN=N[N]2CC(F)(F)F""",21,"""39FC264BEC36A627"""
+"""329B5DD9F7C6F1A7_2CBCAF9FA978209D_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=N[N](CC(F)(F)F)N=N2""",21,"""39FC264BEC36A627"""
+"""815B3A310851ED44_9E2797DFF4384C41_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(C=C2)C3CCC3""",21,"""39FC264BEC36A627"""
+"""35A34CBCED2E0D01_165E608EFAD31ACE_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NN=C3[N]2CCCCC3""",21,"""39FC264BEC36A627"""
+"""9A211CB814C7D2A1_3B2E34B0D6334862_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=N2)C(OC)=O""",21,"""39FC264BEC36A627"""
+"""5B261251BF3240B1_C859C651B0380879_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C([S](N)(=O)=O)C=CC=C2""",21,"""39FC264BEC36A627"""
+"""80F0F0538841E9E3_025673AA48A66B2A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C(C(OCC)=O)(C)C)=O""",21,"""39FC264BEC36A627"""
+"""540B2298F0F79749_759D64E6A37F9E10_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C([S](Cl)(=O)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""744778C2E57A2038_89D61FA878C97F7E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(N=C2)C=CC=C3""",21,"""39FC264BEC36A627"""
+"""B4B01116C57E59B9_1DF14BA1F5CF22B2_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C([S](C)(=O)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""F6E03B907A3B16A1_A53F6954F0B48145_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C=CC=C2)[S](=O)(=O)Cl""",21,"""39FC264BEC36A627"""
+"""78A70870463660C2_95344E063659FD2F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCC2(CCOCC2)C#N""",21,"""39FC264BEC36A627"""
+"""57D79702AE879903_DC518AA43F538A0B_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(OC)N=C(C=C2C)C""",21,"""39FC264BEC36A627"""
+"""D203C90882BDA200_CE42EFAF3A5BB630_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=CC=C2)[S](=O)(=O)Cl""",21,"""39FC264BEC36A627"""
+"""174F8ABC8DB47C0D_41D1339877EF8ABF_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C(F)(F)F)C=CC=C2""",21,"""39FC264BEC36A627"""
+"""545F193A4E328FC7_891437B01347E029_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)COC2=CC=CC=C2""",21,"""39FC264BEC36A627"""
+"""8D81423A8CF8A595_9D0225C69BA517F1_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC(CC(OCC)=O)(C)C""",21,"""39FC264BEC36A627"""
+"""491F8704E322F0EF_AD098C2AAA7F9C26_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(NC(C)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""E473B932F7A40B61_D5E86EFC37A40AD6_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC(=NC=C2)OC)=O""",21,"""39FC264BEC36A627"""
+"""D203C90882BDA200_E7BD720A3FCDD259_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=C2)[S](Cl)(=O)=O""",21,"""39FC264BEC36A627"""
+"""0C10ADB09C72B097_9D39E5FB1F7A0729_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C([S](F)(=O)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""EDCE8741AAFC2600_1C6633EE30B2BCE7_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC=CC(=N2)OC)=O""",21,"""39FC264BEC36A627"""
+"""FD86DBD38470E270_18E47F4608A3B222_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCN2C3=C(CC2)C=CC=C3""",21,"""39FC264BEC36A627"""
+"""DDF79828185AF40F_CB388D7D10F72699_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(N=C(C(C)C)C=C2)C""",21,"""39FC264BEC36A627"""
+"""FC10CFEE51E71C49_CEA72DE3C6B9F671_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=CS2)C(OCC)=O""",21,"""39FC264BEC36A627"""
+"""E6B615D2670E5508_504E1596B5AF0492_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=N[N](CC(F)(F)F)C=C2""",21,"""39FC264BEC36A627"""
+"""92D0B2DC224BF9BB_6A5CFC8A4330CDC4_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCN(C)CC2=CC=CC=C2""",21,"""39FC264BEC36A627"""
+"""378A0F811A456076_D76E0506C1B7B88A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=C2)[S](C)(=O)=O""",21,"""39FC264BEC36A627"""
+"""2BE6B5B66C7338CC_933FEA9FACD84598_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C[N](CC(OC)=O)N=N2""",21,"""39FC264BEC36A627"""
+"""7AB8CDE29E988781_9F7EFAB24EBA65B3_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N2CC(CC(C)C2)C)=O""",21,"""39FC264BEC36A627"""
+"""A9E1EAD1519F13C6_BB9218A3EBA6BD51_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N2CCCCC2CC)=O""",21,"""39FC264BEC36A627"""
+"""EE9D52EE9B7011BC_806CAD5A31BA52C1_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=N[N]2C3CCCC3""",21,"""39FC264BEC36A627"""
+"""8C90949E85BEDC44_C5903085F89059CD_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=N[N]2CC(F)(F)F""",21,"""39FC264BEC36A627"""
+"""37A867D1AF3BFE95_3256AB19150EAF6E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3COC2=C(C=CC=C2)O3""",21,"""39FC264BEC36A627"""
+"""A81AAD648D46FFB2_5A239969AC45C5AC_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N(C)CC2=CC=CO2)=O""",21,"""39FC264BEC36A627"""
+"""A0C51ACA04C2C6AF_6CDD2D990D402982_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)CCC2CCCCO2""",21,"""39FC264BEC36A627"""
+"""92CD0FB8E5099188_A27DDAC2AD059055_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC(NC2=NOC(=C2)C)=O""",21,"""39FC264BEC36A627"""
+"""0AB5CF33C538A9BC_B1807FEA589A2EBF_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)NC2=C(C=CS2)C#N""",21,"""39FC264BEC36A627"""
+"""EEF142ED60978C3F_2E990F6E278CDD1D_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NOC(=C2)C3=CC=CS3""",21,"""39FC264BEC36A627"""
+"""C65223C9625805AF_DB81FA3B981F2069_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(OC)CC2=CC=CC=C2""",21,"""39FC264BEC36A627"""
+"""3703876E89C78E7D_AF18B864C68B51A0_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCOC2=C(C=CC=C2)C#N""",21,"""39FC264BEC36A627"""
+"""A6017E566FDFBA12_57385571824DB944_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC(NCCCC)=O)=O""",21,"""39FC264BEC36A627"""
+"""93B2F5A307730201_7A2D43D0E089425E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=NC2=C(C=C(F)C=C2)O3""",21,"""39FC264BEC36A627"""
+"""5B075E01412C3DEA_091CFD6E1843B29E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(ON=C2)C3=CC=CS3""",21,"""39FC264BEC36A627"""
+"""6E91709787ED7DEA_39C19D0D6A72F3EB_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CSC(=N2)C[S](C)(=O)=O""",21,"""39FC264BEC36A627"""
+"""12CB40E556700F6F_263C9292DC051493_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC(CC)(CC)C(=O)OC""",21,"""39FC264BEC36A627"""
+"""B3F6A35433372B74_B64BD1A33DFC387E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=C(OC)N=CC=C2)=O""",21,"""39FC264BEC36A627"""
+"""F90F7DED1F7AD5C7_8653C6064B67910A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=C(C=C(C)C=C2)C)=O""",21,"""39FC264BEC36A627"""
+"""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"""
+"""1DF9D947DDEB37FA_6F04DB83BC65A362_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=N[N]2C)C(OC)=O""",21,"""39FC264BEC36A627"""
+"""B5995DB9601CBABD_520E0460612F0B56_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCOCC(C(F)(F)F)(F)F""",21,"""39FC264BEC36A627"""
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+"""721D2B5A3B0E4E7F_D6B1337DE6B7E6FE_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)CC(F)(F)F""",21,"""39FC264BEC36A627"""
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+"""C1DC1CD283D14CED_416865E8BB9AE4E6_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=N[N](C=C2)C3CCCC3""",21,"""39FC264BEC36A627"""
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+"""E92CAFAA1D713467_752CD877DB51ACF6_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=NC=C[N]2C(C)C)=O""",21,"""39FC264BEC36A627"""
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+"""D2A60E00D3647262_B4327B0B360022C4_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=N[N]2C)C(F)(F)F""",21,"""39FC264BEC36A627"""
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+"""D761CE97F6512031_E00540BEEE5E9651_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C=C(C(O)=O)C=C2)F""",21,"""39FC264BEC36A627"""
+"""CD6B0D52EF92B307_FB86996036481B21_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCN(C)C2=CC=CC=C2""",21,"""39FC264BEC36A627"""
+"""9C484FBF85D98B53_61C99D9E85607BCB_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(F)C=C(C(=C2)F)C#N""",21,"""39FC264BEC36A627"""
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+"""81E6DC2251B6C5BC_FEDB5C65DB57E2CD_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC2=NSC3=C2C=CC=C3""",21,"""39FC264BEC36A627"""
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+"""B511DA5806D5A26E_708C6A4B580DD7D6_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC3=C(N=C2)C=CC=C3""",21,"""39FC264BEC36A627"""
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+"""3088514BEE02AA40_1989369D93DC2BC5_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C([N](=O)=O)C=C(C=C2)F""",21,"""39FC264BEC36A627"""
+"""C18C4CF710202123_C73D4D7637EA63A0_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC2=N[N](C(C)(C)C)N=N2""",21,"""39FC264BEC36A627"""
+"""0983B6CFAA71A563_CC748AB9BDAD7A87_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC2CCC3=C2C=CC=C3""",21,"""39FC264BEC36A627"""
+"""88A3BEBD5EB21EE5_807E7E3F5D78280E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCC(CC(OCC)=O)=O""",21,"""39FC264BEC36A627"""
+"""674FB8EB91A780F6_F431FDD696DCDB8E_6039_DP""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC3=C2CCNC3""",21,"""39FC264BEC36A627"""
+"""565255F1B8CA8648_54906BF411C8DD89_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(OC)C2=CC=C(C=C2)F""",21,"""39FC264BEC36A627"""
+"""3D71C80DF009EDF5_4423F0362FC94910_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=NC2=C(C=CC(=C2)C)S3""",21,"""39FC264BEC36A627"""
+"""974420B85D9822C2_1AD34A45790C4A5C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C(F)(F)F)N=CC=C2""",21,"""39FC264BEC36A627"""
+"""590296BF05C0867E_565D64263FE1B6E7_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N(CC)CC(F)(F)F)=O""",21,"""39FC264BEC36A627"""
+"""E1D0C14AAEF6AD32_439BDD76CABD07C8_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC2=C(C)C=CC=N2)=O""",21,"""39FC264BEC36A627"""
+"""A81B078D794BD475_E0C5B3DE6749F165_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=C2F)[N](=O)=O""",21,"""39FC264BEC36A627"""
+"""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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+"""32F4654D0E09DD57_900A010A2AFBA60C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC2CCN(C)CC2)=O""",21,"""39FC264BEC36A627"""
+"""9964E586570BB002_DF185C091D19A077_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=C(C)C=C2)[N](=O)=O""",21,"""39FC264BEC36A627"""
+"""905208E93673FAB0_53A5AD12B892B4A9_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2CC3(CO2)CCCCC3""",21,"""39FC264BEC36A627"""
+"""5E231F325468095D_D8C8705656AB1A5E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2CC3(CO2)CCOCC3""",21,"""39FC264BEC36A627"""
+"""DA34EC0E8FC9428A_5883C3422F102E58_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(C=C2)N=CC=N3""",21,"""39FC264BEC36A627"""
+"""5AEE79DA7C7B6A2F_ECDDB12F313EF00F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CN=C(C(OCC)=O)S2""",21,"""39FC264BEC36A627"""
+"""F2D8C13A83B08015_78DBEFBABD60A3B4_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3CCC2(CCOCC2)O3""",21,"""39FC264BEC36A627"""
+"""AE27A96F04126FC0_35DC1E56F2659648_6039_DP""","""O(CC1=CC=C(C=C1)CF)CC3OCC2(CCNCC2)C3""",21,"""39FC264BEC36A627"""
+"""4F8016F43CF3D792_D6F52198D57CD885_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3COC2(CCCCC2)O3""",21,"""39FC264BEC36A627"""
+"""D6CDFFAE6988A163_98546BABFC6B48D4_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N2CC(C)(C)OCC2)=O""",21,"""39FC264BEC36A627"""
+"""FCAE86D3A758730F_22E7E855C1F60FE2_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC=C(OC)C=C2)=O""",21,"""39FC264BEC36A627"""
+"""8FB3ED816B3B48A4_13D492656E4EEE85_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)N2CC3CCC(C2)O3""",21,"""39FC264BEC36A627"""
+"""D49DB990F179154A_0847ACCE15DB6291_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC=C(F)C=C2)(F)F""",21,"""39FC264BEC36A627"""
+"""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"""
+"""54CA60022DDF7F6B_8C8760C9F7B95CA9_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCOC(=O)C2=CC=CC=C2""",21,"""39FC264BEC36A627"""
+"""DA7DC6A3811838FE_C12661F4FBBF2BD5_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC[S](NC(C)(C)C)(=O)=O""",21,"""39FC264BEC36A627"""
+"""51F029AE3D2B857C_676C89C62A58CB1B_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=C(OC)C=CC=C2)=O""",21,"""39FC264BEC36A627"""
+"""02D767A87AD63DEB_0B09A726C22CC794_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=C2)C(F)(F)F""",21,"""39FC264BEC36A627"""
+"""EAD75D89875A4433_AB6F759064E22325_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(F)C=C(C(=C2)C#N)F""",21,"""39FC264BEC36A627"""
+"""0EDA1ACA62C6832C_ED4DFD8C5EE0DDD6_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(CC(C)C)C=CC=C2""",21,"""39FC264BEC36A627"""
+"""9445F65FBA986B87_111CD461D2B34AB3_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)NCC2CCCCC2""",21,"""39FC264BEC36A627"""
+"""77F33F6DEC7CD5CD_41052AA4CED026BC_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N(C)C2CCCCC2)=O""",21,"""39FC264BEC36A627"""
+"""67EE5B8F4803EF48_24D81C10972C4F1F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)COC(C)C""",21,"""39FC264BEC36A627"""
+"""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"""
+"""3D9306A6426F2CFD_3B9B5BFA7C91FAE3_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=C(S2)C(C)(C)C)C""",21,"""39FC264BEC36A627"""
+"""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"""
+"""E3BC7A1593120BF9_369B9D7F01655F0C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=NN=C2C3CC3)C""",21,"""39FC264BEC36A627"""
+"""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"""
+"""6649FFB2758E13A1_B3A1BE269BC7A2A4_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCOC2CC[S](=O)(=O)CC2""",21,"""39FC264BEC36A627"""
+"""00CBF91F47FF46ED_E94E8C89F4E2A88F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NSC3=C2C=CC(=C3)F""",21,"""39FC264BEC36A627"""
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+"""33F91162F76538CF_7432AA82438AFF73_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(F)C=C(C=C2F)C#N""",21,"""39FC264BEC36A627"""
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+"""5D913EF4C339C1A3_BCD858C44BC6E088_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C([N](C)N=N2)C(F)(F)F""",21,"""39FC264BEC36A627"""
+"""92C60C598D9F5483_02DEA1B5909C9D47_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C[N](C)N=C2C(F)(F)F""",21,"""39FC264BEC36A627"""
+"""5B87086759D02E00_548C5D3259FD9DE4_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=C(OCC)C=C2)F""",21,"""39FC264BEC36A627"""
+"""0BC63D7DE580B1FF_B2D3A35D04FCAC35_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=NC2=C(F)C=CC=C2O3""",21,"""39FC264BEC36A627"""
+"""03B765919A9EECB9_435AFF5D8AD50189_6039_DP""","""O(CC1=CC=C(C=C1)CF)CC2OCCC23CCNCC3""",21,"""39FC264BEC36A627"""
+"""1AEBE669FD6971B1_AB4AC99866114829_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C([S](N)(=O)=O)C=C2""",21,"""39FC264BEC36A627"""
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+"""4975F1D20153D9C3_48261516C09050AB_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C([S](C)(=O)=O)C=CC=C2""",21,"""39FC264BEC36A627"""
+"""8FC91CE93DDF30C1_510AE8E7B014C590_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=NO2)C(OC)(C)C""",21,"""39FC264BEC36A627"""
+"""021A055E0476D8BD_F73ED4DEA9703254_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NCCCOC(C)C)=O""",21,"""39FC264BEC36A627"""
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+"""DF2D1EBC12B67B0B_B979C30AFC528F18_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(SC(F)F)C=C2""",21,"""39FC264BEC36A627"""
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+"""540B2298F0F79749_B11A4D8787EF6D80_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(C=C2)[S](=O)(=O)Cl""",21,"""39FC264BEC36A627"""
+"""D1085D9E1540E3C2_4A6EF4AA9AA2C68C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=C2[N](=O)=O)C""",21,"""39FC264BEC36A627"""
+"""25E1E3707670E5B8_BE96FB5011E25AD2_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(C=C2)C=CC=N3""",21,"""39FC264BEC36A627"""
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+"""5C11A064476A83F5_C0B764849D78B737_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C=CC(=C2)[N](=O)=O)F""",21,"""39FC264BEC36A627"""
+"""77EDD73F079738FB_A5C947BECF5182CD_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCNC(CC(C)(C)C)=O""",21,"""39FC264BEC36A627"""
+"""296C8D6182A835D5_52B249C60EE0C219_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC(=O)N2CCCCCC2""",21,"""39FC264BEC36A627"""
+"""87224E201BDBC255_B46911936277B391_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=NC2=C(CCCCC2)S3""",21,"""39FC264BEC36A627"""
+"""979C942888779FAC_E043AC5D50D7401D_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CN=CC(=C2)C(C)(C)C""",21,"""39FC264BEC36A627"""
+"""0442C41D67D6A845_22B25F253645B10F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3CCCC2(CCOC2)O3""",21,"""39FC264BEC36A627"""
+"""B6458DB4B3B9057F_B1551CEB74630A49_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(N(C)CC2=CSC=C2)=O""",21,"""39FC264BEC36A627"""
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+"""F6D1878D7F79385D_E41D93C46549F68F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NOC(=N2)N3CCCC3""",21,"""39FC264BEC36A627"""
+"""B1698E3EFCA8579C_5FF0C2D13FD4EEC9_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C)OC=C2C(F)(F)F""",21,"""39FC264BEC36A627"""
+"""06BB356FDCAE5D11_D2BDECC73E02D6BB_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=CC2=C(CN(C)C2)C=C3""",21,"""39FC264BEC36A627"""
+"""A77D2B57B654EB8F_10E7E820EB7442E8_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C(OCC)=O)[NH]N=C2""",21,"""39FC264BEC36A627"""
+"""0A4D975849EA6024_8F277DC0B3EE7699_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=C(C)O2)[S](=O)(=O)C""",21,"""39FC264BEC36A627"""
+"""A6A72E83DE4D28E2_6BAC1ADE3D4EFC6C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC3=C2N=C(C)O3""",21,"""39FC264BEC36A627"""
+"""5FC3C1DA9B151754_F60DED3EF0F7AE88_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC=CC(=C2)OC)F""",21,"""39FC264BEC36A627"""
+"""52C0DA888E476DEB_62894D4F217E5F71_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NN=C3[N]2CCOCC3""",21,"""39FC264BEC36A627"""
+"""3959CAAA2FC3A104_ED82A327C49F3783_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC3=C(C=C2)CCOC3""",21,"""39FC264BEC36A627"""
+"""3C46050A53858ACB_B9166BC46D51490A_6039_DP""","""O(CC1=CC=C(C=C1)CF)CC2(OC(CC23CNC3)=O)F""",21,"""39FC264BEC36A627"""
+"""97D0369DB03C8F72_41E2A063242B82F7_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=NC2=C(CC(C)CC2)S3""",21,"""39FC264BEC36A627"""
+"""D17D0CC6DA70081B_BCCACFE76EC305C9_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC=C(SC)C=C2)=O""",21,"""39FC264BEC36A627"""
+"""52B11FCC113CD2E5_694542BB596544DB_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CN=C(C(OC)=O)C=N2""",21,"""39FC264BEC36A627"""
+"""9BE2E5BE26BBDE84_D0349BF9827C26B7_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC(N2CCN(C)CC2)=O""",21,"""39FC264BEC36A627"""
+"""A26E8A1B6F045E4A_0ED4F67E6D773AAA_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C(F)(F)F)C=CC=N2""",21,"""39FC264BEC36A627"""
+"""0C2DF7EFB30B5C29_54ABDB263BB67AD7_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C(OCC)=O)SN=N2""",21,"""39FC264BEC36A627"""
+"""A264CF48039720AC_4A7EED1B351760B8_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CN=C3[N]2C=C(F)C=C3""",21,"""39FC264BEC36A627"""
+"""3DF4D11A7F245EC1_2D81B245C719B7AC_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCC(=O)N2CCCCC2""",21,"""39FC264BEC36A627"""
+"""FAD1A3C55D6CDFBD_63A84B6A6AC03EB9_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C(C)(C)C)C=CC=C2""",21,"""39FC264BEC36A627"""
+"""8CB97188AED07938_E1524ADDEF2F1FF2_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC2=CC(=C(C(=C2)F)F)F""",21,"""39FC264BEC36A627"""
+"""99CE55E01F9BBC56_502ECBBFB252D0CA_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC=CC(=C2)[S](F)(=O)=O""",21,"""39FC264BEC36A627"""
+"""99749A08FEDDCEF8_072447C5B961FD4D_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CN=C(C(F)(F)F)C=C2""",21,"""39FC264BEC36A627"""
+"""161455E0FA456CB2_F537922516B237E2_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=NC=C2)C(F)(F)F""",21,"""39FC264BEC36A627"""
+"""665655F1B0D0458A_4B211FEE9027897F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)C2=CC=C(C=C2)C#C""",21,"""39FC264BEC36A627"""
+"""6750938354F2D066_7B443581598A354B_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(OC(C)C)C=C2""",21,"""39FC264BEC36A627"""
+"""C2C3DED32223888B_C4F215A4157B7156_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=C(C(O)=O)C=C2)F""",21,"""39FC264BEC36A627"""
+"""F017E98363A28B8B_77C05F41AD317669_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(NC(C)=O)C=CC=C2""",21,"""39FC264BEC36A627"""
+"""0ED0E6DB3A39CF7F_9FA0F69B0859EC41_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3CN2CC(CCC2=O)O3""",21,"""39FC264BEC36A627"""
+"""AD48D231D5E3CB28_D657EC34F238D689_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NN=C(O2)N3CCCC3""",21,"""39FC264BEC36A627"""
+"""10C44181F485671A_9A156A68BC4BF509_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NOC3=C2CCCCC3""",21,"""39FC264BEC36A627"""
+"""781BDBE897A40DB8_C445882ED167994A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NOC=C2C(OCC)=O""",21,"""39FC264BEC36A627"""
+"""6331B67ACE9524F9_6790D7EAF9DF103C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NOC(=C2)C(OCC)=O""",21,"""39FC264BEC36A627"""
+"""4A7B13688CEFD041_AB5A751F77E17371_6039_UN""","""O(CC1=CC=C(C=C1)CF)C[C@@H](C(C)(C)C)N[S](=O)(=O)C""",21,"""39FC264BEC36A627"""
+"""44E1054275841E9C_1489C5590AC738E2_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(=O)C2=CN=C3[N]2C=CS3""",21,"""39FC264BEC36A627"""
+"""5E337BDD2965F04A_55D8FD98A868C514_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCOC2=CC(=O)CCC2""",21,"""39FC264BEC36A627"""
+"""048BDC8711F8CDBB_E4A119AC4D761334_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=C2)SCCC""",21,"""39FC264BEC36A627"""
+"""6FD5EEBE9A8F4983_7ED4A44087E5B7FF_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCC2=C(F)C=CC=C2F""",21,"""39FC264BEC36A627"""
+"""49FF43AC9C07D94E_B2167BFB0EE316DF_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NOC(=C2)C3CCCC3""",21,"""39FC264BEC36A627"""
+"""A0F910FB5F4814AE_23C5AA06841229C6_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=N2)C(C)(F)F""",21,"""39FC264BEC36A627"""
+"""500CF617FF173B79_A8965215E9D5A634_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(C2=CC(=CC(=C2)F)F)=O""",21,"""39FC264BEC36A627"""
+"""EEEA983DA4118930_15AC86AD5BFF82D9_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=C(C(CC)C)C=C2""",21,"""39FC264BEC36A627"""
+"""B4BEB2FF9F0EB5F1_196D3BFB89504796_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC3=C2OC(=N3)C""",21,"""39FC264BEC36A627"""
+"""E759B9C7127B9860_C3D3AD323BF0AEE0_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(NC(N=[S](C)(=O)C)=O)=O""",21,"""39FC264BEC36A627"""
+"""A9012430E77204F3_FD78562E928F4542_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C(F)(F)F)N=CC=N2""",21,"""39FC264BEC36A627"""
+"""302AD0C8394FE489_A68C314EAB53F1FF_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=C2)[S](C)(=N)=O""",21,"""39FC264BEC36A627"""
+"""29872C78B7250D12_4AE5E4B18562298F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NOC(=N2)C(OCC)=O""",21,"""39FC264BEC36A627"""
+"""DAB55B89830A1000_5BDBE27D5B62737B_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=N[N](C)C=C2[S](=O)(=O)Cl""",21,"""39FC264BEC36A627"""
+"""F109D3E4A2784751_64BBEE9736BCB325_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=N[NH]2)C(OCC)=O""",21,"""39FC264BEC36A627"""
+"""FD3A0BD2F71AEB8A_655474DECBED2A4E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3CC2(CCCC2)C(=O)O3""",21,"""39FC264BEC36A627"""
+"""CB3558841D15DB3E_01B38C1552770154_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=N[N](C)C=C2[S](=O)(=O)N""",21,"""39FC264BEC36A627"""
+"""041B7B275900180B_049EADA7278FAC62_6039_DP""","""O(CC1=CC=C(C=C1)CF)CC3CCC2(CCNCC2)O3""",21,"""39FC264BEC36A627"""
+"""2B1DD6D4F6F6CF4E_65EA22976A369EB1_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC(OC2CN(C)CCC2)=O""",21,"""39FC264BEC36A627"""
+"""01707A614B2BD5B9_5A6576DC6A32417C_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC(=NC(=C2)OC)OC""",21,"""39FC264BEC36A627"""
+"""C889F70305CD4BE9_97569458283D735A_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCC2(C(O)=O)CCOCC2""",21,"""39FC264BEC36A627"""
+"""44D15EEB2335F0DD_CD4D2237FF8B2228_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C(OCC)=O)C=NO2""",21,"""39FC264BEC36A627"""
+"""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"""
+"""7DAE6723E2A74F17_60A9BE23AA320B45_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C(C)(C)F)C=CC=C2""",21,"""39FC264BEC36A627"""
+"""3B614050E74EC573_6C4D6117E0C63E86_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C(OCC)=O)C=N[NH]2""",21,"""39FC264BEC36A627"""
+"""18F3ECCF1B4A1F50_D825813BA2860A49_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCOC2(CCOCC2)C#N""",21,"""39FC264BEC36A627"""
+"""196A5E0867BA1D62_4A104D9BC9A1E664_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC#CC2=CC=CC(=C2)OC""",21,"""39FC264BEC36A627"""
+"""302F2E2CAF527BC9_20951CA0C31D1FD3_6039_UN""","""O(CC1=CC=C(C=C1)CF)CCCO[S](C(F)(F)F)(=O)=O""",21,"""39FC264BEC36A627"""
+"""1A627BD83F51D425_B1ABEB6833F52B76_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC[S](=O)(=O)C2=CC=CC=C2""",21,"""39FC264BEC36A627"""
+"""A6846DAE897FDA52_BA47F0DC0565E040_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CN=C(OC)C=C2OC""",21,"""39FC264BEC36A627"""
+"""ADA0EA29D94EDED7_31DE1DF1BDC3B660_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CN=C(C(OC)=O)C=C2""",21,"""39FC264BEC36A627"""
+"""DCF521324EA3A70E_97515E556D3CC35E_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C([S](F)(=O)=O)C=CC=C2""",21,"""39FC264BEC36A627"""
+"""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"""
+"""0F9EBDE65E208464_7EB615357B0BA59F_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NC(=C(C=C2)[N](=O)=O)C""",21,"""39FC264BEC36A627"""
+"""AA9289884571665C_000A4AB32F7F9D22_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=CC=CC(=N2)OC(F)F""",21,"""39FC264BEC36A627"""
+"""41F61F1DDB1C924C_471F81B4D71FA01D_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC3=C[N]2C=CC=C(F)C2=N3""",21,"""39FC264BEC36A627"""
+"""EAF0DFEF9F90C473_120FCD7A9161B3FC_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=NN=C(O2)C3=CC=CO3""",21,"""39FC264BEC36A627"""
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+"""DD5BADA4A4C74DE1_6C6CDB4F358729FD_6039_UN""","""O(CC1=CC=C(C=C1)CF)CC2=C(C=N[N]2C)[S](=O)(=O)Cl""",21,"""39FC264BEC36A627"""
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+"""4E5020A2AF5AE1E4_35D65F73BE7E6B0B_6039_DP""","""N[C@@H]3CC[C@@H](OCC1=CSC(=N1)C2=C(OC)C=CC=C2)C3""",21,"""8E86621C0BB19007"""
+"""5000C0A01D962C65_B68CA72EF25D5EFD_6039_DP""","""N[C@@H]2CC[C@@H](OCC(C1=C(C=CC(=C1)C)OC(F)F)=O)C2""",21,"""8E86621C0BB19007"""
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+"""6191F28AA5DE51AE_19D195426BF9C4B2_6039_DP""","""N[C@@H]3CC[C@@H](OCC2=CC=C([N]1N=C(C)C=C1C)C=C2)C3""",21,"""8E86621C0BB19007"""
+"""D50B5566AC13E7A3_8B4D78E9859EB0D7_6039_DP""","""N[C@@H]3CC[C@@H](OCC1=CC(=CC2=C1OCOC2)[N](=O)=O)C3""",21,"""8E86621C0BB19007"""
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+"""8960E680028EDD7D_9569152208898CFD_6039_DP""","""N[C@@H]2CC[C@@H](OCC(=O)NC(=O)NCC1=CC=CC=C1)C2""",21,"""8E86621C0BB19007"""
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+"""E23133415170F880_4B119DC1EA9E0FD6_6039_DP""","""N[C@@H]2CC[C@@H](OCC(NC1=CC=C(CC(O)=O)C=C1)=O)C2""",21,"""8E86621C0BB19007"""
+"""BA31E1AB83D78C3B_F043FF27F05D4E1C_6039_DP""","""N[C@@H]3CC[C@@H](OCC1=CC(=NO1)C2=CC=C(OC)C=C2)C3""",21,"""8E86621C0BB19007"""
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+"""0FB9CC1CC1BE23DB_8328BEE3A416D1AF_6039_DP""","""N[C@@H]3CC[C@@H](OCC2=C1N=CC=CC1=C([N](=O)=O)C=C2)C3""",21,"""8E86621C0BB19007"""
+"""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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+"""63FA4FEB2B0B7AB2_03D9A10066A343E0_6039_DP""","""N[C@@H]2CC[C@@H](OCC(N(CC)CC1=CC(=CC=C1)F)=O)C2""",21,"""8E86621C0BB19007"""
+"""2A668AD6BEB0702F_A302AF6CC310B242_6039_DP""","""N[C@@H]2CC[C@@H](OCC(NC1=C(C(O)=O)C=CC(=C1)F)=O)C2""",21,"""8E86621C0BB19007"""
+"""AD840AA92025D26D_AD55B908A6EBF87F_6039_DP""","""N[C@@H]3CC[C@@H](OCC1=NC(=NO1)C2=CC(=C(C)C=C2)F)C3""",21,"""8E86621C0BB19007"""
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+"""387C1E30D9D52E6F_DE6B8E7DC6CA5DA3_6039_DP""","""N[C@@H]3CC[C@@H](OCC(=O)C1=CC2=C(C=C1)NC(=O)CC2)C3""",21,"""8E86621C0BB19007"""
+"""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"""
+"""77F080F1F4E35A95_14FF9CF8E1DD7836_6039_DP""","""N[C@@H]3CC[C@@H](OCC1=COC(=N1)C2=CC=C(OC)C=C2)C3""",21,"""8E86621C0BB19007"""
+"""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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+"""2DC6E04A35535DDD_8630E2EAEA895673_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC(=O)CCC3CCCC3""",21,"""EBB0E49182C40249"""
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+"""F2EA3FA99EE850EE_9E92B95AE2EA1A76_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCC[S](CCOC)(=O)=O""",21,"""EBB0E49182C40249"""
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+"""2C86E35806E2BC72_1BA5350C03074EEE_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=N[N](C)C=C3[N](=O)=O""",21,"""EBB0E49182C40249"""
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+"""1358825C407931EA_A26989CDB55B8430_6039_DP""","""O(C1=CC(=CC=C1)OC2CC2)CC(N3CCNCC3C)=O""",21,"""EBB0E49182C40249"""
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+"""C05519CEE4EBD674_E4FCEC876D919790_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=NN=C4C=CC=N[N]34""",21,"""EBB0E49182C40249"""
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+"""4B7153241E6FAD65_C5BA8EB305A3A5F3_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=NCC(C(OC)=O)O3""",21,"""EBB0E49182C40249"""
+"""F8907EE710D0FDA8_AEDA2F0ABEF3B96B_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CCNC(=O)N3CCCC3""",21,"""EBB0E49182C40249"""
+"""418C262247DA502F_BE3B32F81DE4478D_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=NOC(=C3)CC(C)C""",21,"""EBB0E49182C40249"""
+"""EF85A8A6B531FA35_0D74A0BD9B225687_6039_UN""","""O(C1=CC(=CC=C1)OC2CC2)CC3=N[NH]C(=C3)C(OC)=O""",21,"""EBB0E49182C40249"""
+"""2DDD110C3F851717_05DB875216A4642A_6039_DP""","""O(C1=CC(=CC=C1)OC2CC2)CC(N3CC(C)NCC3)=O""",21,"""EBB0E49182C40249"""
+"""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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+"""B28B53280574CA56_C3DAE73BB19DFFA3_6039_UN""","""CC2(OCC1=C(C=C(C(N)=O)C=C1)[N](=O)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
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+"""4D242B0FBB23D981_682BA2897E5F1F9E_6039_UN""","""CC3(OCC1=NN=N[N]1C2=CC=C(C)C=C2)CCOCC3""",21,"""84B4DA20177CEA26"""
+"""53235E6925EDB438_722641CB94083B88_6039_UN""","""CC2(OCC(N1CCN([S](C)(=O)=O)CC1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
+"""31657089B0AA0AC5_5DC2311DAB07E0ED_6039_UN""","""CC2(OCC1=CC=C(C(C)C(F)(F)F)C=C1)CCOCC2""",21,"""84B4DA20177CEA26"""
+"""DE45A484A1AAE2C5_020789EC293A0648_6039_UN""","""CC3(OCC1CN(CCO1)C2=CC=CC=C2)CCOCC3""",21,"""84B4DA20177CEA26"""
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+"""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"""
+"""7484A301295223F9_B9DBC0B1B378F8CF_6039_UN""","""CC2(OCC(C1=C([N](CCC)C(=C1)C)C)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
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+"""70B92F7E86755CE0_6B695067688E8B20_6039_UN""","""CC3(OCC(=O)C1=CC2=C(C=C1)NC(=O)O2)CCOCC3""",21,"""84B4DA20177CEA26"""
+"""B083357512DFC400_1720814BACE79BE8_6039_UN""","""CC2(OCC(N(C)CC1=CC=C(C=C1)C)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
+"""E1A7233A91D58743_EDA9D7F353A0C713_6039_UN""","""CC2(OCCCC1=CC=CC(=C1)C(F)(F)F)CCOCC2""",21,"""84B4DA20177CEA26"""
+"""494A0E5215907A47_04F204A665177C60_6039_UN""","""CC2(OCC(C(=C1C=CN(C)C=C1)C#N)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
+"""A483FBE0469D3BF3_B1D9966BD3A2F6D3_6039_UN""","""CC3(OCC(C1=C[N](C)C2=C1C=CC=C2)=O)CCOCC3""",21,"""84B4DA20177CEA26"""
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+"""C767EE90C18C37F7_7A33DBB796860EDA_6039_UN""","""CC2(OCC(C1=C(C(=CC(=C1C)C)C)C)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
+"""B410C9BCD5C2A356_FDDAB27B31C5DB8F_6039_UN""","""CC2(OCC1=NOC(=N1)CCCC(OC)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
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+"""50CF2F7B4DA563AD_2E77F629B40F5644_6039_UN""","""CC3(OCC2=NN=C(C1=CC=C(F)C=C1)O2)CCOCC3""",21,"""84B4DA20177CEA26"""
+"""295F28B053879385_F7CAA408F48DA61B_6039_UN""","""CC2(OCC1=CC(=C(C=C1)OC(F)F)OC)CCOCC2""",21,"""84B4DA20177CEA26"""
+"""A182BD04503CF2B7_2D07DD1B0BDA487A_6039_UN""","""CC3(OCC1=CSC(=N1)N(C(C)=O)C2CC2)CCOCC3""",21,"""84B4DA20177CEA26"""
+"""EB523692D6D3A246_E8DB53FAB8869FB8_6039_UN""","""CC3(OCCCC1=NC(=NO1)C2=CC=CS2)CCOCC3""",21,"""84B4DA20177CEA26"""
+"""0CA2A9DDC9675848_1D586B9AC2B47268_6039_UN""","""CC2(OCC(C1(NC(C(F)(F)F)=O)CC1)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
+"""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"""
+"""9FEC4835B8EB8A7A_4B8F00334411EB34_6039_UN""","""CC2(OCC(NC1=CC=CC(=C1)C(N)=O)=O)CCOCC2""",21,"""84B4DA20177CEA26"""
+"""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"""
+"""1604C7003E60A748_220EE52FCB2F3F0A_6039_UN""","""CC3(OCCCN1C(=O)NC2=C1C=CC=C2)CCOCC3""",21,"""84B4DA20177CEA26"""
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+"""DB87851EA9601B59_FC8F1309A9E38B17_6039_UN""","""CC(OCC(C1=CC(=C(C=C1)F)C)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""F463916F558856CD_B03B918E83F66EE6_6039_UN""","""CC(OCC2=NC1=C(C=CS1)C(=O)N2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""4A058681AE6A8E84_E9B59AB6C51816EC_6039_UN""","""CC(OCCCNC(=O)C1CCCC1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""1264B007CDCA51C0_28F3E4FBC4AE5CB7_6039_UN""","""CC(OCCN[S](CCCOC)(=O)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""080D08D1B180BC9B_1DC5B17C26CF737A_6039_UN""","""CC(OCC1=CC=C(OC(C)=O)C=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
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+"""DBAE869CFD2BB9E7_C3F9550554753B39_6039_UN""","""CC(OCC1=NOC(=N1)C2=COC=C2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
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+"""F2D802E904DC66B5_CFE4AF6E54225ACC_6039_UN""","""CC(OCC2=CC1=C([N](C)N=N1)C=C2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""82C25CB8523C3B29_470F50682E951EFA_6039_UN""","""CC(OCCNC(=O)C1=NC=CC=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""3DEF51901C9A7BBF_2A3A708F11A83B25_6039_UN""","""CC(OCC1=C([N](C)N=C1)C(F)(F)F)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""8B7D702DA330D4C6_2B5D00F1448E03CA_6039_UN""","""CC(OCC1=NC(=NO1)CCC(C)C)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""6171DFA33B5068F8_19A1FD346B751B95_6039_UN""","""CC(OCC1=NC(=NO1)C(SCC)C)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""055B96263DAA64FC_CDEB395F1052EA75_6039_UN""","""CC(OCC1=C[NH]C(=N1)C2=CC=CS2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""DF87638E9160F21F_5DAD57F36BFEA8DB_6039_UN""","""CC(OCC1=C(OC)C=CC(=C1)C#N)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""58437A3354FA82C7_DCD9A6FA35DDDCF5_6039_UN""","""CC(OCC1=CC2=C(C=C1)NC(=O)O2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""A0E26A5E8FBEC6FB_F603063C56D2AFE5_6039_UN""","""CC(OCCOC1=CC=CC(=C1)OC)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""270232F18DAC23B6_AAAD55C1B165D8D8_6039_UN""","""CC(OCC1=CC=C(C(OC)=O)C=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""C8239DD8AE5B6718_1E826D60AA53C415_6039_UN""","""CC(OCC(NC(NCC(C)C)=O)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""61CCB308436F2E69_BC04983E8186CDAB_6039_UN""","""CC(OCC(NC1CCC(C)CC1)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""6815C23C64EBEF7C_5E1B31F4FE0F8241_6039_UN""","""CC(OCC1=NC(=NO1)C2=CC=CO2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
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+"""E2D87637E7616563_960265472F14E4AA_6039_UN""","""CC(OCC[N]1C(=CN=C1C)[N](=O)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
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+"""689FD9F9AACF9C3F_0B590EE73157DD6C_6039_UN""","""CC(OCC1=NC=C(C(F)(F)F)C=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
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+"""F177FCDF5D869AB0_2C85AD0624AA8882_6039_UN""","""CC(OCC1=CC=C(C=C1)C2CCC2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""BC609C24F4972441_A4FC5A572A41DE0D_6039_UN""","""CC(OCC1=NN=C2[N]1CCCCC2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""09B3F180F78DE298_898C0E6906A18CA1_6039_UN""","""CC(OCC1=CC=CC(=N1)C(OC)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""28A00D4A5927F575_7AFBFC8860AACCBA_6039_UN""","""CC(OCC1=C([S](N)(=O)=O)C=CC=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
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+"""3C3FC19BFA4588EE_C73F5E3F73ED5AD3_6039_UN""","""CC(OCC1=CC=C([S](Cl)(=O)=O)C=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""B9997D5B6F4F95C5_3B742571A85BBBBD_6039_UN""","""CC(OCC1=CC2=C(N=C1)C=CC=C2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""FC596C0F3AF6180E_AF537178255DE671_6039_UN""","""CC(OCC1=CC=C([S](C)(=O)=O)C=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""F6CB0BE6423D5792_179D538D20264586_6039_UN""","""CC(OCC1=C(C=CC=C1)[S](=O)(=O)Cl)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""542AC686105542B6_279674DFE6CB39EC_6039_UN""","""CC(OCCCC1(CCOCC1)C#N)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
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+"""43958C8E1E81BFE7_7CE0D576EAC972F3_6039_UN""","""CC(OCC1=CC(=CC=C1)[S](=O)(=O)Cl)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""05E9F0592E75F06D_F3730941A77D4E7C_6039_UN""","""CC(OCC1=C(C(F)(F)F)C=CC=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""C1BDE5018A3E17D0_3BB60D69C3D524EA_6039_UN""","""CC(OCC(=O)COC1=CC=CC=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""251782A57F77E1AF_2FA01F1F4B37D332_6039_UN""","""CC(OCCC(CC(OCC)=O)(C)C)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""81A7CED1A3BFE156_1FABB6F37AED58E5_6039_UN""","""CC(OCC1=CC=C(NC(C)=O)C=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""6DC310AC1ACD6BB8_674A5425E736CE15_6039_UN""","""CC(OCC(C1=CC(=NC=C1)OC)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""43958C8E1E81BFE7_551F48D3EF5F169A_6039_UN""","""CC(OCC1=CC=CC(=C1)[S](Cl)(=O)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""D425AC32CAC7C2EE_2F9BDF22CFE8C3EA_6039_UN""","""CC(OCC1=CC=C([S](F)(=O)=O)C=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""631208780FCDFCF2_AEC40937E0207824_6039_UN""","""CC(OCC(C1=CC=CC(=N1)OC)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""93696976AF6DD308_AA46459FD83176E1_6039_UN""","""CC(OCCN1C2=C(CC1)C=CC=C2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""6974BBA657E77651_799AB7A4C065E25A_6039_UN""","""CC(OCC1=C(N=C(C(C)C)C=C1)C)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""7C2923BE39148C9F_7C05173A162B32B2_6039_UN""","""CC(OCC1=NC(=CS1)C(OCC)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""7702D166B106348F_E2EC2F4F653DC051_6039_UN""","""CC(OCC1=N[N](CC(F)(F)F)C=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""7A63C77FD90C3620_D8FEC65393A20907_6039_UN""","""CC(OCCN(C)CC1=CC=CC=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""40FF9FBA5FC1579A_65CC3FDF11257C49_6039_UN""","""CC(OCC1=CC=CC(=C1)[S](C)(=O)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""2F30A0CC014E3D74_219DD0467C4A815B_6039_UN""","""CC(OCC1=C[N](CC(OC)=O)N=N1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""3847B7EFFFDE9B65_2DDCC06B9E28A170_6039_UN""","""CC(OCC(N1CC(CC(C)C1)C)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""5865B2510047D4A1_0930227A3B347992_6039_UN""","""CC(OCC(N1CCCCC1CC)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""730339BC9D9A708F_32CE9783E1289602_6039_UN""","""CC(OCC1=CC=N[N]1C2CCCC2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""2E56AD3D5EF01988_77320A5C28029D0E_6039_UN""","""CC(OCC1=CC=N[N]1CC(F)(F)F)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""CE400C270EBD3DD1_80F491C0C59C6BAD_6039_UN""","""CC(OCC2COC1=C(C=CC=C1)O2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""918F75E86ED0D57B_E881A3B07CD7016F_6039_UN""","""CC(OCC(N(C)CC1=CC=CO1)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""08915199A6501416_DE7F1740DDD2ED41_6039_UN""","""CC(OCC(=O)CCC1CCCCO1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""A39A06B5B0EBBA05_10DFE01B7D975496_6039_UN""","""CC(OCCC(NC1=NOC(=C1)C)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""F54BACC80E0A56A7_032245338808EA7C_6039_UN""","""CC(OCC(=O)NC1=C(C=CS1)C#N)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""161C6E70A81670A2_9C3B35B7F71E19DE_6039_UN""","""CC(OCC1=NOC(=C1)C2=CC=CS2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
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+"""5DAA3BC75534383F_D5CEB31FFACA0FD8_6039_UN""","""CC(OCC(C1=C(OC)C=CC=C1)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""F5B4A1258CF3D1C8_B9AB9DFF12BE0357_6039_UN""","""CC(OCC1=CC=CC(=C1)C(F)(F)F)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""518D92B8659BC30A_19CD4F49B470E7E6_6039_UN""","""CC(OCC1=C(F)C=C(C(=C1)C#N)F)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""149FE8B1FC444525_5FEFC7558E721915_6039_UN""","""CC(OCC1=C(CC(C)C)C=CC=C1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""2F6485152107E604_A3BEEEB802218E70_6039_UN""","""CC(OCC(=O)NCC1CCCCC1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""5F378D13C6BE0630_F3A7107D1E42E27F_6039_UN""","""CC(OCC(N(C)C1CCCCC1)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""07DD4360C4BF6B5D_967A26C947BE8BDC_6039_UN""","""CC(OCC1=NC(=NO1)COC(C)C)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""B9AE1056EA799CBA_CA300898637CBCB9_6039_UN""","""CC(OCC2COC1(CCOCC1)O2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""FD17F6343C98B588_AE97F0B1EFC61938_6039_UN""","""CC(OCC1CCCC(C(F)(F)F)O1)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""1B394C9BC81CA9D3_5A80E8CD0473BDC3_6039_UN""","""CC(OCC1=NSC(=N1)C(OCC)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""FD939D90D780A1D0_3EE8D6BC0B0049B0_6039_UN""","""CC(OCCCCCCCCCCC)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""1EA4DACAAA75ACCA_04BD758C2142EB51_6039_UN""","""CC(OCC1=NN=C2C(=O)NC=C[N]12)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""9629D237182EC0C8_89396123AC033E20_6039_UN""","""CC(OCC1=NC(=C(S1)C(C)(C)C)C)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""862D30CD1C8711B4_7B00BB205EDE89D1_6039_UN""","""CC(OCC1=CC2=C(C=C1)C=NC=C2)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""79FE221783EB6545_C60BE530510468B2_6039_UN""","""CC(OCC1=C(C)C=C(C=C1C)C#N)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
+"""C4F5622A1F3AE930_66567557D7384516_6039_UN""","""CC(OCC1=CN=CC(=C1)C(OC)=O)C(C)CCCC=C""",21,"""8B5E1C923CA462E4"""
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+"""893B273FF2FA97A6_EAE2F5FC063CE948_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=CC=C(C(C)(C)C)C=C3""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""AD8BC62944A805C9_98627B03A7635691_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(CC)C3CC[S](=O)(=O)C3)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""71C8F97227186DD9_BFA964AF89AECFB7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(=O)N3CCC4=C3C=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""96935B71AC499B70_4FFED0FFAF9CF82D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC=C(C3=CC=C(F)C=C3)O4""",21,"""FAB9FDD82DB15728"""
+"""D3ED002EE23D58A5_96A016C41568B07E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(NC3=C(C(N)=O)C=CS3)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""20396909586A4B9D_3B180E884408A1EC_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C3=CC4=C(C=C3)CCCC4""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""7AAC158C811921F0_02EBD4E9A8383CEE_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC[S](=O)(=O)C3=CC=C(C=C3)C#N""",21,"""FAB9FDD82DB15728"""
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+"""2EA679B17850162A_9A42384C999E0B3E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=CC(=C3)SC(N(C)C)=O""",21,"""FAB9FDD82DB15728"""
+"""A3B77B6C2CB9D910_416E42EF09EEAE34_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC3=C(C=CC(=C3)[N](=O)=O)O4""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""29FDC369B88595C4_5D18F7CF867BDA4B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC4=C(N(C)C3=O)C=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""909D534963F69F59_4A9DB2CA5CFEEF48_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NOC(=N3)C4=C(C)C=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""E8D716ED472032BA_D9A41A6F8A0956F0_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CN=C(OCC(F)(F)F)C=C3""",21,"""FAB9FDD82DB15728"""
+"""755238C27AF737B0_5773F2A6F976A967_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=NN=C(C(C)(C)C)S3)=O""",21,"""FAB9FDD82DB15728"""
+"""97117DC359806289_EFF38F7EC12D41F9_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NN=C([N]3C)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""45AD6E9A23459A7D_AFEA8712B651280A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC3=CC=CC(=C3)OC(F)(F)F""",21,"""FAB9FDD82DB15728"""
+"""59AD27209A0892B9_E0C12BC32025BFD1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=NO3)C4=CC=C(F)C=C4""",21,"""FAB9FDD82DB15728"""
+"""E51CBD0C2F82A995_CDB725D302E7817D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C(=C(C)[NH]3)C(C)=O)C)=O""",21,"""FAB9FDD82DB15728"""
+"""DF4D6056444C1FBB_10D70793BED09539_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N3CCSC4=C3C=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""44CAD4D263B741CA_BDD7C0C38B5042AD_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=C(C(N)=O)C=C3)[N](=O)=O""",21,"""FAB9FDD82DB15728"""
+"""BA779A25C07EA902_B8008376D7715417_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(=O)NC(=O)NC3CCCC3""",21,"""FAB9FDD82DB15728"""
+"""13CBCA342078C11F_88A0F7AEA974F7F9_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NC(=O)CC3=CC=CC=C3""",21,"""FAB9FDD82DB15728"""
+"""AFEC0CC966E28EF2_CF5A1CE37FD7B3F9_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC(=C(C)C=C3)[N](=O)=O)=O""",21,"""FAB9FDD82DB15728"""
+"""773AC0C7525FD1BE_431FC8F4704605CE_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=CC(=C3)C(C)=O)=O""",21,"""FAB9FDD82DB15728"""
+"""303DB12BC641B857_FF092CC4028789E8_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC(C(OC)=O)CC(C)C)=O""",21,"""FAB9FDD82DB15728"""
+"""8842203F6980CB82_8B598C5A51784082_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N=C3N=C(SCCC)NS3)=O""",21,"""FAB9FDD82DB15728"""
+"""512F8DDDD97AD40C_4DF0090B6F4309EB_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NC3=CC4=C(C=C3)CCC4""",21,"""FAB9FDD82DB15728"""
+"""D2A400CEC849BC18_A60529FA6FB8CBC8_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC3=C(C=C([N](=O)=O)C=C3)[NH]4""",21,"""FAB9FDD82DB15728"""
+"""E654BA5BBD2B8C43_E082A5F277163743_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(=O)N4CCC3=C(C=CS3)C4""",21,"""FAB9FDD82DB15728"""
+"""30140CC480A87321_E3FDE31D7CBDC491_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C3=CC4=C(C=C3)OCCO4""",21,"""FAB9FDD82DB15728"""
+"""920737A956C6698C_7111BE36F0DBCAC7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCN3C(=O)OC4=C3C=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""570B1A1C1D04F0AF_4112B8018B8448DA_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NC(=O)NC3=CC=CC=C3""",21,"""FAB9FDD82DB15728"""
+"""2E602DF7B981B304_C8D6ADF43687F33B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C(CC(C)C)C=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""8B6A040450A4E551_BD8B197466FF7706_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C([S](N)(=O)=O)C=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""6C8D0B531B48B5FA_7C3B608023340508_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(C(O)=O)C=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""868FCEC37FB5A219_C82B01C8FA28EB76_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N(CC3=CC=CS3)C4CC4""",21,"""FAB9FDD82DB15728"""
+"""D6E746A9AC1603B7_8264E4D00EEAA581_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=C([N](=O)=O)[N]3C=CC=CC3=N4""",21,"""FAB9FDD82DB15728"""
+"""BA7F513DB1C29796_0B6D5272B5E1E20A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC3=C(C)C=CC=C3C(N4)=O""",21,"""FAB9FDD82DB15728"""
+"""0895C2EB4F4D776F_40AE9D99B3D6F7E3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NC3(CCCCCC3)C#N""",21,"""FAB9FDD82DB15728"""
+"""0BF6E1E539609A1E_3ED093516F005DEC_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC(=NO3)C(C)(C)C)=O""",21,"""FAB9FDD82DB15728"""
+"""9EB8AF6DAACCC6DB_99F5EF9E20AA5078_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C)C4=C(O3)C=CC=C4)=O""",21,"""FAB9FDD82DB15728"""
+"""C55593C57849C0CB_8D97E715BC9AD0C4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C=CC(=C3)OC)OC)=O""",21,"""FAB9FDD82DB15728"""
+"""CBC45E7D72F66CEF_F4924FC39094897D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=NO3)C4=C(C)C=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""43B58E3B90C91865_BA44DD4106522F8B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC[Si](OCC)(OCC)OCC""",21,"""FAB9FDD82DB15728"""
+"""0667A223BF483229_D590CAF7368F6EDB_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N3CCCC4CCCCC34""",21,"""FAB9FDD82DB15728"""
+"""E2AEADDA469F1371_1D5CCA0275E80421_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCN4C=NC3=C(C=CC=C3)C4=O""",21,"""FAB9FDD82DB15728"""
+"""2F62A7E287867C5F_81B6210A324C45ED_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC(C)C3CC4CCC3C4)=O""",21,"""FAB9FDD82DB15728"""
+"""6B6DCBCD5A771103_B07A837646521634_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=C(C=C3)C4CCCCC4""",21,"""FAB9FDD82DB15728"""
+"""B2446A4666430CF7_3963C77DF21565E3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=NO3)C4=CC=CC(=C4)C""",21,"""FAB9FDD82DB15728"""
+"""6D306BBFD3909D21_BF56BE7F68AE0B99_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=CC(=C3)C(C)C)=O""",21,"""FAB9FDD82DB15728"""
+"""7EDC3376EBC6C852_94F9A0937F86B1CB_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(NC3=CC=CC(=C3)OC)=O""",21,"""FAB9FDD82DB15728"""
+"""85FC6FBD1AF9B682_0A90C3F6053DB2AA_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NOC(=N3)C4=CC=C(F)C=C4""",21,"""FAB9FDD82DB15728"""
+"""44294EC7189C2DB6_B25FE2BD55791936_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCN4C(=O)NC3(CCCC3)C4=O""",21,"""FAB9FDD82DB15728"""
+"""145A0C9F23BFCFFB_80E99D0F8C3963B0_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=NO3)CC4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""1AB72A6BA7267935_A4D7BDF36EE5CD37_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NCC3=CC=C(C=C3)C#N""",21,"""FAB9FDD82DB15728"""
+"""A65EE01C663E52C9_2742DEA21AD1B8B4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C(NC(C)=O)C=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""D465358ECD2C5035_AB54CBBF860FB2BB_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC=C(C3=C(F)C=CC=C3)O4""",21,"""FAB9FDD82DB15728"""
+"""603EB676B2C374B5_C723B5511513A84E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=C(C(OC(C)C)=O)C=C3""",21,"""FAB9FDD82DB15728"""
+"""5F71CD5B5E8CD321_913BC156C009B88E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CSC(=N3)C(OCC(C)C)C""",21,"""FAB9FDD82DB15728"""
+"""F14F4BB6F17AD366_6F22C2987538FE68_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=C(C(OC)=O)C=C3)OC""",21,"""FAB9FDD82DB15728"""
+"""0D09AC0DAFA28821_220464B565532D5B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=CC=CC(=C3)C(C)(C)C""",21,"""FAB9FDD82DB15728"""
+"""6D92F3D12DA5696A_C24B08E181658212_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C[S](=O)(=O)C3=CC=CC=C3""",21,"""FAB9FDD82DB15728"""
+"""AE9A897819EB2AEF_5019647A0AFF358B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=N[N](C3=CC=C(F)C=C3)C=C4""",21,"""FAB9FDD82DB15728"""
+"""4DBED5A12BC6DA06_522CA2851CB8D0BB_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NN=C(C3=C(C)C=CC=C3)O4""",21,"""FAB9FDD82DB15728"""
+"""45166E46BD2C3BBB_02A797CD5014CD92_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC=C(C3=CC=C(C)C=C3)O4""",21,"""FAB9FDD82DB15728"""
+"""36C5BEFB551136AA_D763DF18F63C1683_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC3=CC=C(OC(F)(F)F)C=C3""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""6EC0AB0F837B9F9F_AAEF5CE3901256DC_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C(O)=O)C=C(C=C3)[N](=O)=O""",21,"""FAB9FDD82DB15728"""
+"""4E09E70FF2AE20F7_B4295DDC7CFF86DF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=CC(=C3)C(OC)=O)=O""",21,"""FAB9FDD82DB15728"""
+"""B0FBE83801C3922B_3D14640132C3A1A5_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=C(C(O)=O)C=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""E4707E7AC6CF96D8_0D98A7DB686D4D83_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=CC(=C3C#N)C(OC)=O""",21,"""FAB9FDD82DB15728"""
+"""C5CA158C468738D6_D3F387D7418E24D4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=C(C(C)C)C=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""BB9CB1F3633BC90F_E9AEBDF3CE82A88C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C[N](N=C3)CC4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""8B1DBEF1953C7A8A_93588AE1757D81D2_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(OC)C=CC(=C3)C)=O""",21,"""FAB9FDD82DB15728"""
+"""BDBC2891925ED39F_62F593F9F0D1C21E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(C=C(C)C=C3C)C)=O""",21,"""FAB9FDD82DB15728"""
+"""8099681032C115DF_57B03FF8F45AA634_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=C(OCC)C=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""6924FD9A9478A9E2_717B0E83FEA681FF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(CC)C=CC=C3C)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""DFB96FE2F7144A35_6C60DFB62FCBEE41_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=C(C=C3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""D014F4BC38D8107D_9BD47B9E4DAC3922_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(C(N)=O)C=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""80A2190AC7A63320_B8C902A4B0E5FA45_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCN4C(=O)C3=C(C=CC=C3)C4=O""",21,"""FAB9FDD82DB15728"""
+"""4FFE6D298E977055_0582E68942809484_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NCC3=C(OC)C=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""28BE7A5FE27369F2_D75D464EE476B43C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=C(C=C3[N](=O)=O)F)OC""",21,"""FAB9FDD82DB15728"""
+"""83969B1398365A77_FE72782D4E970C14_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCCCCCCCCC(O)=O""",21,"""FAB9FDD82DB15728"""
+"""6C0D47E8A8F81A3E_B12A0D16DE6894D6_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=C([S](N(C)C)(=O)=O)C=C3""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""EA2D673B0177060F_0367045FB26A5A88_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCC3=C4C(=CN=C3)C=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""704BB30F1ABB0C34_C86EEE787FEFA3D0_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=NO3)C4=C(C)[N](N=C4)C""",21,"""FAB9FDD82DB15728"""
+"""5C014D3864FF99DA_B1EC82E769A9CEC4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=C(C(OC)=O)C=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""B41B3F943F0F4851_F2B04C07FA8A68A8_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NOC(=C3)C4=CC=C(F)C=C4""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""BD72B48EEDA597C6_23CF16E591CA5DE3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=C(C(C)C(F)(F)F)C=C3""",21,"""FAB9FDD82DB15728"""
+"""FDCE20CF3A5AC21C_7C0AAE1413F7BB46_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3CN(CCO3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""E5EE52D0FE072099_8DDB02BC14B84DB2_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=CC3=C([N](C(C)C)N=C3)N=C4""",21,"""FAB9FDD82DB15728"""
+"""9DA4C63CA3390A74_D11EFC0CF43D105E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NC(=O)NCC3=CC=CO3""",21,"""FAB9FDD82DB15728"""
+"""65A3F84CA2CFB742_E281173F6863C5B5_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C([N](C(C)C)C(=C3)C)C)=O""",21,"""FAB9FDD82DB15728"""
+"""61F79D97B3E5470F_ECF67C5726E3C7F4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(NC(NCC(F)(F)F)=O)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""6354AD1FFC687CF1_89B73522DED1794B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4ON=C(C3=CC=C(F)C=C3)C4""",21,"""FAB9FDD82DB15728"""
+"""5D351C7A5BD7122B_E9223ABDDF841606_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=NO3)C4=C(F)C=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""4CC77746CED9BD1F_5FEADF2F6429BD71_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C)CC3=CC=C(C=C3)F)=O""",21,"""FAB9FDD82DB15728"""
+"""B2AF1FD349931EA9_7B61B7E419DDE6F7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CSC(=N3)C4=CC=C(F)C=C4""",21,"""FAB9FDD82DB15728"""
+"""CE0DABD72A1924E2_A8027906C7671B3C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=CC=C([S](N)(=O)=O)C=C3""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""BEFF9869601D5AA9_1FB9DCB7F4EC1EDF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=COC(=N3)C4=CC=CC(=C4)F""",21,"""FAB9FDD82DB15728"""
+"""E1C34BF1FA1CD439_BA57B2BFF675593B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=NC(=CC(=O)N3)OC)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""C37F0AE45CB4618F_AEDD7EBB079CE27A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=C(C(C)C)C=C3)C(C)C""",21,"""FAB9FDD82DB15728"""
+"""46BFF2D2EB8ABBC9_0E5535997E7F311E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NC=C(C3=CC=CC(=C3)F)O4""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""0CC1913F0E2FACAA_6A10FC03CBFBCD5B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC4SC3=C(C=CC=C3)NC4=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""BC77D35DE61DAD17_BA9742F489A0F1DD_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CN=C(N=C3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""F4B8E41EB7E52D93_900BB75E39F75525_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C(OCC)=O)C(=CC=N3)C""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""6675E90EA17E6F44_C8E9B59A57E8AC33_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)NC3=CC4=C(C=C3)OCO4""",21,"""FAB9FDD82DB15728"""
+"""23211DF47CAD3967_9B22F9102642F163_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N3C4=C(CC3C)C=CC=C4)=O""",21,"""FAB9FDD82DB15728"""
+"""2FB0067821855E81_ADB97B7A822FF262_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N3CCCC4=C3C=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""E1FA6D13F6B27E33_071BA84E652DC77F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=C(C(C)C)C=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""F0C732562DACEB6C_8ACAE088C0EB9574_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=CC=CC(=N3)C(OC)=O)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""D696B3B690A18388_5D6980BA0320D10C_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NCC3=CC=C(OC)C=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""1D897971CCDF3291_1564779F5243362E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)C3=CC4=C(C=C3)NC(=O)O4""",21,"""FAB9FDD82DB15728"""
+"""EF56FFC075D0FD0A_692DA6B3962A26E6_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C)CC3=CC=C(C=C3)C)=O""",21,"""FAB9FDD82DB15728"""
+"""F1716FB4C6908BB7_93A4F00B696D7A1D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCC3=CC=CC(=C3)C(F)(F)F""",21,"""FAB9FDD82DB15728"""
+"""91DB0F75AC32A333_7AFF235E5FDAC16E_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C(=C3C=CN(C)C=C3)C#N)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""70363CF6AECA72EC_AD3B8B0101586269_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC(C(CC)C)C(=O)OC)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""250CEA3054FE8D84_F6DE67D335024458_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NOC(=N3)CC4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""31E7E1710023B296_507AD1D18EC2EB4A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=NN=C(C3=CC=C(F)C=C3)O4""",21,"""FAB9FDD82DB15728"""
+"""3277CBE4284BE445_89C783F0CE401B15_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=C(C=C3)OC(F)F)OC""",21,"""FAB9FDD82DB15728"""
+"""285A0B61310AD62F_530AFAE33117F574_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CSC(=N3)N(C(C)=O)C4CC4""",21,"""FAB9FDD82DB15728"""
+"""CCDAC29B0EDF4768_96D67402824B22B6_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCC3=NC(=NO3)C4=CC=CS4""",21,"""FAB9FDD82DB15728"""
+"""B5827B955A69CAE7_63554C62F879CF66_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3(NC(C(F)(F)F)=O)CC3)=O""",21,"""FAB9FDD82DB15728"""
+"""63A148DA3FF95C5D_B5F1EAF42799E474_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC(C(F)(F)F)N3CCOCC3""",21,"""FAB9FDD82DB15728"""
+"""4A9FEFFFA6E1823F_FCF13F1FE7DCBBE3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=CC(=C(OC)C=C3)OC""",21,"""FAB9FDD82DB15728"""
+"""745DCBDBF269C54F_358227CB7EDC563A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(NC3=CC=CC(=C3)C(N)=O)=O""",21,"""FAB9FDD82DB15728"""
+"""0A619E59C8A78E32_8D4B4C22948AB83D_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C(C3=C(C)C=CC=C3)=O)(F)F""",21,"""FAB9FDD82DB15728"""
+"""36EDC60F354CF455_291528097D918716_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=N[N](C)C4=C3C=CC=C4)=O""",21,"""FAB9FDD82DB15728"""
+"""0E85A856DB077F43_5C03C2D7F1E28204_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCN3C(=O)NC4=C3C=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""A45462E8357B864A_58CC099D50CB8B2F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N4CCC3=C(C=CC=C3)C4""",21,"""FAB9FDD82DB15728"""
+"""6B88CD3C3F569315_BB43ABCBC53D7E09_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=CC=C3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""DA6069B089AD03A8_D8E97EE9AAC13518_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=C3C=CC=CC3=C(C=C4)C#N""",21,"""FAB9FDD82DB15728"""
+"""C3699BC3655999DF_D9F66A644AA0BF36_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCC3=C(OC(F)(F)F)C=CC=C3""",21,"""FAB9FDD82DB15728"""
+"""04CFC60C70A776A4_543946305A60C149_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCCC3=CC(=C(OC)C=C3)OC""",21,"""FAB9FDD82DB15728"""
+"""1438A9FEB28516E7_A416A25AD51BA0E4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=C(OC)N=C3C=CC=CC3=C4""",21,"""FAB9FDD82DB15728"""
+"""A4ECFC1F76DFBC96_B42C93F3C4DFABC3_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=CS3)C4=CC=C(F)C=C4""",21,"""FAB9FDD82DB15728"""
+"""AAEDECF913E62804_22BEEE8AF6D23CB1_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=CC(=C3OCOC3=C4)C5CC5""",21,"""FAB9FDD82DB15728"""
+"""6CE9A6B934CE849C_D58CFDFBC785A51A_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=CC(=C3)[N](=O)=O)[N](=O)=O""",21,"""FAB9FDD82DB15728"""
+"""08312F1D3580258A_5E808BA89FC14FE4_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=C(C=CC(=C3)C(OCC)=O)F""",21,"""FAB9FDD82DB15728"""
+"""FB69E2B157B2AD84_F07A9105436AC475_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC4=N[N]3CCCC3=C4C(OC)=O""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""DF0499473949196A_FE194708FCFAB8FA_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(=O)N(C3CC3)C4=CCCCC4""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""77B99FA387C71EB0_646FA6D0F1F77AC7_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(C3=C(C)[N](C(=C3)C)CC#C)=O""",21,"""FAB9FDD82DB15728"""
+"""39E384914E2704FF_80B7996EE5D3E688_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3(O)CSC(=N3)C4=CC=CC=C4""",21,"""FAB9FDD82DB15728"""
+"""572D2A2A949452EC_37495143F2B5D955_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC=C(CCC(OC)=O)C=C3""",21,"""FAB9FDD82DB15728"""
+"""685FBD4B2C7F2866_6AB71840AB00C12F_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC(N(C(C)C)C3=CC=CC=C3)=O""",21,"""FAB9FDD82DB15728"""
+"""C5DE3DA23C737007_7CA4301378E4C424_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOCCO[Si](C(C)(C)C)(C)C""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""FAE4155FF28FCA52_419427B3ADEEB69B_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CCOC3=CC=C(C(F)(F)F)C=C3""",21,"""FAB9FDD82DB15728"""
+"""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"""
+"""B5B026646C52D8B9_C85FA78277C74EEF_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=NC(=CC(=N3)C(OCC)=O)C""",21,"""FAB9FDD82DB15728"""
+"""F11C222A3C6DFF0A_4530E80DA035C6AB_6039_UN""","""O(CC2C[C@@H]1C[C@@H]1C2)CC3=CC(=NO3)C4=CC=C(C)C=C4""",21,"""FAB9FDD82DB15728"""
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+"""04BFEEE5E8B677AB_64A2AE990F6376A7_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CCC[S](N(C)C)(=O)=O""",21,"""FE098A7998CE26B0"""
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+"""A05C9817AB126A04_E4243B00D8152E38_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CC3=CC=C(CC)C=C3""",21,"""FE098A7998CE26B0"""
+"""97B432380D8ABE8C_3BF3ABC0AB04D3C6_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CCC3=CC=C(C)C=C3""",21,"""FE098A7998CE26B0"""
+"""CF8699E0983DED2B_F865FCECDDE12A93_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CC3=CN=C(OC)C=C3""",21,"""FE098A7998CE26B0"""
+"""2A383E21056E8670_2584BDADB4264CDE_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CC3ON=C(C(C)C)C3""",21,"""FE098A7998CE26B0"""
+"""861D8D8AC63CE832_DF5472DD5C9454FE_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CCC3COC(C)(C)O3""",21,"""FE098A7998CE26B0"""
+"""AE369992F49D9357_9ABEAD335B6B11B0_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CC(NC(C)C(=O)O)=O""",21,"""FE098A7998CE26B0"""
+"""397E3CEB36CD8C77_87DF340C24329392_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CC(NCCOCC)=O""",21,"""FE098A7998CE26B0"""
+"""B573EB661C0DE249_AB5FCF773DC1B1D9_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CC3=C(C=CC(=C3)F)F""",21,"""FE098A7998CE26B0"""
+"""25000849197DC531_E5D9A1C6878C158F_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CC3=C(OC)N=CC=C3""",21,"""FE098A7998CE26B0"""
+"""14968E800C5AD10E_E6509D936ABB04B8_6039_UN""","""O(C[C@@H]1C[C@H]1C2=CC=C(C=C2)F)CCOCC3CCCO3""",21,"""FE098A7998CE26B0"""
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+"""68775E74917E4439_EAEA960C778CB685_6039_UN""","""COC(COCCCCCCCCCCCC)C1CCC1""",21,"""2A0E6A99DC2BC3B1"""
+"""ACE689756D7F0E13_6D60A84E5DDBE0AE_6039_UN""","""COC(COCC(N1CCC(C(N)=O)CC1)=O)C2CCC2""",21,"""2A0E6A99DC2BC3B1"""
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+"""B0D66EF7E413C852_DA007B9241020612_6039_UN""","""NC(=O)C1=C[N](N=C1)CCOCCN2CC(C)CC(C2)C""",21,"""D52624A37DA59C92"""
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+"""0694420FB361A355_4E4427C74CD41467_6039_UN""","""NC(=O)C1=C[N](N=C1)CCOCC(C2=N[N](CC)N=C2)=O""",21,"""D52624A37DA59C92"""
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+"""618CAF36B1EC9553_ACD102D71F7FD8A3_6039_UN""","""C[C@H]1[C@@H]3C[C@H](C[C@@H]1OCCSC2=CC=C(C)C=C2)C3(C)C""",21,"""5A763947F0B0D4D0"""
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+"""C9A9A2DAA819BA0E_7F890D05D256A28B_6039_UN""","""C[C@H]1[C@@H]4C[C@H](C[C@@H]1OCC3=NC2=C(C=CC=C2)O3)C4(C)C""",21,"""5A763947F0B0D4D0"""
+"""910E588835ACA893_1765E351534AC795_6039_UN""","""C[C@H]1[C@@H]2C[C@H](C[C@@H]1OCC[S](CCC(N)=O)(=O)=O)C2(C)C""",21,"""5A763947F0B0D4D0"""
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+"""E5756D6050559785_2A6069B5A4B12CA9_6039_UN""","""C[C@H]1[C@@H]2C[C@H](C[C@@H]1OCCCC(N(CC)CC)=O)C2(C)C""",21,"""5A763947F0B0D4D0"""
+"""424C90136D6B3207_9E8C99E3C642DEF9_6039_UN""","""C[C@H]1[C@@H]2C[C@H](C[C@@H]1OCCCCCC(OCC)=O)C2(C)C""",21,"""5A763947F0B0D4D0"""
+"""820704859D5FDD60_E7AAE2B0B70FC51B_6039_UN""","""C[C@H]1[C@@H]3C[C@H](C[C@@H]1OCC(N2CC(C)OCC2)=O)C3(C)C""",21,"""5A763947F0B0D4D0"""
+"""0EA266AB75821613_AEC5730A425D2B78_6039_UN""","""C[C@H]1[C@@H]3C[C@H](C[C@@H]1OCC(NC2=NC(=CS2)C)=O)C3(C)C""",21,"""5A763947F0B0D4D0"""
+"""D61810AFEA03BCF9_BAE6FD608709C906_6039_UN""","""C[C@H]1[C@@H]3C[C@H](C[C@@H]1OCC2=C(F)C=C(C=C2)C#N)C3(C)C""",21,"""5A763947F0B0D4D0"""
+"""063CEBC558E8848D_EA17EA7170D0E5CB_6039_UN""","""C[C@H]1[C@@H]4C[C@H](C[C@@H]1OCC3=NC2=C(C=CC=C2)[NH]3)C4(C)C""",21,"""5A763947F0B0D4D0"""
+"""F91FFB420082D479_455F05893437576B_6039_UN""","""C[C@H]1[C@@H]3C[C@H](C[C@@H]1OCC2=NC(=NO2)CC(C)C)C3(C)C""",21,"""5A763947F0B0D4D0"""
+"""9F4C33D271B1F67E_04591A9EA2D6DACF_6039_UN""","""C[C@H]1[C@@H]3C[C@H](C[C@@H]1OCC2=C(C=C(C)C=C2C)C)C3(C)C""",21,"""5A763947F0B0D4D0"""
+"""45B60EC38A872E1E_6E7A8EB3881D0C0A_6039_UN""","""C[C@H]1[C@@H]3C[C@H](C[C@@H]1OCC2=NC(=NO2)CCCC)C3(C)C""",21,"""5A763947F0B0D4D0"""
+"""1704112D96774C69_39ADA9A25A160BDD_6039_UN""","""C[C@H]1[C@@H]3C[C@H](C[C@@H]1OCC2=C(C(OC)=O)C=CO2)C3(C)C""",21,"""5A763947F0B0D4D0"""
+"""897D7B2ED6CD4DD7_A5293112E4FB5297_6039_UN""","""C[C@H]1[C@@H]2C[C@H](C[C@@H]1OCC(N(C)C(C)(C)C#N)=O)C2(C)C""",21,"""5A763947F0B0D4D0"""
+"""D8FE99BF68D370FB_98058F3319CC3236_6039_UN""","""C[C@H]1[C@@H]2C[C@H](C[C@@H]1OCC(NCCC(OC)=O)=O)C2(C)C""",21,"""5A763947F0B0D4D0"""
+"""2DBA65C3FC70A595_2B40A47EC073EC96_6039_UN""","""C[C@H]1[C@@H]4C[C@H](C[C@@H]1OCC3COC2(CCCC2)O3)C4(C)C""",21,"""5A763947F0B0D4D0"""
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+"""F6CDE3096EEE0046_497FC9F8D1420BD8_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCC(NC(N)=O)=O""",21,"""5A9F5D185F50D637"""
+"""796D20FB8264DFC1_C0EE9FE6AD8A479A_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCN2CCCC2=O""",21,"""5A9F5D185F50D637"""
+"""23F60FFDB5350D57_C877757FB1B1809A_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NN=C(OCC)S2""",21,"""5A9F5D185F50D637"""
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+"""DB629C7560B765E8_21B4A3C328B05C42_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC(=NO2)COC""",21,"""5A9F5D185F50D637"""
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+"""E5199C606D93EEB9_E38C0425404D043E_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)NC2CCCC2""",21,"""5A9F5D185F50D637"""
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+"""CE90E247D43FE6CE_93318747685591F4_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NN=C(CCC)S2""",21,"""5A9F5D185F50D637"""
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+"""AD090C5AEB7E2F39_C0815318ABB84175_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)C2CCCCC2""",21,"""5A9F5D185F50D637"""
+"""D50946F4C18EF0A0_7F04FCE7EFA55F65_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NOC(=N2)COC""",21,"""5A9F5D185F50D637"""
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+"""9513B9585981F1D6_D12807091C95DAEF_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(SC)C=CC=C2""",21,"""5A9F5D185F50D637"""
+"""7278C2F4077B6C81_08442C5A716FF0F7_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(NCC(F)(F)F)=O""",21,"""5A9F5D185F50D637"""
+"""AB86DAC103189448_9DE85B6E76C96360_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NN=C(C(F)F)S2""",21,"""5A9F5D185F50D637"""
+"""F06BEF8DD783A0B2_C5F959B328E7F438_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(F)C=CC=C2F""",21,"""5A9F5D185F50D637"""
+"""C3A33473BD388C59_3C0D8056F5D00DCB_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC(=CS2)C3CC3""",21,"""5A9F5D185F50D637"""
+"""183EC2DFFCA559D6_7D780F91E9F26C09_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C#C[Si](C)(C)C)=O""",21,"""5A9F5D185F50D637"""
+"""87387E22E4A35CC8_910CDD9199E975D1_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2N(C)CCCC2""",21,"""5A9F5D185F50D637"""
+"""8A2451AB78B4A3E4_7CBA2F00E3697A48_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)C2CCCOC2""",21,"""5A9F5D185F50D637"""
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+"""7598A97AC84C18FD_46300B5C66D9A202_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(NCC(CC)=O)=O""",21,"""5A9F5D185F50D637"""
+"""E3311B506FB87E41_3319487C74A1641C_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2=CC(=NO2)C)=O""",21,"""5A9F5D185F50D637"""
+"""D565E360CE729B06_C8321CFD58E4F411_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCOC2=CC=CC=C2""",21,"""5A9F5D185F50D637"""
+"""AE18B53B772CF7EC_EE4BA16D73083633_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC(=NO2)N(C)C""",21,"""5A9F5D185F50D637"""
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+"""D9866AE6DEA4377F_611D6653257C4261_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(N=C(C)C=C2)C""",21,"""5A9F5D185F50D637"""
+"""4C5C99BD1F2274B4_BE85549115889A0B_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCOC2=CN=CC=C2""",21,"""5A9F5D185F50D637"""
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+"""B42A28AB121CC997_B7E3917A90BA3B7D_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCN2CCOC(C)C2""",21,"""5A9F5D185F50D637"""
+"""283EEADAD57E9A76_AA10852A8CFADB06_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2=C(C)ON=C2)=O""",21,"""5A9F5D185F50D637"""
+"""F2979F7299B440AD_B5147F66405F6D4C_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(C)C=CC(=C2)F""",21,"""5A9F5D185F50D637"""
+"""EE5F6869F3F8F48D_211CF033F454FFF4_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)C2=NC=CC=C2""",21,"""5A9F5D185F50D637"""
+"""92AF686B3C4EF5F0_C7E712B255CA5931_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2=CC=N[N]2CC""",21,"""5A9F5D185F50D637"""
+"""E396947A4C3303C7_E959FE2BAF9F5911_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(C)C(OC2=O)=O""",21,"""5A9F5D185F50D637"""
+"""A72E517B9EF9A5E1_A24306B14A1BE60C_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2=NN=C(OC)S2""",21,"""5A9F5D185F50D637"""
+"""A5C1972E7C6DF166_A1A3680AEDCCE1AC_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC=CC(=C2)CC""",21,"""5A9F5D185F50D637"""
+"""94E82FE5744274EE_6167B25CEE5FAC07_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC#CC2=CC=CC=C2""",21,"""5A9F5D185F50D637"""
+"""3D6A096849746127_B2886CDA4FD20221_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCN2C(C)COCC2""",21,"""5A9F5D185F50D637"""
+"""B3B6E7E21E52CD55_5061F52F1B1A0DC7_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2CC(F)(F)C(O2)=O""",21,"""5A9F5D185F50D637"""
+"""CA021C31A497BEF0_E7638A94C36318B1_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCN2CCOCCC2""",21,"""5A9F5D185F50D637"""
+"""BAD207FB51BB14AE_913FEBD0E0374FC9_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NN=C(N(C)C)O2""",21,"""5A9F5D185F50D637"""
+"""5EAB9D1A40B7AC9F_04FD4725E83B2456_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC=N[N]2C(C)C""",21,"""5A9F5D185F50D637"""
+"""4808B84BAF61D282_66DF10C453DD4186_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC(=C(C)C=C2)C""",21,"""5A9F5D185F50D637"""
+"""17270F19FFD3AD8E_708C0BC40BACF6B1_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NN=C(OC)C=C2""",21,"""5A9F5D185F50D637"""
+"""48CB4670FD7BE976_8907E6578D0BCBFE_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CN=C(OC)N=C2""",21,"""5A9F5D185F50D637"""
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+"""55C30F4F6C85D0E8_38F38723F6242526_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C(CC(O)=O)N)=O""",21,"""5A9F5D185F50D637"""
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+"""BFD1779C6DA91BDA_47BA9798DD77F70A_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC(=NO2)C(C)C""",21,"""5A9F5D185F50D637"""
+"""CA41412BF93D0DC0_58EB880D19393442_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=N[N](CCC)C=C2""",21,"""5A9F5D185F50D637"""
+"""D4033A8AA3D5B212_CB9519751EAB4D3D_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)N2CCOCC2""",21,"""5A9F5D185F50D637"""
+"""A28F2EF883BFB9E5_62F4FFB51B6E9222_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC=C[N]2C(F)F""",21,"""5A9F5D185F50D637"""
+"""64938A0151382D1F_1B6B68A3B68689EC_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)N2CCCC2=O""",21,"""5A9F5D185F50D637"""
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+"""B647FE4B332F7717_E52667B4546B8C03_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCCN2CCCC2""",21,"""5A9F5D185F50D637"""
+"""1628363FE44250B8_29D7CE1475BC302B_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC=CC(=N2)OC""",21,"""5A9F5D185F50D637"""
+"""34B2B60D286554FD_0A82B552CA704857_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(N=C(C)C=N2)C""",21,"""5A9F5D185F50D637"""
+"""49DF5AAF14133B57_BFEC50F86BC5B520_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCC(C(OC)=O)=O""",21,"""5A9F5D185F50D637"""
+"""1706F2B6A3BAF31D_EEC39595ACEC16C7_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)C2=NC=CN=C2""",21,"""5A9F5D185F50D637"""
+"""80783C191B54B781_AF3CE0159D6F9E88_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC[N]2N=C(C)C=C2C""",21,"""5A9F5D185F50D637"""
+"""9424ED3E741C45C5_F34388D0FC7CBE28_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=N[N](CC)N=C2C""",21,"""5A9F5D185F50D637"""
+"""C5705CF1ACBDB03A_2CF8519B4D1703ED_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(OCC(F)(F)F)=O""",21,"""5A9F5D185F50D637"""
+"""0FEEDD715A29555D_66CC63D9FFFFEAE3_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(C=CC(=C2)C)F""",21,"""5A9F5D185F50D637"""
+"""2C719F960901FBC7_9EF3C5604E592CEB_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2=CN=N[N]2C)=O""",21,"""5A9F5D185F50D637"""
+"""AC46C24DF72EA775_96A551586AADB381_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC=N[N]2CCC""",21,"""5A9F5D185F50D637"""
+"""509659E01E4FF717_FAE9E7E97F581317_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCC2CCOCC2""",21,"""5A9F5D185F50D637"""
+"""F96B869D5E80A311_F4F0E3A868E8DD09_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCCCC(C)(C)C""",21,"""5A9F5D185F50D637"""
+"""ABD9AFFA0AEAF13B_1D768288017F97C3_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(C=CC(=C2)C)C""",21,"""5A9F5D185F50D637"""
+"""94058FE59B3D2FAE_07C3467E9788C909_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=N[NH]C(=N2)C(C)C""",21,"""5A9F5D185F50D637"""
+"""91FC1337C7CB63A9_599E9C268DC59D54_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2=C(F)C=CC=C2""",21,"""5A9F5D185F50D637"""
+"""8DC41B7025CE7492_747E02B0590CA253_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC(=NC(=N2)C)C""",21,"""5A9F5D185F50D637"""
+"""A265D255FA299941_D5FA88AB83AE2C4C_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC=CC(=C2)C#N""",21,"""5A9F5D185F50D637"""
+"""12A166FCEBB19C44_B7FA71D1477A93B1_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC(=C(C)C=C2)F""",21,"""5A9F5D185F50D637"""
+"""107CA3BC66CB7F38_743B7A26E93C81B3_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC(=N[NH]2)C3CC3""",21,"""5A9F5D185F50D637"""
+"""78C768CCEE293394_949608D3EB21BE1E_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NSC(=N2)N(C)C""",21,"""5A9F5D185F50D637"""
+"""0C335DC693CD9414_9C3CAE8D85BE3F93_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)C2=CN=CC=C2""",21,"""5A9F5D185F50D637"""
+"""C93D922565CE69ED_83C7D9399BFC52FF_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCCC(OCC)=O""",21,"""5A9F5D185F50D637"""
+"""EE79A44EBF4AC89F_8730F1095573D062_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCC2=NC(=NO2)C""",21,"""5A9F5D185F50D637"""
+"""9FE8A323A36D81F1_33249E090F0218AB_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NOC(=N2)C3CC3""",21,"""5A9F5D185F50D637"""
+"""8558935BBF2CEC41_471B5C733C9DE656_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCOC2CCCCO2""",21,"""5A9F5D185F50D637"""
+"""748AB0939FED26B4_893A4DCED87B29FB_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCSC2=CC=CC=C2""",21,"""5A9F5D185F50D637"""
+"""980A288AEBE4E707_2600B8C0FE1D5A3B_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)CC2CCCO2""",21,"""5A9F5D185F50D637"""
+"""4E300B18E38DF418_1469A13A0D937202_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCOCC2CCCC2""",21,"""5A9F5D185F50D637"""
+"""C818E0A1778C10EA_412D4BCA639674AE_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(N=N[N]2CC)C""",21,"""5A9F5D185F50D637"""
+"""75417DDB886CF616_0835815EC10A4689_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC=CC(=C2F)F""",21,"""5A9F5D185F50D637"""
+"""BA8336A9EC8C32DC_9CA0FC225014F554_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC=C(C=N2)C#N""",21,"""5A9F5D185F50D637"""
+"""BF1F769A9C1FEECE_58D8D80A3B8DE1DE_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCNC(NC(C)C)=O""",21,"""5A9F5D185F50D637"""
+"""1F8EC0CF5B5C12A2_E259D04DBD258F0B_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCC2=CN=C[N]2C""",21,"""5A9F5D185F50D637"""
+"""DD7A1EEF971FB66E_DF74943350BEB37B_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC(=NO2)C(F)F""",21,"""5A9F5D185F50D637"""
+"""4A2B6DC32B3E44B1_AA7FD92645D77254_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2=NC=C[N]2C)=O""",21,"""5A9F5D185F50D637"""
+"""63C71BB93FD6016D_B4052FB469D0C4B9_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC(=C(N=C2)Cl)F""",21,"""5A9F5D185F50D637"""
+"""995145C612115BDC_32159E6F4A63D6B4_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2=NON=C2C)=O""",21,"""5A9F5D185F50D637"""
+"""DBBCF90742902A58_6F384C4D691D1296_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NN=C(S2)C3CC3""",21,"""5A9F5D185F50D637"""
+"""D853CE1A294D4D5D_726E23FC3A09F72A_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC=C(C=C2)C#N""",21,"""5A9F5D185F50D637"""
+"""56F09CB53F73F357_26D24EC045EA5493_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(C=C(C)C=C2)C""",21,"""5A9F5D185F50D637"""
+"""F038E35C60B7ED2F_B4B4314D39007B15_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2=C[N](C)N=N2)=O""",21,"""5A9F5D185F50D637"""
+"""DA31EB5671ACC0A2_E77856448C9BB994_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2=CC=N[N]2C)=O""",21,"""5A9F5D185F50D637"""
+"""06EA565CE9A22260_2086D3B1E0E5B520_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OCC3OCC2(CNC2)C3""",21,"""5A9F5D185F50D637"""
+"""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"""
+"""585BEB3E687A0B50_39BD784C25940B83_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(C=NC=C2)C#N""",21,"""5A9F5D185F50D637"""
+"""08FAB1A5152A907B_3444CCBB39462873_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2CN(CC)C(O2)=O""",21,"""5A9F5D185F50D637"""
+"""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"""
+"""DAE8479ED82044E0_A015B51FF0CAFE4F_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)C2=CC=CC=C2""",21,"""5A9F5D185F50D637"""
+"""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"""
+"""4534CF1FF47A4BDA_BEC9A656D0AB2BE3_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OCC3CCC2(CNC2)O3""",21,"""5A9F5D185F50D637"""
+"""7485BCB667A59C43_F4D122DD42101BD7_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC=N[S](C(C)(C)C)=O""",21,"""5A9F5D185F50D637"""
+"""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"""
+"""4F476078BB66A5E1_0E18D7B14619B796_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC(=NS2)C(C)C""",21,"""5A9F5D185F50D637"""
+"""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"""
+"""D2A93B945B936B83_D8E343D0CCF392F5_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)NC2=NC=C[NH]2""",21,"""5A9F5D185F50D637"""
+"""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"""
+"""9DF95B61D42F9833_45AA0A386850B498_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCSC2=CC=NC=C2""",21,"""5A9F5D185F50D637"""
+"""90ED97F95D329E03_3126AE33DD82E7B2_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(NCC(C)(C)C)=O""",21,"""5A9F5D185F50D637"""
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+"""044872624C544A9D_560929AB866E7209_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2=CC(=CS2)C)=O""",21,"""5A9F5D185F50D637"""
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+"""810FFF6EB5C82902_446C02B68203A8BB_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2(CCC#C)N=N2""",21,"""5A9F5D185F50D637"""
+"""726DC85C35FD3031_03887808EF52881D_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2CCCC(=O)O2""",21,"""5A9F5D185F50D637"""
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+"""EB210C12FBF7231E_826FE4C9C1F0DA05_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2=C(C)N=CS2)=O""",21,"""5A9F5D185F50D637"""
+"""58CA4F3C5240B994_1DF32E3AF63705F3_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(F)C2=CC=CC=C2""",21,"""5A9F5D185F50D637"""
+"""D500C51A395FA47B_2CC261E589CE960E_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CON=C2COC""",21,"""5A9F5D185F50D637"""
+"""1EA1060F721D7F6B_62CB2A8A973E9EF2_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CN=CC(=N2)OC""",21,"""5A9F5D185F50D637"""
+"""9526242FF2113AD2_5262751BAF512F65_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2OC(CC2(C)C)=O""",21,"""5A9F5D185F50D637"""
+"""C58263BEA76D693D_C27F087207159677_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(CCCCCC)=O""",21,"""5A9F5D185F50D637"""
+"""AE797E8BD6D5ACED_B119F52AD8CE4D81_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC(=CC(=C2)F)F""",21,"""5A9F5D185F50D637"""
+"""347ADAE7305A27F4_26CB67B26C1F8F16_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2=C[N](CC)N=C2""",21,"""5A9F5D185F50D637"""
+"""F9EFA56AFBA0647C_3C077E940E2B17BE_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC3CC2(CC2)C(=O)O3""",21,"""5A9F5D185F50D637"""
+"""022CA5F3A5C9E585_0F520E86FA9B87D3_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCCC[S](Cl)(=O)=O""",21,"""5A9F5D185F50D637"""
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+"""46F8B477205C5704_971078F800E790D6_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCN2C[C@H]([C@@H](C)C2)C""",21,"""5A9F5D185F50D637"""
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+"""69B41D458C2C0A8F_DF7B85A436572CCC_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NO[C@@H]3COC[C@H]23""",21,"""5A9F5D185F50D637"""
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+"""72BF3FE2B17ECEF1_2F4BA80050062652_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC(=NC=N2)OC""",21,"""5A9F5D185F50D637"""
+"""E78E25CF691F86CA_1936ADE2490F941C_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(CCN)OC=N2""",21,"""5A9F5D185F50D637"""
+"""ABA29DA25DCF0AC5_7C285E14C127BFFF_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2=CN=C(C)C=C2""",21,"""5A9F5D185F50D637"""
+"""463636C9BE78C884_8A879A5C3201D6A7_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(C)C=C(N=C2)F""",21,"""5A9F5D185F50D637"""
+"""DEBDF6741DC49E64_527707A095663B40_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2CNC(CO2)(C)C""",21,"""5A9F5D185F50D637"""
+"""A538F3D097330F71_C33228BE4687B1A9_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2CCNCC2)F""",21,"""5A9F5D185F50D637"""
+"""B79D259073237E9A_7636109476BBE1DC_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCOC(C#N)C2CC2""",21,"""5A9F5D185F50D637"""
+"""19FC10144D96266A_C57746B3D86DCF80_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2CC(=NO2)C3CC3""",21,"""5A9F5D185F50D637"""
+"""67E56771154EDE44_78313FFB85547545_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CC=NC(=N2)OC""",21,"""5A9F5D185F50D637"""
+"""B2BA3A3094EDC097_F3492B0B4B4F7EC1_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(ON=C2OC)C""",21,"""5A9F5D185F50D637"""
+"""A21A9980C14E5D03_C662B424928C3426_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCOCC(OC)OC""",21,"""5A9F5D185F50D637"""
+"""34D4DC6B681DAAC4_F8601D5881C57FE4_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC(=CC=C2)C#N""",21,"""5A9F5D185F50D637"""
+"""812BF2BA890FB460_964668A7DF7F7D10_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NNC(=O)NC2=O""",21,"""5A9F5D185F50D637"""
+"""B7910FD2EB2BBC88_7502F28C5E58749B_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=N[NH]C3=C2CCC3""",21,"""5A9F5D185F50D637"""
+"""CCE9E8568541A061_030B80819600DC0A_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2CCN(C)CC2""",21,"""5A9F5D185F50D637"""
+"""EBC9FFC203D6C5E4_0E6B28C5252E6BFF_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NOC(=C2C)CC""",21,"""5A9F5D185F50D637"""
+"""0A0EA9620F115BBA_FEF5B72561CB8FEC_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OC[C@H]2CNCC(O2)(C)C""",21,"""5A9F5D185F50D637"""
+"""1E8AB9BE45E347B8_9878F824A5DB57A8_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NOC(=C2)C(F)F""",21,"""5A9F5D185F50D637"""
+"""090DB5E49F27BCB7_E258D7F675BAD7F0_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(F)C2CCOCC2""",21,"""5A9F5D185F50D637"""
+"""1BEDE6ED4C1C1AA3_F4E0F52248F82088_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OC[C@@H]2CNCC(O2)(C)C""",21,"""5A9F5D185F50D637"""
+"""6151FD79A31E822F_77DA93B5DB853583_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2=C(C)OC=N2)=O""",21,"""5A9F5D185F50D637"""
+"""DC02E6FC29D7081A_4E4BF700FDCA9FED_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=N[N](CCF)C=C2""",21,"""5A9F5D185F50D637"""
+"""10BB0BBFD9858EAF_19312FD75886649F_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=CN=C(O2)C3CC3""",21,"""5A9F5D185F50D637"""
+"""EC31564B7FD63C34_76B93732396172D6_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(N(CC)C(C)C)=O""",21,"""5A9F5D185F50D637"""
+"""45630E7F9E8A3781_2391C3892A9224B8_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NN=C3[N]2CCC3""",21,"""5A9F5D185F50D637"""
+"""4A4B8CC6DC00AA66_25CDB2EE16B4E54D_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCOC2CCOC2""",21,"""5A9F5D185F50D637"""
+"""54C4E2982B06A6B7_3957145805217557_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2CCC(F)(F)CO2""",21,"""5A9F5D185F50D637"""
+"""C1F5794704B022FA_5BE47AEC8FA774A9_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(OC)C2CCCC2""",21,"""5A9F5D185F50D637"""
+"""9A85CE9F1CFDF9F5_8C6FCD6FB7CF1BC6_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2CC[S](=O)(=O)C2""",21,"""5A9F5D185F50D637"""
+"""81D015397901A99E_EE971A99E71DBA29_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NN=C(C(C)C)O2""",21,"""5A9F5D185F50D637"""
+"""0D516F1EB5450A69_103C90E818084156_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NC=N[N]2CCF""",21,"""5A9F5D185F50D637"""
+"""E94BBB8A7AEC6D53_688414E8D42B312D_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCCC(C)(C)C#N""",21,"""5A9F5D185F50D637"""
+"""B2C4ACCC4A69DB36_8BAEE86A8DAB2791_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=C(CC)ON=C2C""",21,"""5A9F5D185F50D637"""
+"""752A5839DACD9509_BAF5DA9B3F24F2E0_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(=O)C2COCCO2""",21,"""5A9F5D185F50D637"""
+"""E390FAE8255D8666_AF847217DC8D08F1_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2CCCC2(F)F""",21,"""5A9F5D185F50D637"""
+"""E5508D2E20CE9050_ABB56CEA408A2CF3_6039_DP""","""CC(C)C1=CC=CC(=O)C(=C1)OCC(C2CCNCC2)=O""",21,"""5A9F5D185F50D637"""
+"""6319B36E6037BA91_6F9AB1558D133AD5_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2OC(=O)CC23CC3""",21,"""5A9F5D185F50D637"""
+"""FA4BBC4F9152FAC4_CFEDB125B1940DFC_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2CN=C(O2)C3CC3""",21,"""5A9F5D185F50D637"""
+"""FC7037BB92E414E8_8DD64DB28E27781B_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCCC2=CC=NC=C2""",21,"""5A9F5D185F50D637"""
+"""5E99A4E03851A27F_193D7FC458511FBD_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCN2N=C(C)OC2=O""",21,"""5A9F5D185F50D637"""
+"""2E2A96D2AB649006_9CF29D6AE9321DED_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCC2CCC(C)CC2""",21,"""5A9F5D185F50D637"""
+"""13B9CFE1513F66F3_798D5122B1FCB9B8_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCC2=NO[C@@H]3CCC[C@H]23""",21,"""5A9F5D185F50D637"""
+"""632292F5B7A8A73C_406483D8C24E11CA_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCN2C3CCC(C2)C3""",21,"""5A9F5D185F50D637"""
+"""5D0F37DB31F60E47_DB6911CC58AA73F0_6039_UN""","""CC(C)C1=CC=CC(=O)C(=C1)OCCOCCOCC#C""",21,"""5A9F5D185F50D637"""
+"""7BAF85723DF500A8_14A2092BB481ADFA_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=C(C(N)=O)C=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""9C97A2842315B9F8_A9C929CE8819BDA6_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(F)C=CC(=C2)C#N)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""823A68F230A7B9C1_9E5A8A5F7C12FDD1_6039_UN""","""CC1=C(C=CC(=C1)OCC(N2C(C=C(C)O2)=O)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""A85ECF67C1F06E9A_77EA0D2D6F5845F7_6039_UN""","""CC1=C(C=CC(=C1)OCC(NC2=CC(=NO2)C)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""8E8BAE801B93DD48_B0D071BFB3450B3C_6039_UN""","""CC1=C(C=CC(=C1)OCC(NC2=NN=C(C)S2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""966FCB324F078BAC_E53646A66AC3361F_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(OCC)C=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""3B1C69CCA6E3BCF1_12CA9504B019C531_6039_UN""","""CC1=C(C=CC(=C1)OCCCCCCCCCC)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""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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+"""87033F1E3487053F_BA8B2B3A1B15726D_6039_UN""","""CC1=C(C=CC(=C1)OCC[P](OCC)(=O)OCC)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""E8930F6574F1EC8A_6F86A083B59209D7_6039_UN""","""CC1=C(C=CC(=C1)OCC3=NC2=C(N=CC=C2)[NH]3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""3B27481C16AC6064_631C63504EA5DECF_6039_UN""","""CC1=C(C=CC(=C1)OCC[N]2C=C(C(O)=O)C=N2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""84EFB93D28F4A544_12619FC9760C8382_6039_UN""","""CC1=C(C=CC(=C1)OCCCNC(C(F)(F)F)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""6FCE93B8619EAF4B_045FC680954B28AA_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=CC(=C2)COC)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""B44FFFB2D773C2BC_02D6A4790915BC1B_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=CC(=C2)C(O)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""94BF37AF420CC5AA_2A9F287E04ECF474_6039_UN""","""CC1=C(C=CC(=C1)OCC(=O)NC2CCSC2=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""77C45E31079FC989_36507D261B635711_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C=C(F)C=C2)C#N)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""A29A4DE55CADD018_7FE402DAD930ACA5_6039_UN""","""CC1=C(C=CC(=C1)OCCCCC[N]2C=CN=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""8C268D7369757580_C04180E99FC122CC_6039_UN""","""CC1=C(C=CC(=C1)OCCCOC(NC(N)=O)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""B9EA9399090A8C57_2B9AC2A4DA074B40_6039_UN""","""CC1=C(C=CC(=C1)OCCCC[N]2C=CN=C2C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""323D90CBC1B4E7CA_1AA8C7C57A32B363_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NC(=NO2)C(C)(C)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""D79F4F6738199936_73B693B0E32DDCFE_6039_UN""","""CC1=C(C=CC(=C1)OCCC(N(C)CCC#N)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""807071E1623C87A6_689CBE5C68861896_6039_UN""","""CC1=C(C=CC(=C1)OCC(N(CCCC)CC)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""3C66B5DC654A77CF_D9F26BFF5C1916EF_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(OC)C=CC(=C2)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""E08636334C36A28D_219B49D67EE24B03_6039_UN""","""CC1=C(C=CC(=C1)OCCC(=O)N2CCOCC2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""DD6BB9381C0997DE_D42126E1C4D6BDB1_6039_UN""","""CC1=C(C=CC(=C1)OCC3=CC2=C(C=CC=C2)O3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""BC8FB015BC2F0F34_A67ABA8E8AAC8F1B_6039_UN""","""CC1=C(C=CC(=C1)OCC(N(CC)CCC#N)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""A327BB486899907E_3FA444DA3099B75F_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NC(=CS2)C(F)(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""47674999B2BDD19F_D223C6CFEBBFFBDB_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NC=C(OCC)C=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""4D14B8889A4DA366_70D1A373FF40EC45_6039_UN""","""CC1=C(C=CC(=C1)OCCC2CC(CC(C)C2)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""1DA634958EBD021E_1166D1C31FDA54BB_6039_UN""","""CC1=C(C=CC(=C1)OCC(=O)C2CC3CCC2C3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""FAE98FAB0C9CEF45_813D4CEFD4D58CB0_6039_UN""","""CC1=C(C=CC(=C1)OCCCCC2(C)OCCO2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""D6361D89F05FF2D4_1395684482FDBBFB_6039_UN""","""CC1=C(C=CC(=C1)OCC3CCC2(CC2)C(=O)O3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""0E690E6B0D5B8565_F1849F0282DC4FA3_6039_UN""","""CC1=C(C=CC(=C1)OCCC2=C(CC)C=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""0D18108E9DD9929C_CB2491E8470C9A20_6039_UN""","""CC1=C(C=CC(=C1)OCC3CC2=C(C=CC=C2)O3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""9D4B504B27431191_311ECFEA5671ECF0_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NN=C3[N]2CCCC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""A907006979C53FED_B639540CA2C6D6C6_6039_UN""","""CC1=C(C=CC(=C1)OCC(=O)C2CCCCCC2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""D8A9E3F573AD1A94_34F1A94C657ABBA8_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NOC(=C2)C(C)(C)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""1D31E10109369DBD_C2E651A591F2C89D_6039_UN""","""CC1=C(C=CC(=C1)OCC(N2CCC(C)CC2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""FCD38185A17F53F1_747CEF47C8723505_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(N=C(OC)N=C2)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""22803A435423701F_AE975B6DDB27AF30_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NC=N[N]2C(C)(C)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""762A9301CB0C917E_90DBD032AE186038_6039_UN""","""CC1=C(C=CC(=C1)OCC2N(C(C)C)CCCC2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""BCDC729DA47826D1_E15701D91D8206B5_6039_UN""","""CC1=C(C=CC(=C1)OCCCCC2CCOCC2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""FE1DB0AFBB21D8FF_7747586D9E93EAE1_6039_UN""","""CC1=C(C=CC(=C1)OCCCC2=CC(=NO2)CC)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""5768299D401BE0C1_1747282D445029EB_6039_UN""","""CC1=C(C=CC(=C1)OCC(C(C(OC)=O)(C)C)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""61B27C363E12B4DF_F8D0B4B579266965_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C(OC)=O)C=NO2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""F7009D0113DE178A_D34EC4CD04436E83_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NN=C3[N]2CCOC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""2E00A934BD0EE441_D37BFC528C7ADE0F_6039_UN""","""CC1=C(C=CC(=C1)OCC(OC)C2=CC=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""70B41713A1EE6599_575DC121236816DC_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2=NC=CC(=C2)C)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""4A44B3E087F9F104_F1BD3CF97F70999F_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=C(COC)C=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""8FDBE6D49A6F144A_06856ACA850420D0_6039_UN""","""CC1=C(C=CC(=C1)OCC2=N[NH]C(=N2)C(C)(C)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""0AFAED2A5E5A0F2E_4A87A9E8E296B7FB_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NOC(=N2)CCOC)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""E1F13A2FC5C7C732_CBDE74AE1B4677B4_6039_UN""","""CC1=C(C=CC(=C1)OCC3=CC2=NON=C2C=C3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""A728DBEA88A1B994_C60154119DD6D152_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2=C(C)N=CC=C2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""221E24525C217D43_8C63EEBB55FA431B_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=N[N]2CC(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""7A0CB538E8BC3919_A55216B27EBBF542_6039_UN""","""CC1=C(C=CC(=C1)OCCSCC2=CC=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""7AFE0F18C20D88F2_F9589F678DA08DCE_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CSC(=C2)C(OC)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""D9F3F2A2C075E73C_A25C36E8458A9869_6039_UN""","""CC1=C(C=CC(=C1)OCC(CC(C)(C)C2CC2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""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"""
+"""BB42C8441B27C6D3_934CA14F73E4EB75_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC(=CO2)C(OC)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""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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+"""B44D7637010B8752_379B317C52C7D9E3_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC(=CS2)C(OC)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""19A0EFF30C11CE2F_B4A5EA694FA83531_6039_UN""","""CC1=C(C=CC(=C1)OCC3=NC2=C(CCOC2)O3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""22A9382C6509F770_BD3345DFC73D9E8E_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC(=CO2)C(F)(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""D34DAF6D25FB387C_42145C87F3EA0AFD_6039_UN""","""CC1=C(C=CC(=C1)OCC3=NC2=C(CCCC2)O3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""CB855BAD8DD0B423_2A9E2577F82CABEE_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C([N](=O)=O)N=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""90DD68019D73BE4F_6F1C8B29505ED5AB_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NOC(=N2)C3CCC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""AE65B75DBAB7D50C_165012C096EC91D3_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NC=C[N]2CC(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""1A44C967CA5B3F12_63935142B892E4EA_6039_UN""","""CC1=C(C=CC(=C1)OCC3CCC2(CCC2)CO3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""BD96D23B0FD71826_53A9DE1187739FD2_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CN=C(N=C2)C3CC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""9C2756C9B67859BB_AEABF8AD9AE77C93_6039_UN""","""CC1=C(C=CC(=C1)OCC2=COC(=N2)C(C)(C)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""1FA65B2BE5B416EA_E3A95DB08CCEE4F0_6039_UN""","""CC1=C(C=CC(=C1)OCC(=O)NC2=NC=CC=N2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""CFBF499EB58EB453_9CD5B3B330C31C68_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC(=C(OC)C=C2)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""83BB25EAA709454F_A5390AB22DCB03F4_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC3=C(C=C2)[NH]C=N3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""3808BF8B0E78DCAF_A492B8E415EAB091_6039_UN""","""CC1=C(C=CC(=C1)OCCOC2=CC=C(F)C=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""2574E65FEF19F5AA_184FFA0E536A78F1_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2=CC=CC(=C2)F)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""27D1A720D869B42F_20698392182B6879_6039_UN""","""CC1=C(C=CC(=C1)OCC2=COC(=N2)C(F)(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""8CCE35ABB59BA4A3_5652D35C940BACC2_6039_DP""","""CC1=C(C=CC(=C1)OCC3CC2(CNC2)C(O3)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""BB2F5BAC799B2E50_EF00F80EF2E6DCD0_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2=CC(=NC=C2)F)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""FAE0F5CEFE78C2C6_998399CF477CCDDA_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2=N[N](C(=C2)C)C)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""02C60C83DF415A3B_062ED24AF0DD7CD5_6039_UN""","""CC1=C(C=CC(=C1)OCCC2CC(C)(C)NC2=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""B582BA3756E44BD2_9B8887E08D349605_6039_UN""","""CC1=C(C=CC(=C1)OCCC2=C(OC)C=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""EA8A65595C5F15EF_6EB2253A9944D285_6039_UN""","""CC1=C(C=CC(=C1)OCC(N(C)C2CCCC2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""F997B20968332420_701B8BD602572998_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C=CC(=C2)OC)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""C27A094FEA0DE354_20F57433EAA8F713_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NC=C(C(O)=O)C=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""90EFAEA89740F5DB_D8942B7B2C808E07_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2C(C)(C)C2(C)C)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""6B297E3E889A9129_28664C266FE5A9A2_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC(=CC=C2)CC=C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""4438C761373F0BC1_88DE7BD47622E65D_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C=CC(=C2F)C)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""175E8C16295722A1_EFA9325C0168AC97_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C(C)C)ON=C2C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""A094332DFD07C408_7088D1C3F8A19D19_6039_UN""","""CC1=C(C=CC(=C1)OCCO[Si](C(C)(C)C)(C)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""AEED81CF5CE15167_C13E1E371040DCA3_6039_UN""","""CC1=C(C=CC(=C1)OCCC[S](C(C)(C)C)(=O)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""835CB13B94701022_73C7D1858A0C7A22_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(OC)C=CC=C2F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""1C404429705CE8AC_592FFE5001CB29DF_6039_UN""","""CC1=C(C=CC(=C1)OCCOC[P](OC)(=O)OC)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""E960CDA03B34B5B1_7801FC352CDED31B_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C([S](C)(=O)=O)C=CS2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""A7C3ECA853F46E16_C8BCB3EBC0ACD313_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(OC)C=CC(=N2)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""DCA82D76B9E300D9_210A8991246E19FA_6039_UN""","""CC1=C(C=CC(=C1)OCCN2CC[S](=O)(=O)CC2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""6EB0FFF35E660C8A_3990DA6AFACB6CD3_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NSC(=C2)C(F)(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""0F40F0DED120DDC5_972B2D5EE2C83FF6_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(N=C(OC)C=C2)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""04235DC47C74323A_2314B831E492F1E8_6039_UN""","""CC1=C(C=CC(=C1)OCCCCCC2OCCO2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""AC072629B0813017_143838F5FD95B609_6039_UN""","""CC1=C(C=CC(=C1)OCC3CC2(CC2)[S](=O)(=O)N3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""47AE0C726802A617_A9C50D3691FBE4F3_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC3=C(C=C2)N=N[NH]3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""DD8868DC7DFE59A7_737580704A305923_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=CC3=CC=N[N]23)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""1A48B00F161E3D49_7C91E01345D28246_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(COC)C=CC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""58DD818FF76FE62B_870223C0D0B3CD5D_6039_UN""","""CC1=C(C=CC(=C1)OCCCC2=C(C)C=CN=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""2F77607F47D85FA6_DB0AE183A955A0B2_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NC(=CC=C2)CC#N)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""8B200601A5230548_66DACA9B0EB6FFBB_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC(=CS2)C(F)(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""9CF3C2B6B0CE18BC_56C381C34B3B9A50_6039_UN""","""CC1=C(C=CC(=C1)OCC2=N[N](C)C=C2[N](=O)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""7D0CE36F7B44AEEB_28A1031F6DA2B044_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC3=C(C=C2)C=CO3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""22146B025EE23BF8_EF0F3D02FD67508E_6039_DP""","""CC1=C(C=CC(=C1)OCC(N2CCNCC2C)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""13F332659EAC79C0_FE381CD59204273D_6039_DP""","""CC1=C(C=CC(=C1)OCC(NC2CCNCC2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
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+"""4C3211F213609FFB_A99A584825AD432E_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NN=C3C=CC=N[N]23)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""266A3144048F5EA4_90910D22FD79A7F4_6039_DP""","""CC1=C(C=CC(=C1)OCC3=CC2=C(CNC2)C=C3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""998DBCD6F13AAF9E_88DC3A7C4D9F714D_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NCC(C(OC)=O)O2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""0B0B3D80BE99565B_E3BC9BC5F6CF6DD5_6039_UN""","""CC1=C(C=CC(=C1)OCCNC(=O)N2CCCC2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""6A35DEB5CEEB014D_F35D863755D89333_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NOC(=C2)CC(C)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""8E9EE96E01844082_40121472D31E8239_6039_UN""","""CC1=C(C=CC(=C1)OCC2=N[NH]C(=C2)C(OC)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""5B551D12AB9058E9_48BD339D5E98B094_6039_DP""","""CC1=C(C=CC(=C1)OCC(N2CC(C)NCC2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""7B6259DA10BEE912_9C3FE9A0541EDD0F_6039_UN""","""CC1=C(C=CC(=C1)OCC3=CC2=C(C=CC=N2)S3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""3F8D7F4D6BEF61CE_15AC3E229AADD86B_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC(=NC(=C2)C)OC)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""AB55A33E15E7FCA3_51F4B2B10E057820_6039_DP""","""CC1=C(C=CC(=C1)OCC2CNCC3(O2)CCC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""A15C96B9CFC34961_5BEB88C665D4A29D_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC(=NC(=N2)OC)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""03D977D23A6CDA87_7E9F2AA466C7C875_6039_UN""","""CC1=C(C=CC(=C1)OCCN2CCCO[P]2(N)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""308B4E1B30FB4CCE_B9F8267C8B7A454E_6039_DP""","""CC1=C(C=CC(=C1)OCC2=N[NH]C3=C2CNCC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""3E563767C6D562A4_7E90E5ADD380560C_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C3C(=N[NH]2)CCCC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""5403DF9EE753C262_C4227A687C17230C_6039_UN""","""CC1=C(C=CC(=C1)OCCC2=C([N](N=C2C)C)C)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""86AAD5FE88AE0F38_711B394B2EC2EC55_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C(OC)=O)SN=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""02EA25F7E273746F_77518387B96A8A57_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C(F)F)C=NC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""2AEB1CEBFB5BB03A_FB9F44AEB2499C45_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C(F)(F)F)SC=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""C8623874DD74457C_62490CA38A00AAEF_6039_UN""","""CC1=C(C=CC(=C1)OCC(C2(C(F)(F)F)CC2)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""2E02658CD47402D0_5283F2FF55154D49_6039_DP""","""CC1=C(C=CC(=C1)OCC2CNC3(CO2)CCC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""8EC4FCAEEA12B0E8_16F050A7BC2B28F1_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C(C)(C)C)OC=N2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""8A2B088454DA268D_16FF73A524392509_6039_UN""","""CC1=C(C=CC(=C1)OCCOCCOCCOC)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""C09AB489D6C04F8E_DE37C6C34C8ABBCA_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NN=C(C(F)(F)Cl)S2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""62C59195B5FABD8A_FC268D8CD1691179_6039_UN""","""CC1=C(C=CC(=C1)OCCC(C(OCC)=O)(F)F)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""74F2559FB032F13A_90F2B5DB7CE40E65_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(SN=C2OC)OC)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""63C4B34E0A2CDD59_9F90EA8B2D4C3171_6039_UN""","""CC1=C(C=CC(=C1)OCC2=NOC(=C2)CC3CC3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""BBF8503BAB64247E_DE5705102D8003B2_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC3=C(C=C2)OCO3)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""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"""
+"""1C6128F2ABA6126D_41D669EC4F98B3FD_6039_UN""","""CC1=C(C=CC(=C1)OCC2=CC=NC(=N2)COC)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""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"""
+"""2492F5A6F83B00F1_50D7EE4DAF1FD9BE_6039_UN""","""CC1=C(C=CC(=C1)OCC2=C(C(=NO2)C)[N](=O)=O)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""ECBC4D84DD171658_B6DF85D79AB358E5_6039_UN""","""CC1=C(C=CC(=C1)OCCOC2=CC=C(C)C=C2)C(=O)N""",21,"""A6D6505ECAF8D6F7"""
+"""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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+"""B417A074C35E59A2_9550666AA6E71B4F_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COC[CH]=[C]3C[CH2]C3""",21,"""DD8ACFD5B9DF1DDB"""
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+"""7CD94E9C0187CB00_BCD46AEFF328AE43_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCC(O)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""74CAB19B0C837F53_13C0F84BC9CC7A0B_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=C[NH]C=N3""",21,"""DD8ACFD5B9DF1DDB"""
+"""C4A3BF28FC5A2951_B403F42BFA76CF7F_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC=CCC""",21,"""DD8ACFD5B9DF1DDB"""
+"""6959E36675B26FBD_DCF2139A073C184C_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCC(C)C""",21,"""DD8ACFD5B9DF1DDB"""
+"""6741D344602D30CA_3C7FAE5BE0E01562_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCOCCN""",21,"""DD8ACFD5B9DF1DDB"""
+"""7A0F65DE9502454B_94A17406EBA91CA1_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC(NO)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""3103220CD8524E5D_1E95CB2D57408C66_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=C[NH]N=C3""",21,"""DD8ACFD5B9DF1DDB"""
+"""3A0E883B72DE259F_0548A514EE084005_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC[S](C)(=O)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""A4612E8CCBB976B2_D6379B5E94242DE3_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(COC)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""6DB84BEE3C4E546B_44E0E97C9BC56469_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC3CNC3""",21,"""DD8ACFD5B9DF1DDB"""
+"""C8B7511B32A13F69_491A283C54831F8F_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCCCF""",21,"""DD8ACFD5B9DF1DDB"""
+"""7838B404747A9BBD_173DCD39F91C0177_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCSC(C)C""",21,"""DD8ACFD5B9DF1DDB"""
+"""9ECD95C92A802EB5_5A85279125A765C2_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=C[NH]N=N3""",21,"""DD8ACFD5B9DF1DDB"""
+"""06E392B2551D7A4A_D104251018465756_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(OCC)=N""",21,"""DD8ACFD5B9DF1DDB"""
+"""2CA9058A63AA3D99_0B586D132C746D15_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=CC=N[NH]3""",21,"""DD8ACFD5B9DF1DDB"""
+"""3A386A4099AE0EE4_4588096B42CD06C7_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(C(C)=O)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""EBA9C0179351F6EB_5DA811B22EFAD52D_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=CN=NS3""",21,"""DD8ACFD5B9DF1DDB"""
+"""146A2C2B6A690411_6B82169049A5106C_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC[S](F)(=O)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""079C8704CA357814_E3F9E6F58B77DBD5_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COC[C@H]3CCCO3""",21,"""DD8ACFD5B9DF1DDB"""
+"""E4E1F7BB07835995_30A82263C651766D_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC[Si](C)(C)C""",21,"""DD8ACFD5B9DF1DDB"""
+"""D2AF1F6CF1A580B8_8DB912A10E1B2AB8_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(NCC)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""C36E293F000631F6_2A3354867A9D9FA6_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCOCC=C""",21,"""DD8ACFD5B9DF1DDB"""
+"""BA40FACEC54C41AD_AE632EE6FB84170F_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=CSC=C3""",21,"""DD8ACFD5B9DF1DDB"""
+"""F636B9208874795A_BBA536EF82582DED_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=COC=C3""",21,"""DD8ACFD5B9DF1DDB"""
+"""1FD1D5D636026804_C7CCC49B19F4F41C_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC#CC(O)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""9FF7601061EE0DD3_2C915F5F86A945AC_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=NC=C[NH]3""",21,"""DD8ACFD5B9DF1DDB"""
+"""F8B400AE5F08660B_9EF3F1F177FB12B4_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=CSN=N3""",21,"""DD8ACFD5B9DF1DDB"""
+"""01F5423A332BEE33_EED49A07F90F415B_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=NON=C3""",21,"""DD8ACFD5B9DF1DDB"""
+"""8E82BC387FE352BC_BEFEFC18C36475E0_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=NOC=C3""",21,"""DD8ACFD5B9DF1DDB"""
+"""D8854C636A0B8A68_9134DC27022A7C55_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCCCC=C""",21,"""DD8ACFD5B9DF1DDB"""
+"""64AF363A1D170B52_40388AC81A2CC4CC_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=NSN=C3""",21,"""DD8ACFD5B9DF1DDB"""
+"""349B24C4A3107076_3FC4B96A29B6898C_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=CC=NO3""",21,"""DD8ACFD5B9DF1DDB"""
+"""818860B38116D940_2C99DB3506D94B07_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=CON=C3""",21,"""DD8ACFD5B9DF1DDB"""
+"""1DB700038A2A8E89_7A14EA40B2B00BC7_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3COCO3""",21,"""DD8ACFD5B9DF1DDB"""
+"""CE40B5D3E4F76DB7_ECA2A3C4ECD66DBE_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCSC(C)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""6EA81FD10DC0A8BE_16322843A1B58981_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(CC)OC""",21,"""DD8ACFD5B9DF1DDB"""
+"""17E7E2403F2AC452_4037D65CD4EC35BF_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=NN=CO3""",21,"""DD8ACFD5B9DF1DDB"""
+"""6239B77946EB10B9_EC6D7985698CD490_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCC(F)(F)Cl""",21,"""DD8ACFD5B9DF1DDB"""
+"""E28DE5784D2B8861_CBC34CB839FE5478_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC[S](O)(=O)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""E0AAAFAF99AE8F5C_39288765F06D94FD_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCOC3CC3""",21,"""DD8ACFD5B9DF1DDB"""
+"""701D76F824F75FCD_F0CA6067DC08223E_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=CN=CS3""",21,"""DD8ACFD5B9DF1DDB"""
+"""BBFB6FF32B5B13FF_0EBC8419C003A9DA_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=CC=NS3""",21,"""DD8ACFD5B9DF1DDB"""
+"""B4E66E17131997B2_C90B75EAD057BD2D_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3CC(=O)O3""",21,"""DD8ACFD5B9DF1DDB"""
+"""CDEAE3280F420770_F4B22CDC4D106A96_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCOC(C)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""20F5C394B46D935D_E2F6AEAEA56074FD_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCCOCC#C""",21,"""DD8ACFD5B9DF1DDB"""
+"""158552C7E698FA9B_5EDDDFB11BF20CE2_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(CC)(F)F""",21,"""DD8ACFD5B9DF1DDB"""
+"""8D8A0BA52E1F65CB_355CC19AA2FF1C45_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COC[C@H]3CCCN3""",21,"""DD8ACFD5B9DF1DDB"""
+"""107DA525781D3CC0_E65F4EDAEA9EC02C_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3OC3(C)C""",21,"""DD8ACFD5B9DF1DDB"""
+"""FB77AD95990D2C6E_222E1B4CEFB8C935_6039_DP""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(C=CO)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""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"""
+"""3BC93E3249529538_548996F05F67A027_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC(C(F)F)=O""",21,"""DD8ACFD5B9DF1DDB"""
+"""285D0E9E070FB98B_7B84CC0465C4FE2F_6039_UN""","""CC[N]1C=C(C=N1)[C@@H]2OCCC[C@H]2COCC3=NOCC3""",21,"""DD8ACFD5B9DF1DDB"""
+"""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"""
+"""72FC73A8145EBB28_8B8283E3FCFFC5F7_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=NC=NO3""",21,"""C48C1039567EC847"""
+"""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"""
+"""762AD7B1F963311E_DC5E0A80465D6B39_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCN(C)C""",21,"""C48C1039567EC847"""
+"""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"""
+"""3B08CFF70AEFA34B_A4E2AABF34DE034C_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC(C)(C)C""",21,"""C48C1039567EC847"""
+"""FEB7AD6861B653C4_11CF8498FEC3BC98_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=CSC=N3""",21,"""C48C1039567EC847"""
+"""71B33A9193C43370_8BC147F08DEA3AD5_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=NN=N[NH]3""",21,"""C48C1039567EC847"""
+"""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"""
+"""B3737F0635A1ABC8_1C4E7AF801A99599_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC[S](C)(=O)=O""",21,"""C48C1039567EC847"""
+"""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"""
+"""A9C09EFC3EC7A2CF_DECA1B77F6552180_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC#CC(O)=O""",21,"""C48C1039567EC847"""
+"""80E60128AD4A8D2C_359780B369089030_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=NC=C[NH]3""",21,"""C48C1039567EC847"""
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+"""B7CF0348A8369067_00A96710A366ACC1_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC[S](N)(=O)=O""",21,"""C48C1039567EC847"""
+"""C96189FA4E65BEF7_26AD61E082319F78_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCCC#N""",21,"""C48C1039567EC847"""
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+"""C04CC32CF8D5E3BF_2B2773D96E816C6A_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCC(C)=C""",21,"""C48C1039567EC847"""
+"""6F9D1B59BF540896_940C06B1AE8014A3_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(=C)CC#N""",21,"""C48C1039567EC847"""
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+"""2A4367421FE50318_4033C2669A78D4CA_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC=C(C)C""",21,"""C48C1039567EC847"""
+"""EF54BCC9D3E40BE4_FEBAA745D3721F12_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC=C(C)C#N""",21,"""C48C1039567EC847"""
+"""DCBE6179962850B1_6713E9BEECAD1A6E_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(NCO)=O""",21,"""C48C1039567EC847"""
+"""86F358039157C9DE_2A165BC5332194AA_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCOC(F)F""",21,"""C48C1039567EC847"""
+"""2FFF85F9177886BD_2A74BCDD5B516918_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC3(C)CC3""",21,"""C48C1039567EC847"""
+"""F0365926B1BC5F8E_48BED8C755D0FE9E_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC#CC3CC3""",21,"""C48C1039567EC847"""
+"""C6E3AEDC8FB1AC99_89A71D768118D8AC_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC3COC3""",21,"""C48C1039567EC847"""
+"""0AC1C1AC1F40B6E5_05BDCCCF13C549D4_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCC(N)=O""",21,"""C48C1039567EC847"""
+"""42E3F6757706AF7A_2190BE6CC79D25A5_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC(C)(F)F""",21,"""C48C1039567EC847"""
+"""D850DEB56299084C_A6CFA5F8703F0B56_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC3(C)N=N3""",21,"""C48C1039567EC847"""
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+"""D89C49617AB6363C_85986B25F551E8B0_6039_DP""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC([C@@H](C)N)=O""",21,"""C48C1039567EC847"""
+"""3D4939D201847DD6_AC7F22615C2428A7_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCN3CCC3""",21,"""C48C1039567EC847"""
+"""3174BF843EECB498_6337DE57C284B75F_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=N[NH]C=C3""",21,"""C48C1039567EC847"""
+"""5ADC8F12D944A378_BCBA710647EDC332_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC(C)(C)F""",21,"""C48C1039567EC847"""
+"""0B9C2FDCC7DE0290_7E6ED9CE2C379391_6039_DP""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(C(C)C)N""",21,"""C48C1039567EC847"""
+"""6ECF6A171D877C65_F2F3F2D5315E406B_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCN=[N]#N""",21,"""C48C1039567EC847"""
+"""0D1433FE511647AC_C6D7F7456B436158_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC[N+](C)(C)C""",21,"""C48C1039567EC847"""
+"""D1A7DD63849C8BD8_A067A6B0FF08107F_6039_DP""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCCCO""",21,"""C48C1039567EC847"""
+"""30806DE9E6C10C00_D2109A20483C6A77_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCOCCC""",21,"""C48C1039567EC847"""
+"""C8A39B8356CAF9B9_B8516892904C1F8A_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=NC=CS3""",21,"""C48C1039567EC847"""
+"""DBFDDA0504B284C5_D9EFC291EF5B3EC2_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=NSC=C3""",21,"""C48C1039567EC847"""
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+"""F8885CBB25602580_E249DF05C3CB7117_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(C)N(C)C""",21,"""C48C1039567EC847"""
+"""15F93B5FBD4C1603_201E661EF10FAAE8_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCC3CO3""",21,"""C48C1039567EC847"""
+"""9207A5E080777FC7_BC670E24E31DFAB9_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCC3CCC3""",21,"""C48C1039567EC847"""
+"""D51977390E5C7292_CFB0A064F5BD3C5A_6039_DP""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCNC3CC3""",21,"""C48C1039567EC847"""
+"""6F59BF2BFC6F0523_DBF8B56979B62FAB_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCN(CC)C""",21,"""C48C1039567EC847"""
+"""F530E79FA68EB642_6EB5259C1C25E7AE_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3OC3CC""",21,"""C48C1039567EC847"""
+"""033B1F3AE99A8C71_928DB001B8E4A859_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCC=CC""",21,"""C48C1039567EC847"""
+"""9EB4E90D4B297634_4FD6E0D3D5E74F23_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=N[NH]C=N3""",21,"""C48C1039567EC847"""
+"""A187C76BD7618539_E3578F6B1D30A8A4_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC3=CN=CO3""",21,"""C48C1039567EC847"""
+"""8CB0D74F7EAD3BD2_72A84C488C217E5E_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC(=O)C(Cl)Cl""",21,"""C48C1039567EC847"""
+"""DBF50D2D84050347_30D5054519C0E6E5_6039_DP""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC([C@H](C)N)=O""",21,"""C48C1039567EC847"""
+"""B990AD13F344D104_BFFDC6A9C78294BE_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CC[S](Cl)(=O)=O""",21,"""C48C1039567EC847"""
+"""21D52FACE94A195D_D7D59A0744AD131B_6039_UN""","""O(C1=CC(=CC=C1)C(=O)N2CCOCC2)CCCSCC""",21,"""C48C1039567EC847"""
+"""F52D9D6197D5DD75_7EFF543B7153974D_6039_UN""","""O(CCOCCOCC=C)CC1=NOC(=N1)C2=CSC=C2""",21,"""C4BC6016E67B1F4B"""
+"""93030FCE62E722A6_BFD07CC73278B5CF_6039_UN""","""O(CCOCCOCC=C)CC1=CSC(=N1)C2=CC=CO2""",21,"""C4BC6016E67B1F4B"""
+"""BBCF211429FE334E_4A452EBD639839A1_6039_UN""","""O(CCOCCOCC=C)CC1=CSC(=N1)C2=CC=CS2""",21,"""C4BC6016E67B1F4B"""
+"""D8EB2A1E72D8245D_055652129FEC9477_6039_UN""","""O(CCOCCOCC=C)CCOC1=CC=CC(=C1)CC""",21,"""C4BC6016E67B1F4B"""
+"""6535801F79079B7F_EDABA911D53CDE8F_6039_UN""","""O(CCOCCOCC=C)CCC(C1=CC=C(F)C=C1)=O""",21,"""C4BC6016E67B1F4B"""
+"""25367AF6CBF470C8_CF7923ECDE21C8EC_6039_UN""","""O(CCOCCOCC=C)CCCOC1=C(C)C=CC=C1""",21,"""C4BC6016E67B1F4B"""
+"""5AC5B78B240689FF_81F7AF6C0CEF6057_6039_UN""","""O(CCOCCOCC=C)CCOC1=CC(=CC=C1)C#N""",21,"""C4BC6016E67B1F4B"""
+"""C17FD7304F251402_AB6F4C6DD7FF3FF6_6039_UN""","""O(CCOCCOCC=C)CC(C1=CC(=C(C)C=C1)C)=O""",21,"""C4BC6016E67B1F4B"""
+"""70E3D7B49BDD11EA_79AAA5DDEFF4C5C8_6039_UN""","""O(CCOCCOCC=C)CC(C1=CC(=C(F)C=C1)F)=O""",21,"""C4BC6016E67B1F4B"""
+"""78FE2C22AD74ACAC_647C7354618E066B_6039_UN""","""O(CCOCCOCC=C)CCOC1=CC(=CC(=C1)C)C""",21,"""C4BC6016E67B1F4B"""
+"""29DCA340F0A78348_C624E05309C65555_6039_UN""","""O(CCOCCOCC=C)CC(NC(NC(C)(C)C)=O)=O""",21,"""C4BC6016E67B1F4B"""
+"""2347D06C97E9CC36_542D92C4F14657AD_6039_UN""","""O(CCOCCOCC=C)CC(=O)NC1CC[S](=O)(=O)C1""",21,"""C4BC6016E67B1F4B"""
+"""04E3010E6EFEBF3E_590C0F0F7E9825F2_6039_UN""","""O(CCOCCOCC=C)CC(NC1=NN=C(CC)S1)=O""",21,"""C4BC6016E67B1F4B"""
+"""667D6BB2C2BAEEED_E29A43494A90E96F_6039_UN""","""O(CCOCCOCC=C)CC1=C(C(OCC)=O)C=CO1""",21,"""C4BC6016E67B1F4B"""
+"""D1DA6F30B15327A9_2D81C534CC6A9ADA_6039_UN""","""O(CCOCCOCC=C)CCOC1=CC=C(OC)C=C1""",21,"""C4BC6016E67B1F4B"""
+"""8329AE7026F4692F_F6F1FDBDE73BD825_6039_UN""","""O(CCOCCOCC=C)CC(CC1=C(F)C=CC=C1)=O""",21,"""C4BC6016E67B1F4B"""
+"""FA579BC40C4BBBD6_FA03A6BD8E1EFEB1_6039_UN""","""O(CCOCCOCC=C)CC(CC1=CC=C(F)C=C1)=O""",21,"""C4BC6016E67B1F4B"""
+"""2FAB249C94AA0386_24152A7F3D7726EB_6039_UN""","""O(CCOCCOCC=C)CC(NC1=C([NH]N=C1C)C)=O""",21,"""C4BC6016E67B1F4B"""
+"""559CEA83917CCA6E_79908DE2F8362D0A_6039_UN""","""O(CCOCCOCC=C)CC1=CC=C(C(F)(F)F)C=C1""",21,"""C4BC6016E67B1F4B"""
+"""1DA41810555D1B9D_29F582D9FCDAF5AC_6039_UN""","""O(CCOCCOCC=C)CC1=C(C=CC(=C1)OC)OC""",21,"""C4BC6016E67B1F4B"""
+"""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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+"""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"""
+"""4E7DBD721EC10E72_32DA4D1848C29A6D_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(N[C@@H](CC(C)C)C(=O)O)=O""",21,"""66E3F8A0D87DF815"""
+"""4B42F9B779DDA8E4_F28D8B19768B1A30_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCC(NC1=CC=C(F)C=C1)=O""",21,"""66E3F8A0D87DF815"""
+"""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"""
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+"""192C358F99911ADC_23F906EBE71828E1_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(C1=CC(=CO1)C(OC)=O)=O""",21,"""66E3F8A0D87DF815"""
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+"""7ABCBD3465057D85_CC02943B61E58C08_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC1SC(=NC1)N2CCOCC2""",21,"""66E3F8A0D87DF815"""
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+"""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"""
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+"""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"""
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+"""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"""
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+"""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"""
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+"""DDDB4E79269A2E96_EFE0ACB46A9D57DA_6039_UN""","""O(C(CC(=O)O)C(=O)O)CCOCCN1C(=O)CSC1=O""",21,"""66E3F8A0D87DF815"""
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+"""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"""
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+"""5D56C85559A7B44C_AB5EDEFE26EAEFC5_6039_UN""","""O(C(CC(=O)O)C(=O)O)CC(CCNC(C(F)(F)F)=O)=O""",21,"""66E3F8A0D87DF815"""
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+"""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"""
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+"""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"""
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+"""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"""
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+"""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"""
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+"""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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+"""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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+"""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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+"""5EE6C2BCF2A7A2C7_D7A99A5962893B70_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(C2=CC=C(F)C=C2)=O""",21,"""DBDE9615DC7CD085"""
+"""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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+"""E5369CBB41D2988B_F4A9470728304106_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(C2=C(N=C(C)O2)C)=O""",21,"""DBDE9615DC7CD085"""
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+"""09100E1E70168BAB_F1C58D8F4D03AC6D_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC3=CC2=C(C=CC=C2)S3""",21,"""DBDE9615DC7CD085"""
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+"""A9CD60916DC2A165_CB3A6461BBE656CC_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=CSC(=N2)C(F)(F)F""",21,"""DBDE9615DC7CD085"""
+"""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"""
+"""21849ACF7D13FAA4_28FB7BA7D2E90B5F_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(=O)N2CCNC(=O)C2""",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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+"""1151B2012CB18539_7A5FAD6ABC8F4F08_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CCNC(NC(C)(C)C)=O""",21,"""DBDE9615DC7CD085"""
+"""0BCE124EBBEF6E00_A1030772F4A9AEAF_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC(C2=CN=CC(=C2)C)=O""",21,"""DBDE9615DC7CD085"""
+"""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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+"""F691FBB69A1C5788_4B5F7CC06D076538_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C[N](C(C)C)N=C2C""",21,"""DBDE9615DC7CD085"""
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+"""F2B4103E0995C81B_A3EAA7AB3E8F82AF_6039_DP""","""O(C(C(=O)O)C1=CC=CC=C1)CC2OC(CC23CNC3)=O""",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"""
+"""B84533312185CE91_05093A7E3A5AD569_6039_UN""","""O(C(C(=O)O)C1=CC=CC=C1)CC2=C([S](C)(=O)=O)C=CS2""",21,"""DBDE9615DC7CD085"""
+"""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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+"""DD99BF25D917B75C_C234AFFFC04C2940_6039_UN""","""O(C(CC=C)C=C)CC(NC2=NC1=C(C=C(C)C=C1)S2)=O""",21,"""96EB72B01CCC5F6F"""
+"""574ED5918E1700AE_5D8527F20EC37586_6039_UN""","""O(C(CC=C)C=C)CC(C1=CC=C(NC(CC)=O)C=C1)=O""",21,"""96EB72B01CCC5F6F"""
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+"""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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+"""656DC13415B7CD08_F162F02BFBEBB1C8_6039_UN""","""CC(OCC2COC1=C(C=CC=C1)O2)C3=C(C=CC=N3)F""",21,"""FAC87D7902D3B881"""
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+"""11ABC983F4DB6ABF_AFE976ABE3A53724_6039_UN""","""CC(OCC(=O)CCC1CCCCO1)C2=C(C=CC=N2)F""",21,"""FAC87D7902D3B881"""
+"""FCCB56FEE3E8E17E_614981F043E08EF3_6039_UN""","""CC(OCCC(NC1=NOC(=C1)C)=O)C2=C(C=CC=N2)F""",21,"""FAC87D7902D3B881"""
+"""0F9B42B9975B7ACF_72B424D8B67F3019_6039_UN""","""CC(OCC(=O)NC1=C(C=CS1)C#N)C2=C(C=CC=N2)F""",21,"""FAC87D7902D3B881"""
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+"""574F38F8A33B9F7E_0AA2955FB3C3A95A_6039_UN""","""CC=CC(OCCCC1=CC(=C(OC)C=C1)OC)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""CA5880A883C06011_FA8D71353CB8C8F7_6039_UN""","""CC=CC(OCC2=C(OC)N=C1C=CC=CC1=C2)C(=O)O""",21,"""A4222EB7C4123F3B"""
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+"""9D240E10369BE6D6_FA32C52CCA6FF0EB_6039_UN""","""CC=CC(OCC2=N[N](C1=CC=C(C)C=C1)C=C2)C(=O)O""",21,"""A4222EB7C4123F3B"""
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+"""22368D17C4A3C9EF_95674B1EDB826768_6039_UN""","""CC=CC(OCC1=C(C)N=C(S1)C2=CC=CC=C2)C(=O)O""",21,"""A4222EB7C4123F3B"""
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+"""7D0FBC91E88649D7_C882FAF576EC401A_6039_UN""","""CC=CC(OCC1=NC2=C([N]1CC)C=CC(=C2)F)C(=O)O""",21,"""A4222EB7C4123F3B"""
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+"""1A73AA5E74D11A20_F30D5B5CDB8058ED_6039_UN""","""CC=CC(OCC([C@@H]1CC[C@H](C(F)(F)F)CC1)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
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+"""9E0F084B9359F690_026174FC2449A87A_6039_UN""","""CC=CC(OCC(NCC1=CC(=C(C)C=C1)F)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""884EFE0DC267254D_C57EB8A20BEB15EC_6039_UN""","""CC=CC(OCCC(NC(C)C1=CC=CC=C1)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""2FD3DE72F4DA37BC_C02DBABBC3169AFE_6039_UN""","""CC=CC(OCCC(NC1=CC(=C(F)C=C1)F)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""7AAB45DA736EE528_A13C4D62A490E639_6039_UN""","""CC=CC(OCC(NC1=NN=C(CCCC)S1)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
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+"""FB28E422749121E9_0561B6288498A085_6039_UN""","""CC=CC(OCC1=C(OC(F)F)C=C(C=C1)C#N)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""CA6106A3EE56CDC1_69EFA0B8FBE4E7BE_6039_UN""","""CC=CC(OCC1=CN=C[N]1CC2=CC=CC=C2)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""6D2E49077577ABFB_0761C677D27AE0B9_6039_UN""","""CC=CC(OCC1=N[N](C(=C1)C)C2=CC=CC=C2)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""F15C7E2C53DAFBA6_AC63370A048A50C9_6039_UN""","""CC=CC(OCC1=CSC(=N1)C2=CC=C(C)C=C2)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""F13013A6FED959B9_CE2DEBD08D935546_6039_UN""","""CC=CC(OCC(C1=CN=C(C(F)(F)F)C=C1)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""22DABAA3F6430130_FEA57276D12091A6_6039_UN""","""CC=CC(OCCOC1=CC=C([S](C)(=O)=O)C=C1)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""771228449B36862F_BB1BA6D409739BD6_6039_UN""","""CC=CC(OCC1=C(C(F)(F)F)C=C(C=C1)C#N)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""40CDF914134B3487_09121880B3D32073_6039_UN""","""CC=CC(OCC(N=C1C=CNN1CCCC)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""2CD4EF35885E7326_2FC9562A74A1E3A0_6039_UN""","""CC=CC(OCC(NCC1=CC(=CC(=C1)F)F)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""1E791AE751F5FDDC_38F70BDAA6962DF8_6039_UN""","""CC=CC(OCC(N(C(C)C1=CC=CC=C1)C)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""968206C010177C5E_C59D4A61BC086812_6039_UN""","""CC=CC(OCCOC1=C(C(F)(F)F)C=CC=C1)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""4D49D53B3179FA32_500682BE6D9E9E38_6039_UN""","""CC=CC(OCC(C1=CC=CC(=C1)[S](C)(=O)=O)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""0831A07E33E5B4E1_DC92FEEB84BABD44_6039_UN""","""CC=CC(OCC1=CSC(=N1)CC2=NC=CC=C2)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""52AD1E5A6E592B9B_6AB509D74AED23FE_6039_UN""","""CC=CC(OCC1=CC=C([S](C(C)C)(=O)=O)C=C1)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""4389C7AFAB7F345E_B883EE714CA3DC37_6039_UN""","""CC=CC(OCC(C1=CN=C(OC(F)F)C=C1)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""DE879C950C62C2A8_19555EDB880145E5_6039_UN""","""CC=CC(OCC(=O)C1CCOC2=C1C=CC=C2)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""F94C2BA342D4D062_EE696BCBD2BB5D77_6039_UN""","""CC=CC(OCC(N[C@H](C)C1=CC=C(C=C1)F)=O)C(=O)O""",21,"""A4222EB7C4123F3B"""
+"""31338AB1AAD0C1AD_2F6EDE0F8651CB66_6039_UN""","""CC(C)(COCC(NOC)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""002DD7E313146B20_90EB57B7747C5000_6039_UN""","""CC(C)(COCCC(OC)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4F2CF70D1BE0B648_15EC0C9F3AC776B1_6039_UN""","""CC(C)(COCC(OC)OC)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""F43912798C909D6C_5F1E60CFB499F31E_6039_UN""","""CC(C)(COCC(C(O)=O)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4E5F84E2DD0FD72D_1A541846A6ECD86B_6039_UN""","""CC(C)(COCCOC(C)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""B0B6D3655B3F5E9E_9C6341A0EB15C872_6039_UN""","""CC(C)(COCC1OCCO1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""1D75E760412531D6_34F4600B512CC585_6039_UN""","""CC(C)(COCC1CCCO1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""B8FEA27479A8EAD3_040AEA2D4E3C1E61_6039_UN""","""CC(C)(COCCC(NC)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4AA99F4C9978CD24_59EDEE692B809631_6039_UN""","""CC(C)(COCCCN=C=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""E4E69D1E90FC4CA7_AD97852AFF3EAE55_6039_UN""","""CC(C)(COCC1=NC=NO1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""7984B1E313795F1C_80E14AFCCCF279D7_6039_UN""","""CC(C)(COCC(=O)C1CC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""7115F21012080274_B36CD21B07C23327_6039_UN""","""CC(C)(COCC(CCC)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""987352431734288D_3B1894B49A059EB3_6039_UN""","""CC(C)(COCC(C(C)C)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""3BDABBD9F9AA4FF3_21B55C5716B184D4_6039_UN""","""CC(C)(COCCCCOC)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""F3CFD8449423587A_FA4B0C49459C009B_6039_UN""","""CC(C)(COCCCN(C)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""56FC52050781A594_31FADAE41AD2CB24_6039_UN""","""CC(C)(COCCCOCC)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""315666C3103710BB_1A46DF4F69CF9E32_6039_UN""","""CC(C)(COCCCC(C)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""1A5F33D81A007001_D8F1BB0624DED7E7_6039_UN""","""CC(C)(COCC1=NOC=N1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""9C4C1914DD594AF0_82F7AC76371F68EE_6039_UN""","""CC(C)(COCCC(C)(C)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4D02B0771286A5E6_37DA8251FD02D73A_6039_UN""","""CC(C)(COCC1=CSC=N1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""F802C035843E393B_ADD441398E2B5177_6039_UN""","""CC(C)(COCC1=NN=N[NH]1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""118B22593EC1255F_AA43BF4F4A87A571_6039_UN""","""CC(C)(COC[CH]=[C]1C[CH2]C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""7373380D261A2304_A666E3650C10B809_6039_UN""","""CC(C)(COCC(N(C)C)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""505A115C74341555_A87D4BED9C24B3B4_6039_UN""","""CC(C)(COCC#CCOC)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""AF2CC286DFBDA574_1CB853858C4AD135_6039_UN""","""CC(C)(COCCC(Cl)(Cl)Cl)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""B5C07098A91A8182_83C7B3CA1F48107D_6039_DP""","""CC(C)(COCCCC(O)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""7AAE9923C19B3687_2CD3216E25ACC435_6039_UN""","""CC(C)(COCC1=C[NH]C=N1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""B99FF53D22A7E1D7_8B102D0E16167141_6039_UN""","""CC(C)(COCCC=CCC)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""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"""
+"""241351E1EADDDB39_ABB2AD2307C9A29F_6039_UN""","""CC(C)(COCCC(NO)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4A41C18417CC90CA_21861208BB203258_6039_UN""","""CC(C)(COCC1=C[NH]N=C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""9DC9D201384498CA_3A5B7C310268FE3B_6039_UN""","""CC(C)(COCC[S](C)(=O)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""303777E02EB74900_E924427B784493DD_6039_UN""","""CC(C)(COCC(COC)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""6F032880057380C5_7BF3305977A5DA57_6039_DP""","""CC(C)(COCCC1CNC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""FAF342EF1E7A722F_7609F119B8E3A1B1_6039_UN""","""CC(C)(COCCCCCF)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""9C8D98E996D04C93_282E141C157CBF49_6039_UN""","""CC(C)(COCCSC(C)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""0CD286A833879D58_6596FEB4C9C7DBFC_6039_UN""","""CC(C)(COCC1=C[NH]N=N1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""04037356457633D4_EE17FC35F426E968_6039_UN""","""CC(C)(COCC(OCC)=N)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""7075BEE14E2C3BE6_344BB436C014D32B_6039_UN""","""CC(C)(COCC1=CC=N[NH]1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""DF2B079CDEDDC99C_7A9BD04EAEADB8F9_6039_UN""","""CC(C)(COCC(C(C)=O)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""D989280FE2696A41_62BBC897C29A6B13_6039_UN""","""CC(C)(COCC1=CN=NS1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""E11A94C5F7E2C6CD_5491CFB5A5C5AE52_6039_UN""","""CC(C)(COCC[S](F)(=O)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""C38970EFF8EBCB75_DCEA3FD0671765EB_6039_UN""","""CC(C)(COC[C@H]1CCCO1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""914D123A9BA844A8_0FBBFB462A31C853_6039_UN""","""CC(C)(COCC[Si](C)(C)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""0602DA8911BA56D1_B2AACB84E27B9486_6039_UN""","""CC(C)(COCC(NCC)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""9F5EDA7AB9E71039_15208DA396FD2198_6039_UN""","""CC(C)(COCCOCC=C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""EB95C6C0ABD824B8_9170F7C317E4A931_6039_UN""","""CC(C)(COCC1=CSC=C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""BA346A691AA9842A_84B6EFCA6E3893D3_6039_UN""","""CC(C)(COCC1=COC=C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""1751494D4C355874_F8DF1DBEF5944A22_6039_UN""","""CC(C)(COCC#CC(O)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4732574FDF329F81_1382867A6AC9FB92_6039_UN""","""CC(C)(COCC1=NC=C[NH]1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""9D2B4F2F2B779072_A1E028D49B9BAC8A_6039_UN""","""CC(C)(COCC1=CSN=N1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""73C8D6B850570E4B_D1C74322156FFF65_6039_UN""","""CC(C)(COCC1=NON=C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""6C7CEE631F4D1E69_81ED253D2F04CBDE_6039_UN""","""CC(C)(COCC1=NOC=C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""975E91A882295D6C_AE270502EE4AC26B_6039_UN""","""CC(C)(COCCCCC=C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""537D446EAFCAC506_7F2B53EDF64C7AF2_6039_UN""","""CC(C)(COCC1=NSN=C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""B40D1E0C13136030_00D7604FC5D637B2_6039_UN""","""CC(C)(COCC1=CC=NO1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""9644D9880F3FE09E_138A0210EAB9F539_6039_UN""","""CC(C)(COCC1=CON=C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""041C3642DAFBF02C_450733655ED0B5F9_6039_UN""","""CC(C)(COCC1COCO1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""AAE5D1C28EF91589_D3B17AE100B6D380_6039_UN""","""CC(C)(COCCSC(C)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4A80D4FA64535BA9_2921F1664DD537BF_6039_UN""","""CC(C)(COCC(CC)OC)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""272CBDAC98C02891_7F240F79388C8B81_6039_UN""","""CC(C)(COCC1=NN=CO1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""DC6F7BFA71F992C0_D37EA0A085EC6AAE_6039_UN""","""CC(C)(COCCC(F)(F)Cl)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""C415229286AD8890_F4D0959DD59EEA46_6039_UN""","""CC(C)(COCC[S](O)(=O)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""57CF9E62409D248E_063B5E401C0D2AC3_6039_UN""","""CC(C)(COCCOC1CC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""572814C2DB3E67F2_CFD9B94230689C00_6039_UN""","""CC(C)(COCC1=CN=CS1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""F43569F8F0D1614D_31AF5D3C2C6317E4_6039_UN""","""CC(C)(COCC1=CC=NS1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""276EA446C4F8B740_F618ACCF3C370313_6039_UN""","""CC(C)(COCC1CC(=O)O1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""2AA2AA757C5F0878_CBA1F5F9A170D4A8_6039_UN""","""CC(C)(COCCOC(C)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""66E27A115B9C533E_DDE5778B4900CAC3_6039_UN""","""CC(C)(COCCOCC#C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""D370C4583758B1D7_61CE0694F792B2DC_6039_UN""","""CC(C)(COCC(CC)(F)F)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4AFA2467D216B27C_0A4F18BF4E9FA27B_6039_DP""","""CC(C)(COC[C@H]1CCCN1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""0EFEF9A820A6E2A3_D94C97FF06FE7E12_6039_UN""","""CC(C)(COCC1OC1(C)C)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""27432EA7B240793C_1D3DC26903D8770B_6039_DP""","""CC(C)(COCC(C=CO)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""626E33FD8385A647_3F3632DE73D78B3F_6039_UN""","""CC(C)(COCC1=CSN=C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""CB87A6614578D0F5_D8E6276C9D0984A5_6039_UN""","""CC(C)(COCC1=NCCO1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""919B1CB15AFDABB1_445EB9093F5035C7_6039_UN""","""CC(C)(COCC1=NN=CS1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""2A26EDF8A4915DDF_35EB684E6CA29197_6039_UN""","""CC(C)(COCCCC1CC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""E3110F2C3B354048_6B9A4FD5B3071E19_6039_UN""","""CC(C)(COCC(C(F)F)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""75B07800096E80B6_4497152189A44011_6039_UN""","""CC(C)(COCC1=NOCC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""CB995F90B5CF947B_75C4763AC7DC8F63_6039_UN""","""CC(C)(COCC(OCC)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""1841E2F5E8624EDE_26BC61D9A0A7C763_6039_UN""","""CC(C)(COCC[S](N)(=O)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""A2D5945998FBAF63_00B8672981F0F4DA_6039_UN""","""CC(C)(COCCCCC#N)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""830B17B79B82D0E0_FFE9A5DC684D695F_6039_UN""","""CC(C)(COCCC=CC=C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""1C47BFBF2207AC82_28B566D811B6EDC4_6039_UN""","""CC(C)(COCCNC(C)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""9A0C668C83FB27F4_65E758BD10052075_6039_UN""","""CC(C)(COCC[S](=O)(=O)Cl)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""0FC6E25FDCC57D41_2B1707509EEC3D18_6039_UN""","""CC(C)(COCCCCCC)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""CABFBD346120F074_3A539A3ACF861108_6039_UN""","""CC(C)(COCCC(CC)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""7B6CADE9586347F1_0D3275106D4007C8_6039_UN""","""CC(C)(COCCCC(C)=C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""C4CF86E1A7958D0E_B2190078AD417F01_6039_UN""","""CC(C)(COCC(=C)CC#N)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""6440488778E668EB_C335936BE77B3204_6039_UN""","""CC(C)(COCCCC(F)F)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""A0688754F0D230F7_6626C4AF99B9BF68_6039_UN""","""CC(C)(COCCC=C(C)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""8578D41277381BFE_D8AFA18CD0B374B0_6039_UN""","""CC(C)(COCC=C(C)C#N)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""F675B0853392C6C3_4106EF77EF6C71CC_6039_UN""","""CC(C)(COCC(NCO)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""3BD60A1ECF293F7B_0C035D0C30E0FF08_6039_UN""","""CC(C)(COCCOC(F)F)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""16E89EE96AB862AC_0C61BA14589002BA_6039_UN""","""CC(C)(COCCC1(C)CC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""DEA40007E778C650_6EABDE0E5611953C_6039_UN""","""CC(C)(COCC#CC1CC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""3730532507421861_AFB21BBF82D9B30E_6039_UN""","""CC(C)(COCCC1COC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""ACBCB301FC87ED41_23A8CA0610042276_6039_UN""","""CC(C)(COCCCC(N)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""2ADF0BB9FB483DA8_0785B8A5C45C4E07_6039_UN""","""CC(C)(COCCC(C)(F)F)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""468AFBD8C8AD4423_80DAA33173FE60F4_6039_UN""","""CC(C)(COCCC1(C)N=N1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""A38BF6AAD27C5E81_B0CFC454D3203B32_6039_DP""","""CC(C)(COCC1CCCN1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""598F05A661F8D524_A38D6DECF6908312_6039_DP""","""CC(C)(COCC([C@@H](C)N)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4C5CA24BBEADB32A_8A6A24A85FE54305_6039_UN""","""CC(C)(COCCN1CCC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""65761982350CBED3_4522D89EC145DCFD_6039_UN""","""CC(C)(COCC1=N[NH]C=C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""9CB35457C2D8A647_9AAF77CF442CA890_6039_UN""","""CC(C)(COCCC(C)(C)F)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""2DF9F03D59731374_587BDF072FF6F833_6039_DP""","""CC(C)(COCC(C(C)C)N)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""88B943256B74FA90_D4E6F41C329F2BC9_6039_UN""","""CC(C)(COCCCN=[N]#N)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4589954AAE68956E_E0C2F18C68820AFA_6039_UN""","""CC(C)(COCC[N+](C)(C)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""6214DD2D3BC89263_8672A079FCC97BDD_6039_DP""","""CC(C)(COCCCCCO)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""4F90A2941F8C766A_F4059CE94BFD01D5_6039_UN""","""CC(C)(COCCOCCC)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""9CBE75DFD29D4725_9E446E5B938D7428_6039_UN""","""CC(C)(COCC1=NC=CS1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""A26E81DFB238BEDE_FFFAC458EC9A5560_6039_UN""","""CC(C)(COCC1=NSC=C1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""616705B5188EF269_43636711AB230274_6039_UN""","""CC(C)(COCCCCC#C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""450B1C18E6698093_C45CD9CCC00A1AB5_6039_UN""","""CC(C)(COCC(C)N(C)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""93E78D31FF968432_060B60D7F2CEC14A_6039_UN""","""CC(C)(COCCCC1CO1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""9E91B11A095AB94B_9A7208EDE0DC911B_6039_UN""","""CC(C)(COCCC1CCC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""CD3FF66842976665_E9A5A6ADF67C57F8_6039_DP""","""CC(C)(COCCNC1CC1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""E7A08E95B70620B6_FDEDB3A07A774409_6039_UN""","""CC(C)(COCCN(CC)C)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""35BE087ED1249DCC_48A023551FE48C0C_6039_UN""","""CC(C)(COCC1OC1CC)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""2CDFA6D8D361107B_B498B6C8BB25C3FB_6039_UN""","""CC(C)(COCCCC=CC)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""42534B20366D6145_69C3E61AD6262481_6039_UN""","""CC(C)(COCC1=N[NH]C=N1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""DC6191AF743A5BB7_C54289A21EF1C306_6039_UN""","""CC(C)(COCC1=CN=CO1)C2=CC3=C(C=C2)CCCC3""",21,"""E29916F055BFA3E5"""
+"""D5FF3A559566EBBA_54BD4A818FE015FC_6039_UN""","""CC(C)(COCC(=O)C(Cl)Cl)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""B2831C4DF1CA4899_16C0038C1A018D47_6039_DP""","""CC(C)(COCC([C@H](C)N)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""9A0C668C83FB27F4_99E8C060C443FF1C_6039_UN""","""CC(C)(COCC[S](Cl)(=O)=O)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""1C6EDECDA0A8B2D6_F1C09CCE476C78B9_6039_UN""","""CC(C)(COCCCSCC)C1=CC2=C(C=C1)CCCC2""",21,"""E29916F055BFA3E5"""
+"""30AF07A6064DEFF3_9193AECC9CCFE1AB_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC(=N2)C3=CSC=C3""",21,"""2BD09AE10BE769AD"""
+"""7F2AE43FCADA4F5C_50BC8630DFE4C329_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)C3=CC=CO3""",21,"""2BD09AE10BE769AD"""
+"""8753D21A683607A8_A529D44A8E044F47_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)C3=CC=CS3""",21,"""2BD09AE10BE769AD"""
+"""CBB95D0AE5AD6FEB_EA3AA8E57270E291_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2=CC=CC(=C2)CC""",21,"""2BD09AE10BE769AD"""
+"""6F09451E95FD1A12_02C753E638A0A869_6039_UN""","""O(CCCC1C(NCC1)=O)CCC(C2=CC=C(F)C=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""8BBCFF34D31F4AC6_2015D91B33BDBE0A_6039_UN""","""O(CCCC1C(NCC1)=O)CCCOC2=C(C)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""49D69B067F0C6CB9_6E9B559BE17316B1_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2=CC(=CC=C2)C#N""",21,"""2BD09AE10BE769AD"""
+"""0780071EA2C8719D_4403B69A3A634910_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=C(C)C=C2)C)=O""",21,"""2BD09AE10BE769AD"""
+"""4E88C109B31E85B4_96C65F2A0268B32E_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=C(F)C=C2)F)=O""",21,"""2BD09AE10BE769AD"""
+"""B77B854D32FB258A_8B1089A38C12708D_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2=CC(=CC(=C2)C)C""",21,"""2BD09AE10BE769AD"""
+"""DCF3A6B96A4262A6_29481AA4E45A23B3_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(NC(C)(C)C)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""DE2D0BEE95BCCA7B_BB4168331CDA214B_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NC2CC[S](=O)(=O)C2""",21,"""2BD09AE10BE769AD"""
+"""A1F49DE4EE30B6C1_B660F5F893045314_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2=NN=C(CC)S2)=O""",21,"""2BD09AE10BE769AD"""
+"""1403DBDCD8D02DBA_0DF6B9BEA70C9F89_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(OCC)=O)C=CO2""",21,"""2BD09AE10BE769AD"""
+"""7424A8D34A9C3753_C2ED3FC321F6EC3C_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2=CC=C(OC)C=C2""",21,"""2BD09AE10BE769AD"""
+"""C2CDE230FA285FDE_199D074A0AA7AEC3_6039_UN""","""O(CCCC1C(NCC1)=O)CC(CC2=C(F)C=CC=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""7811D7DD3DDE47E6_156F5C4A63828857_6039_UN""","""O(CCCC1C(NCC1)=O)CC(CC2=CC=C(F)C=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""A31216767EEE5C89_CB79D088D0EB500D_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2=C([NH]N=C2C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""2EAD7ED4C4C1CDE5_96FC771515AA5BEC_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(C(F)(F)F)C=C2""",21,"""2BD09AE10BE769AD"""
+"""203BA1ADA1B7CFB6_C699782E1146834A_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C=CC(=C2)OC)OC""",21,"""2BD09AE10BE769AD"""
+"""DDD2619EB61AE98F_2BFEBAA703A69AA5_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(C)C2=CC=CO2)=O""",21,"""2BD09AE10BE769AD"""
+"""2C85F87CA442E67A_C60ADD3D63CEDFC9_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=COC(=N2)C3=CC=CS3""",21,"""2BD09AE10BE769AD"""
+"""B20FBD55100DE75D_1889E3DB2F315B49_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)C3=CSC=C3""",21,"""2BD09AE10BE769AD"""
+"""0774A9E70D91AF45_FC0F79876CE1ECAF_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC(=N2)C3=CC=CS3""",21,"""2BD09AE10BE769AD"""
+"""27FE8B9F8E7A8679_72BA42ABA4FED675_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(CCC(C)C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""23721CB44A341583_59500DC0B4DE79FE_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2=CC=C(C=C2)C#N""",21,"""2BD09AE10BE769AD"""
+"""CE8611D1FCA02F56_EBED3ACEA28135C6_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NCC2=NC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""14150968C117974E_38C70F7E7D99D85C_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""1394BB7EBC0F0F55_0AA4DD9BCDAA09E5_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=C[N]2C=C(C)C=CC2=N3""",21,"""2BD09AE10BE769AD"""
+"""A66AF18328921534_1D9949F73FF51880_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=C[N]2C=CC=C(C)C2=N3""",21,"""2BD09AE10BE769AD"""
+"""798D87DAD45C537D_B4315609161B65FB_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC3=C(C=C2)C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""3FDAC7E2C36B103E_A9F7AAE53DAFB934_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)C(OC)=O""",21,"""2BD09AE10BE769AD"""
+"""B3E0E88885704ED0_C976643D0370CE53_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=C[NH]2)[N](=O)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""B567FA778B0920EC_F67A32BB205A82A1_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NN=C(O2)C3=CC=CS3""",21,"""2BD09AE10BE769AD"""
+"""EACC33942828E66A_0D5E8E005CE78818_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=C(C=C(F)C=C2)F)=O""",21,"""2BD09AE10BE769AD"""
+"""9A217D80BC7ED26A_95EB2A8F7A35FC6C_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=C(C=CC(=C2)C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""A5C5A3DEB4104366_3D45F0C72A636B3E_6039_UN""","""O(CCCC1C(NCC1)=O)CCCCOC2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""DBEE38C6DD18CC6E_CE6001350772EC76_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)C2=CC=C(C=C2)C#N""",21,"""2BD09AE10BE769AD"""
+"""D4C405D562EA77F0_16A6C201B8D046EA_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=C2N=CC=CC2=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""E39118ED73D24EBE_A8F65B56351B9484_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=N)NC(=N2)N(C)C""",21,"""2BD09AE10BE769AD"""
+"""59687F547949B0E8_7FCBC1D9E3663C80_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(C)C2=CC=CS2)=O""",21,"""2BD09AE10BE769AD"""
+"""18B316DFD8C75274_85C29EA37FD53B75_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC=C(CC)C=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""DB5F94C7AD2E098B_357202902AFB24A9_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NC(=O)C2=CC=CS2""",21,"""2BD09AE10BE769AD"""
+"""F28403CEB0A0EFD2_FB8BE0F3DDE56C61_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC(=N2)C3=CC=CO3""",21,"""2BD09AE10BE769AD"""
+"""1CC522DA1202E6D5_44C812BB4AE18E24_6039_UN""","""O(CCCC1C(NCC1)=O)CCC(=O)NC2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""54646C947ED4B52D_78B34907DB3AEBB0_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)OCC2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""4D89F0AAD5CB5F9B_2FD85AE240F325C0_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NCCCC(OC)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""4E318E652617C95F_767CDD38458CB649_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(C(C)(C)C)C=C2""",21,"""2BD09AE10BE769AD"""
+"""56064E6489BEFD83_A200BBBE39266B64_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=C(F)C=CC=C2F)=O""",21,"""2BD09AE10BE769AD"""
+"""F66FCA7A3CD52339_B3E5E6D7EB6912B6_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(C(C)C)C(=O)C)=O""",21,"""2BD09AE10BE769AD"""
+"""106FFFCE2E3E0695_BFBBD4466B4AA537_6039_UN""","""O(CCCC1C(NCC1)=O)CC2OCCN(CC(C)C)C2""",21,"""2BD09AE10BE769AD"""
+"""5C0A5049D62569DD_A69C43975C04AE44_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC(=C2)C3=CC=CO3""",21,"""2BD09AE10BE769AD"""
+"""B7460486F5ADBA24_6FB12CA822CEC785_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)OC(F)F""",21,"""2BD09AE10BE769AD"""
+"""FDF554AF1C503BE7_DE29E5B2D85E5913_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(C(OCC)=O)O2""",21,"""2BD09AE10BE769AD"""
+"""6B87561DAF9C09E3_D01A589B812DD7D0_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2=C(OC)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""3E7786D48E30BF97_DD2CB1D1C646D97D_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NNC2=NC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""E04F442430D52B06_24E0E7C484F60F54_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N=C2N=C(SC)NS2)=O""",21,"""2BD09AE10BE769AD"""
+"""CF8F4A9860E5FF30_CCB9952B14F57E7B_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2C)[N](=O)=O""",21,"""2BD09AE10BE769AD"""
+"""1962626D26F7EB70_6EEA13585EB025B2_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NC2(CCCC2)C#N""",21,"""2BD09AE10BE769AD"""
+"""3CE4411B1D92A475_125D013BC15CAECF_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC=C(C(=C2C)OC)C""",21,"""2BD09AE10BE769AD"""
+"""11A9FE8BFCD3FB5E_26ACB9035142041A_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C(C(OC)=O)O2)C""",21,"""2BD09AE10BE769AD"""
+"""D53717669508ACCE_5C7E7762F989BBFF_6039_UN""","""O(CCCC1C(NCC1)=O)CCSC2=CC(=C(C)C=C2)C""",21,"""2BD09AE10BE769AD"""
+"""CF67E4D6B7273A87_2E4190DA7AA0CA9A_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NC(=O)C2=CC=CO2""",21,"""2BD09AE10BE769AD"""
+"""4AC22842150B2DB8_D7EEB4DD93F2D84A_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)OC(C)C""",21,"""2BD09AE10BE769AD"""
+"""DF908EC2775CCE2F_0DC6D33622E82A35_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NCC2=C(C)C=CS2)=O""",21,"""2BD09AE10BE769AD"""
+"""FCAB94FF2A1E6D80_F7482EE9638478BD_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NCC2=CC=C(C)S2)=O""",21,"""2BD09AE10BE769AD"""
+"""9BF37ABBD11F36D4_6EDA697EF76FE1BC_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(CC(C)C)C2CC2)=O""",21,"""2BD09AE10BE769AD"""
+"""4940DA2B988E4D6F_599B5B622F8885A5_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(CC)CC(C)C#N)=O""",21,"""2BD09AE10BE769AD"""
+"""C33C1D145D825E9B_03AA5CCCB311D2E6_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NCCC2=CSC=C2""",21,"""2BD09AE10BE769AD"""
+"""6EB41E2D5268F47A_76A4D52AB9FB6D96_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(C)C(=O)N(C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""3B65B247142FAAFD_9FBA1C287E831A59_6039_UN""","""O(CCCC1C(NCC1)=O)CCNC(OCC(F)(F)F)=O""",21,"""2BD09AE10BE769AD"""
+"""61F61B32687AFAB2_FE05A202E32CF10F_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(OC)=O)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""97DFD5EFF26E5D07_AACD31DC5919409A_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)CCC(C)C""",21,"""2BD09AE10BE769AD"""
+"""FCFCD8530BF6B709_3543F2D2E2DC91F7_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)N(C)C(=O)C""",21,"""2BD09AE10BE769AD"""
+"""C0E5FDFE0D6C77EC_F96047E3A9DF2657_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)OCCO3""",21,"""2BD09AE10BE769AD"""
+"""447BBE81A161517A_176177E822A2FF7F_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(OC(C)C)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""52657AD263023961_6CE541691B06E687_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC3=C([N]2C)C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""CEDE3B256620277E_8B5F3610BAB4F846_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(CC(C)C)C=C2""",21,"""2BD09AE10BE769AD"""
+"""5BAC32A4983FEA21_8B26B41C05CACF06_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)C3=CSC=C3""",21,"""2BD09AE10BE769AD"""
+"""B1567AF06298BE99_F3AD1BF000ED643F_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=NC2=C(F)C=CC=C2[NH]3""",21,"""2BD09AE10BE769AD"""
+"""E28B79AABF564328_BAC399FC4F75EA82_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=CO2)C(O)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""5B5D91E4D54489D6_BA7C5B415A603A4D_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=CO2)C(N)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""7E9C095CE135AA69_E00D58900533E3A8_6039_UN""","""O(CCCC1C(NCC1)=O)CCCCC[N]2C=C(C)C=N2""",21,"""2BD09AE10BE769AD"""
+"""502BDD8FBA37474B_77AEBA8A38BF9F2F_6039_UN""","""O(CCCC1C(NCC1)=O)CCC(N(CC(OC)=O)C)=O""",21,"""2BD09AE10BE769AD"""
+"""AEB6C6E6BF12E6FA_96D51038B59B24D6_6039_UN""","""O(CCCC1C(NCC1)=O)CCC[N]2N=C([N](=O)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""2BFD411F1686F551_C1D34F5B4180ED9F_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)C3=COC=C3""",21,"""2BD09AE10BE769AD"""
+"""F803F0FCEA653216_66876831699D7132_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)C3=COC=C3""",21,"""2BD09AE10BE769AD"""
+"""3D807EBCDBBFD1F7_A999AB4C9FBC0A81_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=C[N]2C(=CC=CC2=N3)C""",21,"""2BD09AE10BE769AD"""
+"""6B419F0B38CE8C81_76EF6ED0D7F69B4A_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=CS2)C(C)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""8FDAF0A4D84B6988_CAD9D1C4043549A2_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC=C[N]2CC(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""E3769917EA393871_4B1360081290D8D6_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2=NC=C(C(C)(C)C)O2""",21,"""2BD09AE10BE769AD"""
+"""9B33F1AFA6B55E08_4E8738F2C827456F_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(CC(OCC)=O)C)=O""",21,"""2BD09AE10BE769AD"""
+"""229D1BB68F696394_D265D15694D50A9F_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C(C=C2)SC)OC""",21,"""2BD09AE10BE769AD"""
+"""11568DE910942812_3E1844F69BDBC814_6039_UN""","""O(CCCC1C(NCC1)=O)CC2OCCC3=C2C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""D7647EE9388BEB17_84BE62932B5C8166_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)C(OCC)C""",21,"""2BD09AE10BE769AD"""
+"""74DCE9F7DE5D4C89_5DEA3025EAEC7EF9_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=N[N](C(CC)CC)C=C2""",21,"""2BD09AE10BE769AD"""
+"""EC234CE33F1889AA_BEF92329E49D9B35_6039_UN""","""O(CCCC1C(NCC1)=O)CCCC2=CC=CC(=C2)OC""",21,"""2BD09AE10BE769AD"""
+"""0114EC4D02D68200_17DEB2DEC370C252_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2=CC3=C(C=C2)OCC3""",21,"""2BD09AE10BE769AD"""
+"""B39E593963755FA4_6B3B8584D68ECD95_6039_UN""","""O(CCCC1C(NCC1)=O)CCN2CCN(C(C)C)CC2""",21,"""2BD09AE10BE769AD"""
+"""777D45A825AE83E2_649DE3713554BFB9_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=C2C=CC=CC2=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""6D7F09F123D5EF14_466095FAAD9A9283_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=C2OCCOC2=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""C6045E34A2D32365_42A704B3CF224F2F_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2=CC=C(SC)C=C2""",21,"""2BD09AE10BE769AD"""
+"""87310EDAD6CAA222_FBD288209463EBF4_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(C=C2)OCC#N""",21,"""2BD09AE10BE769AD"""
+"""47155F25CAE3B5AA_314AA344C0B71D9B_6039_UN""","""O(CCCC1C(NCC1)=O)CCN(CCCC)CCCC""",21,"""2BD09AE10BE769AD"""
+"""BA1AD70E0FE7DA3A_2E50A4161D97A807_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2=CC=C(C(O)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""04DEC44559F384E8_FC5B0F9FFA164CD5_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)C[S](C)(=O)=O""",21,"""2BD09AE10BE769AD"""
+"""8088119D64D65A85_4552BB1EF96EE4E0_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)C3=N[NH]C=N3""",21,"""2BD09AE10BE769AD"""
+"""B5BA646B9A7669C4_5C01957A9EA0805E_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=C(C=C2)F)C)=O""",21,"""2BD09AE10BE769AD"""
+"""B190B59766609D5F_10B517FDB4B565AF_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=NC2=C(C=CS2)C(=O)N3""",21,"""2BD09AE10BE769AD"""
+"""50E8CBA8B1CE82A7_493B1CC5F25B1DA5_6039_UN""","""O(CCCC1C(NCC1)=O)CCCNC(=O)C2CCCC2""",21,"""2BD09AE10BE769AD"""
+"""FEDD8B50A1DA5875_887D6288F3ED57FE_6039_UN""","""O(CCCC1C(NCC1)=O)CCN[S](CCCOC)(=O)=O""",21,"""2BD09AE10BE769AD"""
+"""2847C9900E546649_BD4B370F118C7833_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(OC(C)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""689F10368DA71140_44A534CDD485A926_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=CS2)C(O)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""7DDD31F3B9806A01_6377D37663363070_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC(=N2)C3=COC=C3""",21,"""2BD09AE10BE769AD"""
+"""DEE4EB2AC647CBC2_25C3D1A4212FAB6F_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=CS2)C(N)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""CECC469140AFD957_B726A4664746E5FD_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC=C(O2)C3=CC=CS3""",21,"""2BD09AE10BE769AD"""
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+"""5D62F45185C28C86_6F6A291D63615185_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=CC2=C([N](C)N=N2)C=C3""",21,"""2BD09AE10BE769AD"""
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+"""8F11E49ED23F852B_8AB4F6FC26EB306C_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C([N](C)N=C2)C(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""AC3037248AEA3EAE_8BD3868273CD0883_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)CCC(C)C""",21,"""2BD09AE10BE769AD"""
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+"""271B68A5A620D35C_6D65BF2C2711E13C_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C[NH]C(=N2)C3=CC=CS3""",21,"""2BD09AE10BE769AD"""
+"""C2D8B708DCC5DE3E_FD23D1805CBDA392_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(OC)C=CC(=C2)C#N""",21,"""2BD09AE10BE769AD"""
+"""E42E12A754E6D04F_7C572089029ED7BC_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)NC(=O)O3""",21,"""2BD09AE10BE769AD"""
+"""9B11DF9475894956_568D804F6191A4AC_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2=CC=CC(=C2)OC""",21,"""2BD09AE10BE769AD"""
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+"""4D08E1CBF5FBB34C_BE0CEB139D10CF5C_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(NCC(C)C)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""88AE169640AA175D_1C8A1E4DB6C5C6E2_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2CCC(C)CC2)=O""",21,"""2BD09AE10BE769AD"""
+"""14ADF33EEA84AFCC_FE95B787C94C8908_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)C3=CC=CO3""",21,"""2BD09AE10BE769AD"""
+"""5EE256A86516435D_9C6EEC146F555CD5_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2=C(C)C=CC=C2C""",21,"""2BD09AE10BE769AD"""
+"""D40F1BD9B0FB4C59_8FE14D0CF524842B_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)C3CCCC3""",21,"""2BD09AE10BE769AD"""
+"""4DD3B816AD4BC5C5_08BCFD48CAF05559_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)C3CCCC3""",21,"""2BD09AE10BE769AD"""
+"""9FD58EE15973183F_99A822477EA867DB_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(CC(C)C)C(C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""9233C4ECCE98E946_A18C1057EAE5B234_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(CC(O)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""E8294B23B3BB888D_3AFB4848BA9F36BD_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NCCOCCCC)=O""",21,"""2BD09AE10BE769AD"""
+"""41FDF22F9971936E_C21DD86AEA7832A3_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)C(OCC)=O""",21,"""2BD09AE10BE769AD"""
+"""6DCA7502FCFAE2D3_B4874EB486EEFC85_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)C3=CC=CS3""",21,"""2BD09AE10BE769AD"""
+"""C62BEC798BD2165B_1505BBD074B70AAE_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NC(C2CC2)C3CC3""",21,"""2BD09AE10BE769AD"""
+"""6A46411B929B5A69_D0C21C43531EF9B1_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=NC2=C(SC=C2)C(=O)N3""",21,"""2BD09AE10BE769AD"""
+"""E92C80499F7D4079_E1FE8084D8C22BF0_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NCCC2=CC=CS2""",21,"""2BD09AE10BE769AD"""
+"""F1DB49879EFE6E4A_3D218CE4A4BB7DE6_6039_UN""","""O(CCCC1C(NCC1)=O)CCN2C(NC(C)(C)C2=O)=O""",21,"""2BD09AE10BE769AD"""
+"""C1B187C6A1690262_A60F563E3DBE5032_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(C)(C#N)C2CC2)=O""",21,"""2BD09AE10BE769AD"""
+"""A91F054693D385AA_0322D56031D81DD8_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=NC2=C(C=CC(=C2)F)O3""",21,"""2BD09AE10BE769AD"""
+"""95B38B8DCCCCE977_6084F0FF0D227BDF_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(C(C)C)(C)C#N)=O""",21,"""2BD09AE10BE769AD"""
+"""10020D1EC01CB877_1D311DFB53DEFFC0_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C([N](=O)=O)C=CC(=C2)F""",21,"""2BD09AE10BE769AD"""
+"""BF43A1376BAFF54F_9C410AB47E3D4210_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)CC(NC)=O""",21,"""2BD09AE10BE769AD"""
+"""28445F7DC301860A_4488901043853935_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(N(CC)C)C=C2""",21,"""2BD09AE10BE769AD"""
+"""6E72D8FE0C510332_FF91D548C21A179F_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)N(C)C3CC3""",21,"""2BD09AE10BE769AD"""
+"""1E464B08C33929F0_B66FBD753970AF71_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=N[NH]2)C3=CC=CS3""",21,"""2BD09AE10BE769AD"""
+"""9F487B6B01DA26E8_1CBA693442AB5BF6_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C)SC(=C2)C(OC)=O""",21,"""2BD09AE10BE769AD"""
+"""89C5152CD24E3A19_A50F49B36C4EDA7C_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NNC(=O)C2CCC2""",21,"""2BD09AE10BE769AD"""
+"""A6C7EC9C7FFBA846_8334C9B237BB1B6A_6039_UN""","""O(CCCC1C(NCC1)=O)CCCOCC2CCCCO2""",21,"""2BD09AE10BE769AD"""
+"""AD0ED4571DAC2C16_9DCC5ED48A4F28D7_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C=C([N](=O)=O)C=C2)F""",21,"""2BD09AE10BE769AD"""
+"""CE107679B14C1B1B_8AE059ADA08DD995_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(OC)C=C(C=C2)C#N""",21,"""2BD09AE10BE769AD"""
+"""DE3FF7F5C10481B5_001DC09D5225E10C_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)C3CCCO3""",21,"""2BD09AE10BE769AD"""
+"""B77851B76D55D2CF_5DFD18690881CC89_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NCC2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""88F82EE646236DFB_F9FF22E6C260B84D_6039_UN""","""O(CCCC1C(NCC1)=O)CCCCCN2CCCCC2""",21,"""2BD09AE10BE769AD"""
+"""B8FD2D69AFD22E80_44CFF0C36137A22A_6039_UN""","""O(CCCC1C(NCC1)=O)CC2OC(=C(C(OC)=O)C2)C""",21,"""2BD09AE10BE769AD"""
+"""8A503BF4410A7A76_8224CA67ACD20E87_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(ON=C2)C3=CC=CO3""",21,"""2BD09AE10BE769AD"""
+"""2D6B474910EA4FCD_D13B00034BC16F66_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C3C(=CN=C2)C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""8C3D8E77FD0D1EB1_A480D8028B6DB135_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(C)C2=CC=CC=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""D8280307EF2B603B_77A83FD3EA8E88B5_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2=CC=C(C)C=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""4BB6B6CB8464F6D0_871D7F2496B80795_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2=C(F)C=CC=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""EBBAE72A7C978BAB_5B4FC0956C004075_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2=CC=C(F)C=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""023EAE1CD5666273_724D41C1267502B3_6039_UN""","""O(CCCC1C(NCC1)=O)CCC(C2=CC=C(C)C=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""944638F1C50C7F97_626B428820D80A80_6039_UN""","""O(CCCC1C(NCC1)=O)CCCOCC2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""9AE9E0FD655D9D4A_EE4927DE5C9F0367_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N2CC(C)OC(C2)C)=O""",21,"""2BD09AE10BE769AD"""
+"""DD10CA886D863EB4_1A65EC9FF7CE1BA4_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2=CC=CC(=C2)C)=O""",21,"""2BD09AE10BE769AD"""
+"""C35519A78EFBFC0C_8CE210D8CC1A9908_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(SC(C)C)C=C2""",21,"""2BD09AE10BE769AD"""
+"""FBBFB941C6A870C4_61F35592E8B16B45_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=C(C=CC(=C2)F)F)=O""",21,"""2BD09AE10BE769AD"""
+"""C1B1B230439B6085_429060AC9EBAAB49_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NN=C([N]2C)C3CCC3""",21,"""2BD09AE10BE769AD"""
+"""99E40E57E2916057_FDB54428D45B522B_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2=C(C)C=CC=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""F724DAE275CF1E34_0D73E7858721410D_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(C(C)C)C(=O)O)=O""",21,"""2BD09AE10BE769AD"""
+"""922300664FFE96AD_EFAA0C7BE545BCF5_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=NC2=C(C)C=CN=C2[NH]3""",21,"""2BD09AE10BE769AD"""
+"""886F0B814A65E4B3_F4F21E9F2D97C1D7_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(N=C(C)S2)C(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""B817B234DA5F248E_CAF779EBE4AF3B18_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)[NH]C(=N3)C""",21,"""2BD09AE10BE769AD"""
+"""EA8F86BF9E0EC336_1D6681A649B1F76F_6039_UN""","""O(CCCC1C(NCC1)=O)CC[N]2C=C(C(OC)=O)N=N2""",21,"""2BD09AE10BE769AD"""
+"""28B9A8DEDBE9921A_A5D96DA3B906DDDF_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2=CC=CC(=C2)F)=O""",21,"""2BD09AE10BE769AD"""
+"""BDF8B443E10C6915_C749BA4AF28D0E2E_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC=CC(=C2)OC)=O""",21,"""2BD09AE10BE769AD"""
+"""D63C33EE07FA3587_19887726F49AA9F3_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2CCCCC2C)=O""",21,"""2BD09AE10BE769AD"""
+"""EED9B2C63DB8D966_7794EABFB12B8E51_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)N=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""44C12DEEC29197AE_6F2AB31C7C5A826E_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N2C(CCCC2C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""E541F47F5D1410C7_B44AB94164D8C5D9_6039_UN""","""O(CCCC1C(NCC1)=O)CCC3COC2(CCCC2)O3""",21,"""2BD09AE10BE769AD"""
+"""077109898AA004BA_8E755680DB226BD0_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C([N](=O)=O)C=C2)F""",21,"""2BD09AE10BE769AD"""
+"""6D836A654201158B_4448F8C0BC2B05B5_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(C(NC)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""B0178CE6A321AA7C_368CE3341857EFE3_6039_UN""","""O(CCCC1C(NCC1)=O)CC[N]2C(=CN=C2C)[N](=O)=O""",21,"""2BD09AE10BE769AD"""
+"""1496E0B6CF6734FE_BA07D17E8374D1F4_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC=CC(=C2OC)OC""",21,"""2BD09AE10BE769AD"""
+"""00D20E75FD3BC2CA_936C832BC7FC04E8_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C(OC)C(=C2)F)F""",21,"""2BD09AE10BE769AD"""
+"""BEA6B90C7CDB00F7_0AB24C1D6A63EE18_6039_UN""","""O(CCCC1C(NCC1)=O)CC3CCC2(CCCCC2)O3""",21,"""2BD09AE10BE769AD"""
+"""3F4C26BCB0AADF50_18DE13996239B555_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2CCC(F)(F)CC2)=O""",21,"""2BD09AE10BE769AD"""
+"""2742BDEE4BA88A06_ABD788940614D625_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC=C(C(F)(F)F)C=C2""",21,"""2BD09AE10BE769AD"""
+"""AC86F72C98FCCC59_728EFEBDD0D07E84_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C([Si](C)(C)C)C=C2""",21,"""2BD09AE10BE769AD"""
+"""399112C1F50083DB_751F5641EE3FD627_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NN=N[N]2CC(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""961D328460F8AAF6_3E9013354EA9EF17_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=N[N](CC(F)(F)F)N=N2""",21,"""2BD09AE10BE769AD"""
+"""E9C9ACB351DB128B_8C0B2B7513E983CB_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(C=C2)C3CCC3""",21,"""2BD09AE10BE769AD"""
+"""818D88D0D7CB1CE5_0472DC241D02D544_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NN=C3[N]2CCCCC3""",21,"""2BD09AE10BE769AD"""
+"""5F76996C715ADCB0_2902881A31E287E8_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=N2)C(OC)=O""",21,"""2BD09AE10BE769AD"""
+"""E02025BDF63DB6E2_DA757AFB57E9C7F3_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C([S](N)(=O)=O)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""34F47B6A99EEF415_107ACF00AF77A4A0_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C(C(OCC)=O)(C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""D78F1B226829F803_67B1D84C44AE519A_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C([S](Cl)(=O)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""FCF745CC6F9B6396_9BFAA3029F18B0F4_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(N=C2)C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""6D8D0CAAE9952CCA_0FDDF70B121EED38_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C([S](C)(=O)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""D58B4DF58A7FB2C8_B713D5FE17654ECF_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C=CC=C2)[S](=O)(=O)Cl""",21,"""2BD09AE10BE769AD"""
+"""9E0666EC67D5E1B9_8718F2ACD18832A5_6039_UN""","""O(CCCC1C(NCC1)=O)CCCC2(CCOCC2)C#N""",21,"""2BD09AE10BE769AD"""
+"""B2E2D5012F374BEC_CE7D360ED8824581_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(OC)N=C(C=C2C)C""",21,"""2BD09AE10BE769AD"""
+"""7A819C602720EE0D_DC6E5305DD8A79BA_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=CC=C2)[S](=O)(=O)Cl""",21,"""2BD09AE10BE769AD"""
+"""9040D24FF209A321_53FD8F32903E4535_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(F)(F)F)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""EAB873F0BA1E4254_9B388B1AF4962FA3_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)COC2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""0AF68FFCDD0A595F_8F2E996C7C74D87B_6039_UN""","""O(CCCC1C(NCC1)=O)CCC(CC(OCC)=O)(C)C""",21,"""2BD09AE10BE769AD"""
+"""A73AF6233DE5D6A3_BF2530804DAE53AC_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(NC(C)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""10AD7C19783FE3D6_C7C4D256D075C55C_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=NC=C2)OC)=O""",21,"""2BD09AE10BE769AD"""
+"""7A819C602720EE0D_F591CEA0D81C1DD3_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)[S](Cl)(=O)=O""",21,"""2BD09AE10BE769AD"""
+"""9FECEE1550C18F09_8F155951F8ABC8A3_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C([S](F)(=O)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""46C8BED5633B1E61_0E4A8F44D763736D_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC=CC(=N2)OC)=O""",21,"""2BD09AE10BE769AD"""
+"""AFFB52270499B25E_0AC8C3ECEF727DA8_6039_UN""","""O(CCCC1C(NCC1)=O)CCN2C3=C(CC2)C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""1DAFB89E7E5D3C8F_D91431D7F726E913_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(N=C(C(C)C)C=C2)C""",21,"""2BD09AE10BE769AD"""
+"""F4A153AA25A9BE2B_DC8B9149216839FB_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=CS2)C(OCC)=O""",21,"""2BD09AE10BE769AD"""
+"""25AF5A1FCAC9EFD0_4262A93C527ECB18_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=N[N](CC(F)(F)F)C=C2""",21,"""2BD09AE10BE769AD"""
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+"""AF0A8821DE75ABE8_811356354B098A12_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C[N](CC(OC)=O)N=N2""",21,"""2BD09AE10BE769AD"""
+"""61893258BA9A01BF_8D524618A96BAA39_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N2CC(CC(C)C2)C)=O""",21,"""2BD09AE10BE769AD"""
+"""FA4FBAA474A0B9CD_A9BEA4090C7772DB_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N2CCCCC2CC)=O""",21,"""2BD09AE10BE769AD"""
+"""E3789FC5BFD4EB49_924011F0D66B9D4B_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=N[N]2C3CCCC3""",21,"""2BD09AE10BE769AD"""
+"""A3A45E8F50250481_D7BC8C2F1F419647_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=N[N]2CC(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""3D6480F7E25ADAE9_207A17B3F2DF60E4_6039_UN""","""O(CCCC1C(NCC1)=O)CC3COC2=C(C=CC=C2)O3""",21,"""2BD09AE10BE769AD"""
+"""21D9C2DE7D815301_480F25C34B940A26_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(C)CC2=CC=CO2)=O""",21,"""2BD09AE10BE769AD"""
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+"""7ACA0C3A37251A5C_B05166684AD45FDF_6039_UN""","""O(CCCC1C(NCC1)=O)CCC(NC2=NOC(=C2)C)=O""",21,"""2BD09AE10BE769AD"""
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+"""6AF1BB3820C42104_3CB5B3C4C05D1297_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC(=C2)C3=CC=CS3""",21,"""2BD09AE10BE769AD"""
+"""CC3B1C7567CDB012_C9AD46917FCEEFE3_6039_UN""","""O(CCCC1C(NCC1)=O)CC(OC)CC2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""0810EF5BAFFE9673_BD3404CE215A9E2A_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2=C(C=CC=C2)C#N""",21,"""2BD09AE10BE769AD"""
+"""EE3CEC925E4C3664_4514E9DB659C76CE_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(NCCCC)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""0308F69DC07C6C61_6801FF7A07588DD4_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=NC2=C(C=C(F)C=C2)O3""",21,"""2BD09AE10BE769AD"""
+"""9F5CD7E5F30B3848_1B3041C4FF927D14_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(ON=C2)C3=CC=CS3""",21,"""2BD09AE10BE769AD"""
+"""5545F6E21C5E40F9_2BED21A78DA33C61_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CSC(=N2)C[S](C)(=O)=O""",21,"""2BD09AE10BE769AD"""
+"""AD7D3134A930220A_34102E383BD4DB19_6039_UN""","""O(CCCC1C(NCC1)=O)CCC(CC)(CC)C(=O)OC""",21,"""2BD09AE10BE769AD"""
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+"""0221E4931D184691_947F7AACACB65E80_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=C(C=C(C)C=C2)C)=O""",21,"""2BD09AE10BE769AD"""
+"""1C1EBAF4EFE91FF6_4B52D5F89250EDE3_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C(N(C)C)C=C2)C""",21,"""2BD09AE10BE769AD"""
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+"""3A089E00B7303002_7D2867295BB46CE8_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=N[N]2C)C(OC)=O""",21,"""2BD09AE10BE769AD"""
+"""AFF63ED39AE60316_4022B8CA86FEC4DC_6039_UN""","""O(CCCC1C(NCC1)=O)CCOCC(C(F)(F)F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""3CE7BD13077F51E1_5669C03171BF5C23_6039_UN""","""O(CCCC1C(NCC1)=O)CCCC2=C(OC)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""4264C6E592E7DBB2_22FFC523F8A72276_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(OC)=O)C=CC=N2""",21,"""2BD09AE10BE769AD"""
+"""96735AED61AD8F80_BFFB153128029D94_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=CC(=N2)N(C)C)C""",21,"""2BD09AE10BE769AD"""
+"""BC9B554435F8E452_618CE155A588510D_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(C)CC2=CC=CS2)=O""",21,"""2BD09AE10BE769AD"""
+"""BE38FDC992C2F688_5AF59AE1BB5115C7_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)C(OCC)C""",21,"""2BD09AE10BE769AD"""
+"""E0DE34C1DE140E07_C49D8FD701662974_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)CC(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""25025770043F55E2_65141CC5D1B30969_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)C2=CC(=CC=C2)C#N""",21,"""2BD09AE10BE769AD"""
+"""1C784493E2672006_5344D9425C4B2B6C_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=N[N](C=C2)C3CCCC3""",21,"""2BD09AE10BE769AD"""
+"""A5BA17A2AA6078EC_0F04518B73EC959E_6039_UN""","""O(CCCC1C(NCC1)=O)CCCSCC2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""22ADD2A2DE0F43FA_FE820E6AC1AEB98A_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(OC(F)F)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""A915F8FBB106A4E6_CBBD1EB11CF89486_6039_UN""","""O(CCCC1C(NCC1)=O)CCCCOC2CCCCC2""",21,"""2BD09AE10BE769AD"""
+"""4F316894D3263646_47A17EF6E0A56FC1_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C(OC)C=C2)C#N""",21,"""2BD09AE10BE769AD"""
+"""3FEE21B3555814DD_7A9FEEB30B7D778E_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)NC(C)=O""",21,"""2BD09AE10BE769AD"""
+"""026DE7BA7244B7E1_52F3E7D3E224787B_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(OC(F)F)C=C2""",21,"""2BD09AE10BE769AD"""
+"""EF9B06AB11188FAA_670064DD3C80637C_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=NC=C[N]2C(C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""3706D8874BB7630A_D2C69634E1B8EC7B_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=N[N](C)C(=C2)C(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""52DBE57CBF28E5F6_A61EC7A1D1D1ED4E_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=N[N]2C)C(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""9F09D1A8750ADB09_2B673BB64C05BB6C_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC(CCCCC)C)=O""",21,"""2BD09AE10BE769AD"""
+"""9A967EEF3C9E0CD6_1AF3C6DC2A2DA8F8_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C=CC=C2)OC3CC3""",21,"""2BD09AE10BE769AD"""
+"""CB03A46BACA3FFAA_311CDBADE65656E0_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2=CC(=N[N]2C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""8BAF2B77724824FF_5EBA7ECE580BB380_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)CCC2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""B345800168E6174D_AD2F91AE5D8DD390_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=N[N](CC)N=C2C)=O""",21,"""2BD09AE10BE769AD"""
+"""8808E8E29E638165_F97B4C510E0BD204_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)CC(NC)=O""",21,"""2BD09AE10BE769AD"""
+"""2B473496283D2947_81BFC7CE7A44E007_6039_UN""","""O(CCCC1C(NCC1)=O)CC2CN2CC3=CC=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""E98F80BADD7212C5_4B70213FC5E55CB1_6039_UN""","""O(CCCC1C(NCC1)=O)CCO[S](C[S](C)(=O)=O)(=O)=O""",21,"""2BD09AE10BE769AD"""
+"""096091D90222979F_9706C98598C88809_6039_DP""","""O(CCCC1C(NCC1)=O)CC3=CC2=C(CCNC2)C=C3""",21,"""2BD09AE10BE769AD"""
+"""FF54FA1ACE72885A_759CB4F38936AF3D_6039_DP""","""O(CCCC1C(NCC1)=O)CC(N[C@@H](C(C)C)C(=O)O)=O""",21,"""2BD09AE10BE769AD"""
+"""60CCA626261311DE_FB408377EDBC450C_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)C(OCC)=O""",21,"""2BD09AE10BE769AD"""
+"""51F9B78C9660171E_59FD5A04D0413EA4_6039_DP""","""O(CCCC1C(NCC1)=O)CC(N[C@H](C(C)C)C(=O)O)=O""",21,"""2BD09AE10BE769AD"""
+"""CE0DD146224F461B_76A86041FFE8FDE0_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CN=C(C(F)(F)F)N=C2""",21,"""2BD09AE10BE769AD"""
+"""CC56DF064F19165F_71F993DB83535AFC_6039_UN""","""O(CCCC1C(NCC1)=O)CCC3=NC2=C(C=CC=C2)[NH]3""",21,"""2BD09AE10BE769AD"""
+"""E6A27D411448B9D3_B4A1D89B5DC8855D_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)C(C)(C)C""",21,"""2BD09AE10BE769AD"""
+"""27C1E3410455404A_576CFFDF4B91F4C3_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC=CC(=C2)OC(C)C""",21,"""2BD09AE10BE769AD"""
+"""DCC701F735DC93A1_F229FC14098F59DB_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C=C(C(O)=O)C=C2)F""",21,"""2BD09AE10BE769AD"""
+"""7E1A634F13951BFA_E9AA25CAD199D4AB_6039_UN""","""O(CCCC1C(NCC1)=O)CCCN(C)C2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""8552F717FA7D1C1F_73E5213462B1B441_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(F)C=C(C(=C2)F)C#N""",21,"""2BD09AE10BE769AD"""
+"""DEBF83C7E97A8D31_3FCBC85793060A7D_6039_UN""","""O(CCCC1C(NCC1)=O)CCSC2=CC=CC(=C2)OC""",21,"""2BD09AE10BE769AD"""
+"""41C02003C89A20B6_ECF7E0CF3C862D47_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2=NSC3=C2C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""B4237891BDAE920E_D14EC89DE627DCBA_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2=NOC3=C2C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""F7553B9624F13003_62A0D6E1BFDC185C_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC3=C(N=C2)C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""05EA44F019C5BCE5_22FB01AE04BA69C1_6039_UN""","""O(CCCC1C(NCC1)=O)CCO[P](OCC)(=O)OCC""",21,"""2BD09AE10BE769AD"""
+"""6545B926B05965D4_510180B5CA88C0DB_6039_UN""","""O(CCCC1C(NCC1)=O)CCSC2=C(C=C(F)C=C2)F""",21,"""2BD09AE10BE769AD"""
+"""2D5F413338AF8B1A_8EED8DE91CD5C52D_6039_UN""","""O(CCCC1C(NCC1)=O)CCCOCCOCCOC""",21,"""2BD09AE10BE769AD"""
+"""2353D2CA50F32336_0BA58A37740DE44F_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C([N](=O)=O)C=C(C=C2)F""",21,"""2BD09AE10BE769AD"""
+"""A01737A93A4D6260_D511F1DCD03BAC2A_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2=N[N](C(C)(C)C)N=N2""",21,"""2BD09AE10BE769AD"""
+"""79DBBCF91B08E69F_DE5836135A7CB50D_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2CCC3=C2C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""25B422BDC564E766_9252C295BAA9E784_6039_UN""","""O(CCCC1C(NCC1)=O)CCCC(CC(OCC)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""1D5E4FB5F91CF7AC_E61D417C710D1404_6039_DP""","""O(CCCC1C(NCC1)=O)CC2=CC=CC3=C2CCNC3""",21,"""2BD09AE10BE769AD"""
+"""719483CE35CE5D6D_46BCD75EF6191203_6039_UN""","""O(CCCC1C(NCC1)=O)CC(OC)C2=CC=C(C=C2)F""",21,"""2BD09AE10BE769AD"""
+"""FD3C234039D5733E_560F4C9CC818869A_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=NC2=C(C=CC(=C2)C)S3""",21,"""2BD09AE10BE769AD"""
+"""8C2FD6C2FD935532_08FFF6EF9EDD85D6_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(F)(F)F)N=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""AD3C8670326A78A3_4471D88CD830796D_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(CC)CC(F)(F)F)=O""",21,"""2BD09AE10BE769AD"""
+"""96DAE025696C1E19_51B761DC2D6CC842_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2=C(C)C=CC=N2)=O""",21,"""2BD09AE10BE769AD"""
+"""AD6E97B535CEED9D_F2E90F7480983EEF_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2F)[N](=O)=O""",21,"""2BD09AE10BE769AD"""
+"""6DF7067FB20BD20A_3F7ED404D1B781D4_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=NO2)C(OCC)=O""",21,"""2BD09AE10BE769AD"""
+"""62CC0A02A1A71759_F958A4F0C456C99E_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)C=CN=C3""",21,"""2BD09AE10BE769AD"""
+"""A49ABA0BA8B7E48C_23ED934880582B9C_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=C2CCOCC2=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""70160C550717852E_8226BDA0CD2A6986_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NC2CCN(C)CC2)=O""",21,"""2BD09AE10BE769AD"""
+"""4624B709CAA9E4E5_CD34E0A3FAC86FFD_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C(C)C=C2)[N](=O)=O""",21,"""2BD09AE10BE769AD"""
+"""EE3EA16837063D33_418911B85F437B23_6039_UN""","""O(CCCC1C(NCC1)=O)CC2CC3(CO2)CCCCC3""",21,"""2BD09AE10BE769AD"""
+"""E893951C4944CBB7_CAE4CCFCB17AD5D4_6039_UN""","""O(CCCC1C(NCC1)=O)CC2CC3(CO2)CCOCC3""",21,"""2BD09AE10BE769AD"""
+"""43FD133163838E70_4AAF7FE8C8C1E1D2_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)N=CC=N3""",21,"""2BD09AE10BE769AD"""
+"""13728E8A460AEBD1_FEF10D85D6EF3F85_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CN=C(C(OCC)=O)S2""",21,"""2BD09AE10BE769AD"""
+"""E05E66A2A7221F27_6AF753105AB16C3E_6039_UN""","""O(CCCC1C(NCC1)=O)CC3CCC2(CCOCC2)O3""",21,"""2BD09AE10BE769AD"""
+"""20C33523ABF42F9D_27F0A2FC15B459C2_6039_DP""","""O(CCCC1C(NCC1)=O)CC3OCC2(CCNCC2)C3""",21,"""2BD09AE10BE769AD"""
+"""BC62913C9BE9F6B7_C4D99D3232AD170F_6039_UN""","""O(CCCC1C(NCC1)=O)CC3COC2(CCCCC2)O3""",21,"""2BD09AE10BE769AD"""
+"""87AC0135C0A5C3B9_8A78D7011BBA875E_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N2CC(C)(C)OCC2)=O""",21,"""2BD09AE10BE769AD"""
+"""5D9D3ED7060B2C09_30CB54FF2627C068_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC=C(OC)C=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""748243BADEE3FE81_01F82ECF899F210F_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)N2CC3CCC(C2)O3""",21,"""2BD09AE10BE769AD"""
+"""2F534D17D7F0C8C7_1A6B1064F20AAD1B_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC=C(F)C=C2)(F)F""",21,"""2BD09AE10BE769AD"""
+"""D7BDFFD82C6BD0CD_345D0F33FB995B8E_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NC2CCCCCC2""",21,"""2BD09AE10BE769AD"""
+"""DC20812E6FCDBE10_6FF4000621CC7080_6039_UN""","""O(CCCC1C(NCC1)=O)CCCOC2=CC=C(F)C=C2""",21,"""2BD09AE10BE769AD"""
+"""469FE2DBAEE8DA77_9EABDC6310689323_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC(=O)C2=CC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""ABA620F4A8F7D9C1_D30ADD5E1C6EE45F_6039_UN""","""O(CCCC1C(NCC1)=O)CCC[S](NC(C)(C)C)(=O)=O""",21,"""2BD09AE10BE769AD"""
+"""83A782FBC39BD83F_7540356CCD890491_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=C(OC)C=CC=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""519B8556E991993C_19251B8C25FD081E_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)C(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""1E698BB027387B3D_B943C93A8333ECAF_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(F)C=C(C(=C2)C#N)F""",21,"""2BD09AE10BE769AD"""
+"""7573656007E02AF8_FF614126B931125C_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(CC(C)C)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""1327326F4FC3BC87_033068CB35628539_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NCC2CCCCC2""",21,"""2BD09AE10BE769AD"""
+"""AE63CD86DFDFB8B7_5329960E2901E936_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(C)C2CCCCC2)=O""",21,"""2BD09AE10BE769AD"""
+"""C77E84C84074225C_36F4A0BA70FD8095_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)COC(C)C""",21,"""2BD09AE10BE769AD"""
+"""0007398CF94E769D_6ABE8EEB543FB7F0_6039_UN""","""O(CCCC1C(NCC1)=O)CC3COC2(CCOCC2)O3""",21,"""2BD09AE10BE769AD"""
+"""03A1CEB35E661AFA_0E1976C2D8851271_6039_UN""","""O(CCCC1C(NCC1)=O)CC2CCCC(C(F)(F)F)O2""",21,"""2BD09AE10BE769AD"""
+"""DC05E83E8E0BE1D7_FA0E6EBE3330B68A_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NSC(=N2)C(OCC)=O""",21,"""2BD09AE10BE769AD"""
+"""D2D20098A74FA8A1_9E6650CF3C4342F9_6039_UN""","""O(CCCC1C(NCC1)=O)CCCCCCCCCCC""",21,"""2BD09AE10BE769AD"""
+"""519B3E34599CF13D_A433F3FF1601E018_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NN=C3C(=O)NC=C[N]23""",21,"""2BD09AE10BE769AD"""
+"""D436C37E4A50E789_29B7E7509B403569_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=C(S2)C(C)(C)C)C""",21,"""2BD09AE10BE769AD"""
+"""D1E250152A3BF638_DB8E3D53699D8298_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)C=NC=C3""",21,"""2BD09AE10BE769AD"""
+"""E353B23D9009DF9E_66856343664763FB_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C)C=C(C=C2C)C#N""",21,"""2BD09AE10BE769AD"""
+"""FFDFF07BE1FEEE33_C6D8F324E07B4E5F_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CN=CC(=C2)C(OC)=O""",21,"""2BD09AE10BE769AD"""
+"""94486CDE0483F727_BFD9C67FA3F7790B_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)[S](F)(=O)=O""",21,"""2BD09AE10BE769AD"""
+"""7CC0213E091CEDD7_4283E5B88450A33B_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(CC(C)=O)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""CDEE6B896805BD56_24B721D5E6B49086_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=NN=C2C3CC3)C""",21,"""2BD09AE10BE769AD"""
+"""CEDA343C851761C6_3B28CC483BE8E044_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=N2)C(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""1639F60C42EE0A17_0DC17568DEF8AF43_6039_UN""","""O(CCCC1C(NCC1)=O)CCCN2CCC(F)(CC2)F""",21,"""2BD09AE10BE769AD"""
+"""E4163060CC9D0DFF_0530B178089C3105_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C)C=CC(=C2)[N](=O)=O""",21,"""2BD09AE10BE769AD"""
+"""CB77B97BE7A11809_FA8EFA69ECC5CA50_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C=CC(=C2)C(O)=O)F""",21,"""2BD09AE10BE769AD"""
+"""DA35317F671975CB_5379098DB3F0AFB1_6039_UN""","""O(CCCC1C(NCC1)=O)CCNC(=O)C2CCOCC2""",21,"""2BD09AE10BE769AD"""
+"""7E37322BCAF4AF5F_FC5AA6F414B79117_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC=CC(=C2)C(OC)=O""",21,"""2BD09AE10BE769AD"""
+"""8EA5CCA0648CD9A3_3A786DAA6A9078FC_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)COCC3""",21,"""2BD09AE10BE769AD"""
+"""959BD816E51252B6_A18D028C7C166D2E_6039_UN""","""O(CCCC1C(NCC1)=O)CCOC2CC[S](=O)(=O)CC2""",21,"""2BD09AE10BE769AD"""
+"""48FB9943A2C4B54B_FB62302313336705_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NSC3=C2C=CC(=C3)F""",21,"""2BD09AE10BE769AD"""
+"""A3140457B3FC6160_57A294E3CC2FF9FA_6039_UN""","""O(CCCC1C(NCC1)=O)CCCNC(C(CC)CC)=O""",21,"""2BD09AE10BE769AD"""
+"""342EDF00777E1A87_661E1628A45B30F9_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(F)C=C(C=C2F)C#N""",21,"""2BD09AE10BE769AD"""
+"""083C6A04B4966F79_8763AB297C9192C4_6039_UN""","""O(CCCC1C(NCC1)=O)CC2(F)OC(=O)CC23CCC3""",21,"""2BD09AE10BE769AD"""
+"""20BF61D7968695D1_AEF4E46EAC172F02_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C([N](C)N=N2)C(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""5D35E1B493F10307_10F21D1F774D52CD_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C[N](C)N=C2C(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""42621AC16DE841BA_46A0E198BE2C526E_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C(OCC)C=C2)F""",21,"""2BD09AE10BE769AD"""
+"""979865BAF3BD1EDE_A0FF1FF7E32D63BF_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=NC2=C(F)C=CC=C2O3""",21,"""2BD09AE10BE769AD"""
+"""D089742D4140B64B_517643F76D04CE03_6039_DP""","""O(CCCC1C(NCC1)=O)CC2OCCC23CCNCC3""",21,"""2BD09AE10BE769AD"""
+"""8C72D5D291D392D2_B966753281C087A3_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C([S](N)(=O)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""F51C2A27BE320BCC_C1FB3890108F1108_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC=C([N](=O)=O)O2)=O""",21,"""2BD09AE10BE769AD"""
+"""32F3AE21726251CB_5A0AA9BC27419F21_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C([S](C)(=O)=O)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""90C7AD80CB35B7FF_4326544D57C50A1A_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC(=NO2)C(OC)(C)C""",21,"""2BD09AE10BE769AD"""
+"""FA78E43E2A3785D7_E51268744EA1FDDE_6039_UN""","""O(CCCC1C(NCC1)=O)CC(NCCCOC(C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""8A6B0D5B82E824EB_5F0BDEBDFEA86EAF_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NCCC3=C2C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""FC01BAB2DA14F645_AB557FA01B834092_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(SC(F)F)C=C2""",21,"""2BD09AE10BE769AD"""
+"""C4F4D7721057E603_138C4DC4F96E059D_6039_UN""","""O(CCCC1C(NCC1)=O)CCC(=O)NC2=NC=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""5BDB1FD1D74A1DA5_198A9B39E6DA5E40_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C)OC(=C2)C(OC)=O""",21,"""2BD09AE10BE769AD"""
+"""D78F1B226829F803_A336F12D603EA20A_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(C=C2)[S](=O)(=O)Cl""",21,"""2BD09AE10BE769AD"""
+"""9E5A1403CCA60910_584248007D730906_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2[N](=O)=O)C""",21,"""2BD09AE10BE769AD"""
+"""14E45B02B8CDC691_ACBA47FAF6339558_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)C=CC=N3""",21,"""2BD09AE10BE769AD"""
+"""1D303DEE292B04E2_8CC4EF7754CA90EE_6039_UN""","""O(CCCC1C(NCC1)=O)CCCOC2=C(F)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""C1F21A580D6A4501_D29BD82E7AA978BD_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C=CC(=C2)[N](=O)=O)F""",21,"""2BD09AE10BE769AD"""
+"""2BE21E1FE98B197C_B7E5FB1428804D47_6039_UN""","""O(CCCC1C(NCC1)=O)CCCNC(CC(C)(C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""437C154C1832B34C_409EF56CE9310D93_6039_UN""","""O(CCCC1C(NCC1)=O)CCC(=O)N2CCCCCC2""",21,"""2BD09AE10BE769AD"""
+"""4227806108053BEE_A645AD3985A67C1B_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=NC2=C(CCCCC2)S3""",21,"""2BD09AE10BE769AD"""
+"""145D993240A6C105_F26F10F7B7068F97_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CN=CC(=C2)C(C)(C)C""",21,"""2BD09AE10BE769AD"""
+"""6FA2E0BF3E6CE64C_309EE38FD1947E85_6039_UN""","""O(CCCC1C(NCC1)=O)CC3CCCC2(CCOC2)O3""",21,"""2BD09AE10BE769AD"""
+"""0BD43522BD34718F_A379A04193B2C5C3_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(C)CC2=CSC=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""8F2EA9909BA08021_5DFF2D791D9E94AD_6039_UN""","""O(CCCC1C(NCC1)=O)CC2CCCC(F)(F)C(N2)=O""",21,"""2BD09AE10BE769AD"""
+"""69F9844D367B4417_F6312F6E82983905_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC(=N2)N3CCCC3""",21,"""2BD09AE10BE769AD"""
+"""9B3256A88427721F_4DDC7E7BD8052143_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C)OC=C2C(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""29B5D01CB6E364E0_C091506DD9D31931_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=CC2=C(CN(C)C2)C=C3""",21,"""2BD09AE10BE769AD"""
+"""283AD5184FFB4A80_02CB548A0CA58D62_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(OCC)=O)[NH]N=C2""",21,"""2BD09AE10BE769AD"""
+"""076557DB88331C20_9D0BC16A543FB913_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C(C)O2)[S](=O)(=O)C""",21,"""2BD09AE10BE769AD"""
+"""9CED4F2540607DBA_7980A674DA9F33E6_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC3=C2N=C(C)O3""",21,"""2BD09AE10BE769AD"""
+"""F452EBE417416EF0_E421519417266102_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC=CC(=C2)OC)F""",21,"""2BD09AE10BE769AD"""
+"""9F298DCCD893A2B6_70A5F1E5C6AF90FB_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NN=C3[N]2CCOCC3""",21,"""2BD09AE10BE769AD"""
+"""1B7F0C651A45AD15_FFAE1F8D234EF809_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC3=C(C=C2)CCOC3""",21,"""2BD09AE10BE769AD"""
+"""05B05B7BFD1D3E1F_AB3AD76E8A808680_6039_DP""","""O(CCCC1C(NCC1)=O)CC2(OC(CC23CNC3)=O)F""",21,"""2BD09AE10BE769AD"""
+"""09CC2E61E1FEB5AB_53CE1CC9C3FA4D7D_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=NC2=C(CC(C)CC2)S3""",21,"""2BD09AE10BE769AD"""
+"""807254CE37A80F0F_AEE6734D8912CA43_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC=C(SC)C=C2)=O""",21,"""2BD09AE10BE769AD"""
+"""9BF3EDCA3FBADD0B_7B69FE11BEB48B51_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CN=C(C(OC)=O)C=N2""",21,"""2BD09AE10BE769AD"""
+"""7E989DA22AF01053_C218275365ADE93D_6039_UN""","""O(CCCC1C(NCC1)=O)CCC(N2CCN(C)CC2)=O""",21,"""2BD09AE10BE769AD"""
+"""3390357FDA680E8E_1CF84AD48AA6F520_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(F)(F)F)C=CC=N2""",21,"""2BD09AE10BE769AD"""
+"""54D9EB42C73F08BF_4687678CDC67B55D_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(OCC)=O)SN=N2""",21,"""2BD09AE10BE769AD"""
+"""4ABA6EE7204774DD_585251B1D2C6AF32_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CN=C3[N]2C=C(F)C=C3""",21,"""2BD09AE10BE769AD"""
+"""D97B42F03178D04D_3FAD0EEF20C87826_6039_UN""","""O(CCCC1C(NCC1)=O)CCCC(=O)N2CCCCC2""",21,"""2BD09AE10BE769AD"""
+"""EA856B3042E67E47_7184F7C08D11F133_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(C)(C)C)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""0A1912CF363E2D50_F37EF67708FED078_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2=CC(=C(C(=C2)F)F)F""",21,"""2BD09AE10BE769AD"""
+"""F6790DF2D9CF8683_4202771555831F40_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC=CC(=C2)[S](F)(=O)=O""",21,"""2BD09AE10BE769AD"""
+"""260F11504ACF869A_1508FB6F5EB032C7_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CN=C(C(F)(F)F)C=C2""",21,"""2BD09AE10BE769AD"""
+"""C1893EB89175BE11_E71B2E8FF163F868_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=NC=C2)C(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""620EC7B2A00FAFA3_590DA34477F646F5_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)C2=CC=C(C=C2)C#C""",21,"""2BD09AE10BE769AD"""
+"""5A4E8BDD0B5BB52C_6968892BBE5BFAC1_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(OC(C)C)C=C2""",21,"""2BD09AE10BE769AD"""
+"""2A87B20563442D0E_D6DEA90EF2AABEDC_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C(C(O)=O)C=C2)F""",21,"""2BD09AE10BE769AD"""
+"""1C3F7947EDDD1D36_65ECE3EB4AE0B9E3_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(NC(C)=O)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""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"""
+"""54643E1A2F5BCC2D_D669348436B656C0_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC=C2C(OCC)=O""",21,"""2BD09AE10BE769AD"""
+"""EE37B5FCFD8197FB_75BC6B401E0EDFB6_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC(=C2)C(OCC)=O""",21,"""2BD09AE10BE769AD"""
+"""8A49DC6027B32266_B976C9B59030BCFB_6039_UN""","""O(CCCC1C(NCC1)=O)C[C@@H](C(C)(C)C)N[S](=O)(=O)C""",21,"""2BD09AE10BE769AD"""
+"""51E91FDAB9792718_06A579F3ED16F768_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)C2=CN=C3[N]2C=CS3""",21,"""2BD09AE10BE769AD"""
+"""49A1688DD41578C1_47F441324FB90A9E_6039_UN""","""O(CCCC1C(NCC1)=O)CCCOC2=CC(=O)CCC2""",21,"""2BD09AE10BE769AD"""
+"""A320EFE61B404E73_F68DA506AAA7DCBE_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)SCCC""",21,"""2BD09AE10BE769AD"""
+"""08DAE1FFBD4588F1_6CF818EA60347875_6039_UN""","""O(CCCC1C(NCC1)=O)CCCC2=C(F)C=CC=C2F""",21,"""2BD09AE10BE769AD"""
+"""67F0DBCFCC9009CF_A03AC751E932D955_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NOC(=C2)C3CCCC3""",21,"""2BD09AE10BE769AD"""
+"""BD2E84EAAF10A999_31E916AC63C3E64C_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=N2)C(C)(F)F""",21,"""2BD09AE10BE769AD"""
+"""0AAB9C0489B38181_BABAEEBF0E0469BE_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=CC(=CC(=C2)F)F)=O""",21,"""2BD09AE10BE769AD"""
+"""5BA140E57E1E751E_07803A07BC2E4D53_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=C(C(CC)C)C=C2""",21,"""2BD09AE10BE769AD"""
+"""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"""
+"""F70C95963E64DEB7_49F75ED7BCB3BCF1_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=N[N](C)C=C2[S](=O)(=O)Cl""",21,"""2BD09AE10BE769AD"""
+"""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"""
+"""CE90FC19A406F669_857A28F2CFECBCD0_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2(C(O)=O)CCOCC2""",21,"""2BD09AE10BE769AD"""
+"""1C8AE290D9237A05_DF619E9D185AEDA2_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C(OCC)=O)C=NO2""",21,"""2BD09AE10BE769AD"""
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+"""07C403BE2004D26D_1C1179F9FD28EA3E_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=NC(=N2)OC)OC""",21,"""2BD09AE10BE769AD"""
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+"""E3D9C79FC4FC1F54_857DE2FF8AED0CD4_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C([S](F)(=O)=O)C=CC=C2""",21,"""2BD09AE10BE769AD"""
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+"""C150D5DB8465315C_55333D1E30CE6F97_6039_UN""","""O(CCCC1C(NCC1)=O)CC3=C[N]2C=CC=C(F)C2=N3""",21,"""2BD09AE10BE769AD"""
+"""20D257ACC2373D36_002371D076B07C76_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NN=C(O2)C3=CC=CO3""",21,"""2BD09AE10BE769AD"""
+"""C4C85EE78E53BE79_68857F97097EC5F1_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)C2CC3=C2C=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""AE47DA26968A0880_4057AAEE124DAC3C_6039_UN""","""O(CCCC1C(NCC1)=O)CCN2CCN(CC2)C3CC3""",21,"""2BD09AE10BE769AD"""
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+"""0C714BB1DA2E2F4A_8BCB1FA9B51CEB5F_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2=C(C)[N](C(=C2)C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""FBE748B66D3AEC2A_467E6D5767671233_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(SC(F)F)C=CC=C2""",21,"""2BD09AE10BE769AD"""
+"""65A9C49B37AF9ECF_2EAC92A666B8BC77_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC(=C(O2)C)C(OC)=O""",21,"""2BD09AE10BE769AD"""
+"""1A281D9112995162_85BB6BC1A6B4AC2D_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2=CC=C([N](=O)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""21B707644E93AA17_E715889446D66565_6039_UN""","""O(CCCC1C(NCC1)=O)CCCCC(N[S](C)(=O)=O)=O""",21,"""2BD09AE10BE769AD"""
+"""FA0FC51D5970036F_12CD292467EABBC8_6039_UN""","""O(CCCC1C(NCC1)=O)CC(=O)NC(=O)C2=CC=C[NH]2""",21,"""2BD09AE10BE769AD"""
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+"""4B71B1BD769ED8C0_61D4F5DDA32F8A53_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CC=CC(=C2)OCCC""",21,"""2BD09AE10BE769AD"""
+"""2D1998993DDFE47C_52C9D75585210880_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C([N](=O)=O)C=CC=C2F""",21,"""2BD09AE10BE769AD"""
+"""1F23350EFACCDFAD_10D924BC36469E6B_6039_UN""","""O(CCCC1C(NCC1)=O)CCCN(CC)CC(F)(F)F""",21,"""2BD09AE10BE769AD"""
+"""EA718CF2CBCF47A5_60974189F84E02FE_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=CN=C(C(C)(C)C)N=C2""",21,"""2BD09AE10BE769AD"""
+"""519A46ACF299584F_68C9D8CC9FF1BDBC_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=NC=C(C(OC)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""86E4C28EABB2D8F3_0A03B98433263F1D_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N(C(CC(C)C)C)C)=O""",21,"""2BD09AE10BE769AD"""
+"""FF30F76BABD5B5E5_F92F5500A3140536_6039_UN""","""O(CCCC1C(NCC1)=O)CC(N2CC(CC)OCC2)=O""",21,"""2BD09AE10BE769AD"""
+"""67FBCE379640AF50_17470701A1F57BF6_6039_UN""","""O(CCCC1C(NCC1)=O)CCC2=CC=C(C(N)=O)C=C2""",21,"""2BD09AE10BE769AD"""
+"""896C5A285D7FD515_B45BBF29B4F44860_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C23CC(C)(C2)OCC3)=O""",21,"""2BD09AE10BE769AD"""
+"""4980CE72D6C73819_7A63689902AE441D_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C3C(=CC=C2)N=CC=C3""",21,"""2BD09AE10BE769AD"""
+"""48B30D15C55D4A28_90E9B9A4A6522DCE_6039_UN""","""O(CCCC1C(NCC1)=O)CC(C2CCC(C)(C)CC2)=O""",21,"""2BD09AE10BE769AD"""
+"""BE259CEB592F56EF_5DAA711E0C04D260_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C=C(C(N)=O)C=C2)F""",21,"""2BD09AE10BE769AD"""
+"""4206C1D755489AB3_7E4067E5D256E677_6039_UN""","""O(CCCC1C(NCC1)=O)CC2=C(C=N[N]2C)[S](=O)(=O)Cl""",21,"""2BD09AE10BE769AD"""
+"""A97C44DD43C558FB_7C1AE128B5B43861_6039_UN""","""CC(C)(OCC(NC1=C(SC(F)F)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""F18269EE9F0BDE48_67D50052C32C1DA6_6039_UN""","""CC(C)(OCC(=O)N(C1CC1)C2CC[S](=O)(=O)C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""2B4A9703BD5ECCD2_6109AFD3DD1D01F9_6039_UN""","""CC(C)(OCC(N1C(CC)C2=C(CC1)SC=C2)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""2C204D8AF4E5410E_D0DA98B796D7443F_6039_UN""","""CC(C)(OCC(N(C)C1=CC=C(C=C1)[N](=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""07A1B1F7AD729578_0642A590AF4F0C1C_6039_UN""","""CC(C)(OCC(N(CC)CC(=O)NC(C)(C)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""B24DC184457E08CB_0F31324850C7E206_6039_UN""","""CC(C)(OCC(N(CC1=C(OC)C=CC=C1)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""F95B1B0E85CB3B88_0E49677D12B6E5D5_6039_UN""","""CC(C)(OCC(NC1=C(C(=C(C#N)S1)C)C#N)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""EF1E5568D32B1C51_51BBFF1159C615F7_6039_UN""","""CC(C)(OCC(NC1=CC=CC(=C1)C(F)(F)F)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""8C33D2EB84F22232_946392319F6F16D5_6039_UN""","""CC(C)(OCC(OCCCCCCCCCC)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""23A2F713772E07AD_BBADBADFBE9DAB80_6039_UN""","""CC(C)(OCC(=O)NC23CC1CC(CC(C1)C2)C3)C(F)F""",21,"""EF6E251F992375CB"""
+"""9B65B9ABC54CBF63_DA93A6DA276C9E8E_6039_UN""","""CC(C)(OCC(NC1=C(C)C=C(C=C1)[N](=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""6D5EB301805C90DA_99CB47CBE9D64AA2_6039_UN""","""CC(C)(OCC(NC1=CC=CC(=C1)NC(C)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""B6773A5FFEC31FB0_BBB1F85045A303E4_6039_UN""","""CC(C)(OCC(NC2=NC1=C(C=C(C)C=C1)S2)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""82103F797FDF40F9_2400705D8B2C5F22_6039_UN""","""CC(C)(OCC(C1=CC=C(NC(CC)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""2C0508A3A708E188_D744238C2DAE1977_6039_UN""","""CC(C)(OCC(NC1=NN=C(CCCCC)S1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""3E408D04B7EB8A0F_69F1C05EF3530C60_6039_UN""","""CC(C)(OCC(NNC(C1=CC=CC(=C1)C)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""A7C231DE1E0AA440_AE643F5F2D988979_6039_UN""","""CC(C)(OCC(C1=C[NH]C2=C(CC)C=CC=C12)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""FCB06B27C7788751_8E6A38652095514A_6039_UN""","""CC(C)(OCC3=NC1=C(C2=C(S1)CCC2)C(=O)N3)C(F)F""",21,"""EF6E251F992375CB"""
+"""87EB909DAFF17C14_090731D7B29D1DFE_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC=C(OC)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""DD09E523DCC6AD63_60AE10655B1A6779_6039_UN""","""CC(C)(OCC2CN(CC1=CC=CC=C1)CCO2)C(F)F""",21,"""EF6E251F992375CB"""
+"""886C15842CF1510D_1EEE3DC624E87A16_6039_UN""","""CC(C)(OCC(C2=CC1=C(NC(C1C)=O)C=C2)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""63890B7D158115B8_D29A4AE88807DC14_6039_UN""","""CC(C)(OCC(NC1=CC=C([S](C)(=O)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""3341E7E1C2D30C4E_F5522998B751BEBF_6039_UN""","""CC(C)(OCC(C1=CC=C(CCNC(C)=O)S1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""1620E20AFD7F4EE3_FF77E3FC90ABED7C_6039_UN""","""CC(C)(OCC(NC1=CC=CC(=C1)[S](C)(=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""673284C6D491732C_008FEDC54D1E464C_6039_UN""","""CC(C)(OCC(NC1=C([S](C)(=O)=O)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""33CC8C5E28FE3329_C5C1E83E5B8534F1_6039_UN""","""CC(C)(OCC1=CSC(=N1)C2=CC=CC(=C2)OC)C(F)F""",21,"""EF6E251F992375CB"""
+"""23971E5311D4F41E_543E18702CEC8EC7_6039_UN""","""CC(C)(OCC1=CSC(=N1)C2=C(OC)C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""9DDBD64A7E97C7C1_D764E02D60CFBB31_6039_UN""","""CC(C)(OCC(C1=C(C=CC(=C1)C)OC(F)F)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""C4C30A83941D7292_C4BF6F6BB10E4424_6039_UN""","""CC(C)(OCC(NC(NC1CCCCC1C)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""07A773C45DB8F466_40D33240EB25BFE3_6039_UN""","""CC(C)(OCC(C1=C(C(=C(C)C(=C1C)C)C)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""38A9140B322F23A4_7839D241F96B217E_6039_UN""","""CC(C)(OCC2=CC=C([N]1N=C(C)C=C1C)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""47F5FD8F2F9EE57F_EAA53FEA170C551B_6039_UN""","""CC(C)(OCC1=CC(=CC2=C1OCOC2)[N](=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""CAFF45D0F7F9172F_DB095DB697212143_6039_UN""","""CC(C)(OCC1N[S](=O)(=O)N=C2CCCCCN12)C(F)F""",21,"""EF6E251F992375CB"""
+"""4447D8B63E920289_F8DFCF98ECEC7F4B_6039_UN""","""CC(C)(OCC1=CSC(=N1)NN=CC2=CC=CS2)C(F)F""",21,"""EF6E251F992375CB"""
+"""E4B4FC3D8576F390_16681B7253D7BC02_6039_UN""","""CC(C)(OCC1=C(C(OCC)=O)C(NC(N1)=O)C)C(F)F""",21,"""EF6E251F992375CB"""
+"""B6F23D9B52AED732_6B346663B5B2067F_6039_UN""","""CC(C)(OCC(NC1=C(C)C=CC(=C1)C(=O)O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""014689A80C040A8F_F48152219A1B6931_6039_UN""","""CC(C)(OCC(=O)NC(=O)NCC1=CC=CC=C1)C(F)F""",21,"""EF6E251F992375CB"""
+"""B00CEB7F06D7F696_42D4E88C92D92ECB_6039_UN""","""CC(C)(OCC(=O)C1=CN=C(S1)N2CCCCC2)C(F)F""",21,"""EF6E251F992375CB"""
+"""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"""
+"""AE9327628862D4B0_2AF9DAC2780CEA1A_6039_UN""","""CC(C)(OCC(NC1=CC=C(CC(O)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""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"""
+"""D14A32BCA0146522_B4453F88CA2D0C9E_6039_UN""","""CC(C)(OCCC(NC1=CC=CC(=C1)[N](=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""64C1731837940817_80A51E7FADF1E925_6039_UN""","""CC(C)(OCC(NC1CCCCC1C(F)(F)F)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""6D349679E87A9AAE_FD7C6F24B0B0A979_6039_UN""","""CC(C)(OCC(NNC(C1=CC=C(F)C=C1)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""5AFAE53DEFC1C725_717BF981DAA5A0D4_6039_UN""","""CC(C)(OCC(N1C(CC(CC1(C)C)=O)(C)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""CE37FADC514447FD_8CC8A40AE03E5265_6039_UN""","""CC(C)(OCCCC(=O)NC1=CC=C(C=C1)C#N)C(F)F""",21,"""EF6E251F992375CB"""
+"""C6D2BB93BDC6A628_A2DA61FC6F1E7B4A_6039_UN""","""CC(C)(OCCC(=O)NC1=CC2=C(C=C1)OCO2)C(F)F""",21,"""EF6E251F992375CB"""
+"""8654031DE1BE3A2D_6231E603F431A62C_6039_UN""","""CC(C)(OCC(N(CC)CC1=CC(=CC=C1)F)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""2C6975DA3DF7759E_C2EAE86F5182578E_6039_UN""","""CC(C)(OCC(NC1=C(C(O)=O)C=CC(=C1)F)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""00C7C02FBCB4B329_CCBDFE0B34791DB3_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC(=C(C)C=C2)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""D6098328E4B9EE34_8D64253A64D9C1B6_6039_UN""","""CC(C)(OCC(=O)NC1CCOC2=C1C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""419AD72A59E3B9B5_BF83C97E5458B86F_6039_UN""","""CC(C)(OCC(=O)C1=CC2=C(C=C1)NC(=O)CC2)C(F)F""",21,"""EF6E251F992375CB"""
+"""7A24A3308588E63B_97992894B8BB4605_6039_UN""","""CC(C)(OCC(NC(CCC)C1=CC=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""EF6CFF571F7C9AC1_265833D113157A7E_6039_UN""","""CC(C)(OCC(=O)NC(=O)NC1CC[S](=O)(=O)C1)C(F)F""",21,"""EF6E251F992375CB"""
+"""7D317B8E1905E587_352258FB4841E588_6039_UN""","""CC(C)(OCC(N(CC1=CC=C(SC)C=C1)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""E006766BA23E7D54_AE800AAB5B9B45FC_6039_UN""","""CC(C)(OCCCN2C(=O)C1=C(C=CC=C1)C2=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""4C45B139F59CF8D2_7517DBFB734F9DFA_6039_UN""","""CC(C)(OCC1=COC(=N1)C2=CC=C(OC)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
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+"""FBD49CB4584F7C1D_F96B54601431096F_6039_UN""","""CC(C)(OCCCCC[N]1C2=C(N=C1)C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""517C7D450EC1F2AB_3210E3DC5E14E1DA_6039_UN""","""CC(C)(OCC2=NC1=C(N(C(N(C)C1=O)=O)C)[NH]2)C(F)F""",21,"""EF6E251F992375CB"""
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+"""97C66DF0402158D1_28D16A9A483ECD5B_6039_UN""","""CC(C)(OCC(NC1=C(C)C=CC=C1[N](=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""A003562C5E77958F_F39ECC906D305835_6039_UN""","""CC(C)(OCC(=O)NCCCCC1=CC=CC=C1)C(F)F""",21,"""EF6E251F992375CB"""
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+"""579C225DA30A34F5_2210BC4A390CCEE4_6039_UN""","""CC(C)(OCC(NC(C)C1=C(C=C(C=C1)F)F)=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""3B39BE039BED24EC_53E0A50935A8498C_6039_UN""","""CC(C)(OCC1=CC=C(O1)[S](=O)(=O)N2CCCC2)C(F)F""",21,"""EF6E251F992375CB"""
+"""B428369E4142D438_9A78A02E4ED7FC1D_6039_UN""","""CC(C)(OCCC(NC1=C(C(N)=O)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""BC46632920DF38A5_8BAC4A2A8474D2FB_6039_UN""","""CC(C)(OCC(NCCOC1=CC=C(F)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""80324B1804E47F0D_EAC655DA472325EA_6039_UN""","""CC(C)(OCC(NCCOC1CCCCC1C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""AD2CD2467EA295E8_CBFF6A71076C0C7C_6039_UN""","""CC(C)(OCC(=O)NCC2CC1=C(C=CC=C1)O2)C(F)F""",21,"""EF6E251F992375CB"""
+"""E9CBA0C60DB1ED13_7FFEF8EF8E59F834_6039_UN""","""CC(C)(OCC(=O)NC1(CCC1)C2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""41702CD8B2E70DDE_B787040381F22EDF_6039_UN""","""CC(C)(OCC(N1CCC(C)C2CCCCC12)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""EF93339EC2564373_758CEEFF56875721_6039_UN""","""CC(C)(OCC(NC(C)C(=O)N1CCCCC1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""C9CA1A811F100FE5_98CE648708EC3BCB_6039_UN""","""CC(C)(OCC(=O)N1CCN(CC1)C(=O)C2CC2)C(F)F""",21,"""EF6E251F992375CB"""
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+"""21EF146D6E180483_CD5B5C4CE7DCAE72_6039_UN""","""CC(C)(OCC(NC1=C[N](CC(NC)=O)N=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""4C81F11E7D57DE1F_CA0AA615CB40E47A_6039_UN""","""CC(C)(OCCCC1=NN=N[N]1C2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""243DD2779C313656_36385CE6DED54DC2_6039_UN""","""CC(C)(OCC1=COC(=N1)C2=CC=C(C=C2)C#N)C(F)F""",21,"""EF6E251F992375CB"""
+"""16471778601B3090_122E5235D09991D7_6039_UN""","""CC(C)(OCC2=NC=C(C1=CC=C(OC)C=C1)O2)C(F)F""",21,"""EF6E251F992375CB"""
+"""421B96CBD6FC0959_8D4386375E879263_6039_UN""","""CC(C)(OCC(=O)C1=CC2=C(C=C1)OCC(=O)N2)C(F)F""",21,"""EF6E251F992375CB"""
+"""B27C0821AE979FE3_68596B922F39D452_6039_UN""","""CC(C)(OCC1=C(C=CC=C1)OC2=CN=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""A881A8743337364C_B571FDB560422D96_6039_UN""","""CC(C)(OCC1=NN=N[N]1C2=C(C=CC(=C2)C)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""C4C6F6DC1B2FA69D_C330D1D0E48DC7F3_6039_UN""","""CC(C)(OCC(C1=CC=C(N[S](C)(=O)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""4D9DAFD7F10B88EA_F6CB7D584F5EF4B7_6039_UN""","""CC(C)(OCC1=NC2=C(N(C)C1=O)C=CC(=C2)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""053C3A1AE0F4DE6B_71DD8F0C0F80B050_6039_UN""","""CC(C)(OCC(NC1=C([S](N)(=O)=O)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""C238210C6D959115_4F308BB757A8F388_6039_UN""","""CC(C)(OCC2=C[N]1C=CC=C(C(OC)=O)C1=N2)C(F)F""",21,"""EF6E251F992375CB"""
+"""0364D229F6A66F35_C83A326E653C2216_6039_UN""","""CC(C)(OCC1=CC=CC(=C1)C(NCC(C)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""0A9D29339BD0F9A1_397F8048021BCFF1_6039_UN""","""CC(C)(OCC(NC1=NN=C(CC(F)(F)F)O1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""3EA1555E80F6D037_AC1EA830AA529FFD_6039_UN""","""CC(C)(OCCCOC1=CC2=C(C=C1)C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""0649A30F39FC6CF3_9AEA8A625DD24512_6039_UN""","""CC(C)(OCCCOC1=CC=CC(=C1)C(C)(C)C)C(F)F""",21,"""EF6E251F992375CB"""
+"""1D0932B7D1A538B0_4AA9152EBEE88D30_6039_UN""","""CC(C)(OCC1=CSC(=N1)N(CCOC)C(=O)C)C(F)F""",21,"""EF6E251F992375CB"""
+"""8DA17F5E2C52D22C_DF92D3E86386BABF_6039_UN""","""CC(C)(OCC2ON=C(C1=C(F)C=CC=C1F)C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""00F92C1639B98954_4C3233BDD71946B0_6039_UN""","""CC(C)(OCC(C1=CC=C(OCC(N)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""2E7F06746A04E86E_AC1B77CF5CFF227F_6039_UN""","""CC(C)(OCCC(=O)NCC(=O)C1=CC=CC=C1)C(F)F""",21,"""EF6E251F992375CB"""
+"""AA622E6515039320_9659802F65835E5D_6039_UN""","""CC(C)(OCC(C[S](C1=CC=C(C)C=C1)(=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""B37BD53B063CD251_6E43BB57024272BA_6039_UN""","""CC(C)(OCC(C1=CC=C(CCC(N)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""4DD4EC8BA9B23377_185EA34EBF57D19E_6039_UN""","""CC(C)(OCCOC1=C(C=C(OC)C=C1)[N](=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""99A73F7F64436D01_0A81ACAAEF67ACF4_6039_UN""","""CC(C)(OCC1=NN=C(O1)C2=CC=C(C=C2)C#N)C(F)F""",21,"""EF6E251F992375CB"""
+"""5F12D8AB6B8BEBA2_4545616455E83142_6039_UN""","""CC(C)(OCC1=NN=C(O1)C2=CC(=CC=C2)C#N)C(F)F""",21,"""EF6E251F992375CB"""
+"""224DA8A3B2A42408_186FF0AF70D9A742_6039_UN""","""CC(C)(OCC2=NC=C(C1=CC=CC(=C1)OC)O2)C(F)F""",21,"""EF6E251F992375CB"""
+"""D56C7D9A9293E12F_3637584244F691B6_6039_UN""","""CC(C)(OCC(=O)C1=C[N](N=C1)C2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""0D1EE4CED349BE86_97F1938D31B8B47A_6039_UN""","""CC(C)(OCC2=NC=C(C1=C(OC)C=CC=C1)O2)C(F)F""",21,"""EF6E251F992375CB"""
+"""1074A09D8B6AEB06_B2D747DE93613D49_6039_UN""","""CC(C)(OCC1CC(=NO1)CCC2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""B90A02C2365127F5_BA6F2878CD24C8DE_6039_UN""","""CC(C)(OCC1=NC(=NO1)CC2=C(C)C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""32DB1CAF00183F50_7B3E322460903D9D_6039_UN""","""CC(C)(OCC1=NOC(=N1)CC2=C(C)C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""29EE4F42864DC0C4_D867BFB4D04647B9_6039_UN""","""CC(C)(OCC(NCC1=C(COC)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""E55476FBAC130CDA_D1C5A85498FC1AE9_6039_UN""","""CC(C)(OCC(C1=C(CC)C(=C([NH]1)C)C(=O)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""7398424F8A8EF1E0_7234B01FCC23C613_6039_UN""","""CC(C)(OCC(=O)NCCCOC1CCCCC1)C(F)F""",21,"""EF6E251F992375CB"""
+"""09C49526E275F037_9F6F87266F16E4C9_6039_UN""","""CC(C)(OCCCN1C(CSC1=CC(OC)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""C5F1EE0604A89B36_C9655DE53EBE6109_6039_UN""","""CC(C)(OCC2=NN=C(CC1=C(C)C=CC=C1)O2)C(F)F""",21,"""EF6E251F992375CB"""
+"""A9594D200726790A_F3269295EA68CDD5_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC(=C(F)C=C2)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""67DA90F923BF9156_FFD821AEF1AB4223_6039_UN""","""CC(C)(OCCCCN(C)CC1=CC=C(C=C1)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""57AB0B18454C00C5_ED430E5583B936C5_6039_UN""","""CC(C)(OCC2=NC1=C(C=CC(=C1)C(F)(F)F)O2)C(F)F""",21,"""EF6E251F992375CB"""
+"""C6FB1495832A1D62_7A00C74A1BEB58CF_6039_UN""","""CC(C)(OCC(NCC(C)(C)N1CCOCC1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""597BD9D945E89442_29496AD5AB232044_6039_UN""","""CC(C)(OCC1=COC(=N1)C2=C(F)C=CC=C2F)C(F)F""",21,"""EF6E251F992375CB"""
+"""ECD8788CA9A321CD_4B6CF54BBBDF1075_6039_UN""","""CC(C)(OCC(N(C(C)C1=CC=C(C=C1)F)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""9E60F31FABCA5030_031A749CBE357D4D_6039_UN""","""CC(C)(OCC(=O)NC(=O)OCC1=CC=CC=C1)C(F)F""",21,"""EF6E251F992375CB"""
+"""CE56371F9324E545_7D1EA4BFF67C65A6_6039_UN""","""CC(C)(OCC(=O)N1CC(=O)NC2=C1C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""E0890698D5F9121F_1F498A8865831860_6039_UN""","""CC(C)(OCC(N1CCCCC1C(OCC)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""EE3780932F587677_C2855A8B8E783448_6039_UN""","""CC(C)(OCC1=C(C=CC=C1)OC2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""F8D366FF9675FF1B_2BD94229B3A4BA91_6039_UN""","""CC(C)(OCC(NC(C)C1=CC(=C(C=C1)C)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""A52738D3C1152280_0E34EB978B41949C_6039_UN""","""CC(C)(OCC2=NN=C(C1=CC=C(OC)C=C1)O2)C(F)F""",21,"""EF6E251F992375CB"""
+"""87F82DCEAB33F6CF_4D60E3207C2D7638_6039_UN""","""CC(C)(OCC(N(C(C)C1CC1)CC(F)(F)F)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""45FEF440B2243670_C4AA099061F24747_6039_UN""","""CC(C)(OCC(N(CCC)C1CC[S](=O)(=O)C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""0690DDF9ED5FA36A_8A2BE35F3C5610AA_6039_UN""","""CC(C)(OCC(=O)NCCCSC1=CC=CC=C1)C(F)F""",21,"""EF6E251F992375CB"""
+"""3D02989C2E48D658_FE0087E25E073ACD_6039_UN""","""CC(C)(OCC(C1=C(C=C(NC(C)=O)C=C1)F)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""8AB4917BA7A83DFB_BD0FE5FC9F84BA01_6039_UN""","""CC(C)(OCC(=O)NC1=CC=N[N]1C2CCCC2)C(F)F""",21,"""EF6E251F992375CB"""
+"""D56E46502F635891_5BD2DCB582E691FC_6039_UN""","""CC(C)(OCC(NC(NC1=C(F)C=CC=C1)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""E0B91B82ECAE3E78_366A6671DDE10CE3_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC=C(CC)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""4907AC591DCBE664_00A688C0BE36AC3E_6039_UN""","""CC(C)(OCC1=CSC(=N1)COC2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""35B97562E247EBD4_39C0ADBE29051068_6039_UN""","""CC(C)(OCC1=C(OC(C)C)C=CC(=C1)[N](=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""4DA3F64DD516200B_793ED86A61FB8CEA_6039_UN""","""CC(C)(OCC1=C(C(OCC)=O)C(OC1(C)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""AD142B0457ADDEB9_F491F4E10951F9D0_6039_UN""","""CC(C)(OCC1=C(C(OC)=O)SC2=C1C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""364ABF5C2B024B96_28C873222F3D11A9_6039_UN""","""CC(C)(OCCOC1=CC2=C(C=C1)NC(=O)CC2)C(F)F""",21,"""EF6E251F992375CB"""
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+"""A409382F30B60D3E_5C1C6754027B4C61_6039_UN""","""CC(C)(OCC(=O)NC1=NN=C(O1)C2CCCO2)C(F)F""",21,"""EF6E251F992375CB"""
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+"""686BA0BA629A2422_7D9943B3B789B5E7_6039_UN""","""CC(C)(OCC1=C(C(OC)=O)OC2=C1C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
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+"""F590C359BC327ADC_A8CF6F4540FA53A7_6039_UN""","""CC(C)(OCC(=O)NC1=CC2=C(C=C1)NC(=O)N2)C(F)F""",21,"""EF6E251F992375CB"""
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+"""6FFC1D43877A42D7_32DC1715FCFB5495_6039_UN""","""CC(C)(OCCN2C(=O)C1=C(C=CC=C1)[S]2(=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""18B607C29420C550_359FA2D1F17B3D9E_6039_UN""","""CC(C)(OCCCC1=NC(=NO1)C2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""2DB83E681235DDAF_63DBB18C9B2383B8_6039_UN""","""CC(C)(OCC(=O)C1=NN=C(O1)C2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""05E1773C0DE0CEDB_45E9678ACB0D62DD_6039_UN""","""CC(C)(OCC(NC(C1=CC=C(OC)C=C1)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""8BFA8CC3C134E9A6_D305A6A36B7362D5_6039_UN""","""CC(C)(OCC(C2=CC1=C(N(C)C(=O)C1)C=C2)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""E2F16B9F54FEA84A_F9653D5A6F17A740_6039_UN""","""CC(C)(OCC(NCC1=CC=C(COC)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""2A8230FF91B58B85_0442EE77A9955724_6039_UN""","""CC(C)(OCC(NC1=CC(=N[N]1C(C)(C)C)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""6ECDEE6078C94723_D2C5556C3331361C_6039_UN""","""CC(C)(OCC(=O)NC1=NC(=CS1)C2=CC=CO2)C(F)F""",21,"""EF6E251F992375CB"""
+"""989C7CCF138E9A0B_33B74287D5637D4D_6039_UN""","""CC(C)(OCC#CC1=CC=C(OC(F)(F)F)C=C1)C(F)F""",21,"""EF6E251F992375CB"""
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+"""9A36959202C1D1D2_B3C05BEC2658200B_6039_UN""","""CC(C)(OCC2=NC1=C(C=CC(=C1)C(F)(F)F)S2)C(F)F""",21,"""EF6E251F992375CB"""
+"""FF50CAB9DDAE0F63_447F486B8D5292AE_6039_UN""","""CC(C)(OCCC(NCC(C1=C(C)N=CS1)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""756B24E0B2C75736_FCBCC46290170124_6039_UN""","""CC(C)(OCC1=NN=C(C=C1)OC2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
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+"""8DBF1FBA29EDDC5E_08D941930EBCF90A_6039_UN""","""CC(C)(OCCN1C2=C(OC(C)C1=O)C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""29CCBA164E05BAB5_B4636F089C006ED0_6039_UN""","""CC(C)(OCC(NC1=CC=C(C(OC)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""2529680A14EEDCCB_048E2F420616127F_6039_UN""","""CC(C)(OCC(=O)NC2=C1C=CC=CC1=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""B4B5FA3D6A119092_46AEA330C08F14EF_6039_UN""","""CC(C)(OCC(NC1=CC=C(C(CC)C)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""A4455A8DC1CBE0AA_1D70A97FD7D3F552_6039_UN""","""CC(C)(OCC(NC1=C(OC(F)F)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""F79504A90034D914_EBB7BE6BCF9D8406_6039_UN""","""CC(C)(OCC(NC1=CC=C([S](N)(=O)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""D1D4ADB13E6D5178_4D9C822664F4C22D_6039_UN""","""CC(C)(OCC(NC1=CC(=C(C=C1)F)[N](=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""059B969573D1BAE3_24569CF74BB3D0FB_6039_UN""","""CC(C)(OCC(NC1=C(C=CC(=C1)OC)OC)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""6C232491E605AFF3_386DA30F526CD686_6039_UN""","""CC(C)(OCC[S](C1=CC=C([N](=O)=O)C=C1)(=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""7077E867A0CB48A5_CE8C274D1DDC80FC_6039_UN""","""CC(C)(OCC(NC1=C(C(C)C)C=CC=C1C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""42E80F79ED170719_5739E62533CCF013_6039_UN""","""CC(C)(OCC(NC1=C(CC)C=CC=C1CC)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""FA16E1F69ADC4C17_383B8B181C8D9918_6039_UN""","""CC(C)(OCC(NC1=CC(=CC(=C1)OC)OC)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""C319AA1911589A12_BCB0118D0EA6DA3D_6039_UN""","""CC(C)(OCC(NC1=CC=C(C(C)(C)C)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""F6A6479E79853A92_B2D9F0230DDB74F3_6039_UN""","""CC(C)(OCC(=O)NCC1=CC2=C(C=C1)OCO2)C(F)F""",21,"""EF6E251F992375CB"""
+"""2604F7C7CBD03CE8_0F4020DA3FE74224_6039_UN""","""CC(C)(OCC1=NC(=CS1)C2=C(F)C=CC=C2F)C(F)F""",21,"""EF6E251F992375CB"""
+"""5CA29028F273B263_2329AC6638D43382_6039_UN""","""CC(C)(OCC2=NC1=CC(=C(C=C1[NH]2)OC)OC)C(F)F""",21,"""EF6E251F992375CB"""
+"""3F9EACFE60FC8B9C_313B007A56BA8032_6039_UN""","""CC(C)(OCC(NC1=CC=C(NC(C)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""5B8AD9A1E0E72930_65A935FBBC4C59DE_6039_UN""","""CC(C)(OCC(NC1=CC=C(C(F)(F)F)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""EFC709C0DEAD2D5C_70E097EFE48E650A_6039_UN""","""CC(C)(OCC(NC1=C(C=CC(=C1)[N](=O)=O)F)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""52A516C1C7F6EA73_C2058571B7A5D5AE_6039_UN""","""CC(C)(OCC(NC1=CC=CC(=C1)[S](N)(=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""A69A722FA3A890E9_FBC615C6832E1B4E_6039_UN""","""CC(C)(OCC1=NN=N[N]1C2=CC=C(OC)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""309CD51CBA5A0666_E02B149475A162C7_6039_UN""","""CC(C)(OCC(C1CCCN1C(C(F)(F)F)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""9CC159857EA2A7CE_0ED4A2F185EBC9B2_6039_UN""","""CC(C)(OCC(N(CCC(C)C)CCC(C)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""41A95F76D91A835D_F7217C3EC7B148FD_6039_UN""","""CC(C)(OCCC[S](C1=C(OC)C=CC=C1)(=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""B265569639AA25ED_36340042A5AEB0BA_6039_UN""","""CC(C)(OCC(C1=CC=C(C(OCC)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""CF35AE7D354C175E_1028D075E9374E75_6039_UN""","""CC(C)(OCCN([S](C)(=O)=O)CC1=CC=CC=C1)C(F)F""",21,"""EF6E251F992375CB"""
+"""4477EB6B3789CAD1_31AD65D038E101E3_6039_UN""","""CC(C)(OCC2=N[N](C1=C(C=C(F)C=C1)F)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""94A6A7B320417DD2_D123DF8C76509C66_6039_UN""","""CC(C)(OCC(=O)CC23CC1CC(CC(C1)C2)C3)C(F)F""",21,"""EF6E251F992375CB"""
+"""3ECAAAF0C860A64C_D2FF30148DDF95D9_6039_UN""","""CC(C)(OCC(N[S](C1=CC=C(C)C=C1)(=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""884C6C7889DE7354_3A18C32882200CF8_6039_UN""","""CC(C)(OCCC(=O)C1=CC2=C(C=C1)OCCO2)C(F)F""",21,"""EF6E251F992375CB"""
+"""B8663635283FBD58_C41530549D942354_6039_UN""","""CC(C)(OCC(CC1=CC=C(OC(C)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""86C206A362A778AE_7CDEF781D1505161_6039_UN""","""CC(C)(OCC(C1=CC=C(OCCCC)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""3823A890C4FF9118_71DA0ABEE0AD867C_6039_UN""","""CC(C)(OCCC2=C(C)N=C1C=CC=CN1C2=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""49CAE548E3A4BC9C_D1409335711C6E75_6039_UN""","""CC(C)(OCC(N1CCC(C(OCC)=O)CC1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""8BBD93CF465C2F3D_3883F20C23B75477_6039_UN""","""CC(C)(OCC1=NOC(=C1)C2=CC=CC(=C2)OC)C(F)F""",21,"""EF6E251F992375CB"""
+"""7A04DD6B7BEFF218_A720261F4A3658D5_6039_UN""","""CC(C)(OCC1=C(C=CC(=C1)[N](=O)=O)C(F)(F)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""5E2EB8C7A7045396_90AE97A4FF11F9ED_6039_UN""","""CC(C)(OCC(=O)NC1=CC2=C(C=C1)OCCO2)C(F)F""",21,"""EF6E251F992375CB"""
+"""4A1A419402CFD80E_EB7B79EFA3AAEF1D_6039_UN""","""CC(C)(OCC(NC1=C(C)C=CC=C1C(=O)O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""C0B84C03AAF79B55_066C1F350BB0A44D_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC(=NC=N2)OC)C(F)F""",21,"""EF6E251F992375CB"""
+"""84FD7E261D2E0739_1165C0EBF690CAD6_6039_UN""","""CC(C)(OCC(NC2=NC1=C(C=C(F)C=C1)S2)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""189DEFE95463694A_A8341FB1026B4ACD_6039_UN""","""CC(C)(OCC(NCCC1=C(OC)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""DB74404287D37D48_06C9F598BA13E9A0_6039_UN""","""CC(C)(OCCC(NC1=C(OCC)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""61394110FEC4B926_EC66ED5593857D52_6039_UN""","""CC(C)(OCC1=CC(=C(C=C1)N2CCCCC2)C)C(F)F""",21,"""EF6E251F992375CB"""
+"""8EBD30D1A85917EE_38209EA272C42615_6039_UN""","""CC(C)(OCC1=C(C=CC(=C1)OC)OC(F)(F)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""D926E789AA09A4FA_548654595FD98370_6039_UN""","""CC(C)(OCC1=CC=C(C=C1)C(=O)N2CCCC2)C(F)F""",21,"""EF6E251F992375CB"""
+"""53D95CCC3FC6C217_46119D4AA6B38E91_6039_UN""","""CC(C)(OCCNC(=O)NC1=CC(=CC=C1)C#N)C(F)F""",21,"""EF6E251F992375CB"""
+"""21F7E6571CE25DB6_5AEB614886370709_6039_UN""","""CC(C)(OCC1=NC(=NO1)CC2=CC=CC(=C2)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""3D726C43567AEFAA_D81BB4C6A89EED63_6039_UN""","""CC(C)(OCCC(=O)N2CCC1=C(C=CC=C1)C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""F4092B7209E8383F_16A7EAB6DD18DD6C_6039_UN""","""CC(C)(OCC(NC1=C(C)C=CC(=C1)[N](=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""B7CBEEA78F464236_EF985438B538C316_6039_UN""","""CC(C)(OCC2=N[N](C1=C(F)C=CC=C1F)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""BE7EE331BA4F834D_FA899669625A7041_6039_UN""","""CC(C)(OCC(=O)NC1=C(C=CC=C1)SCC=C)C(F)F""",21,"""EF6E251F992375CB"""
+"""62EA75717C645CE7_B9EB346AB649A96F_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=CC(=C(C=C2)F)C)C(F)F""",21,"""EF6E251F992375CB"""
+"""A12C59B3754A49D5_4D69FDB8889FE3AB_6039_UN""","""CC(C)(OCC2=NN=C(C1=C(OC)C=CC=C1)O2)C(F)F""",21,"""EF6E251F992375CB"""
+"""F8F8F671617AD454_03D5BF13258AB8B5_6039_UN""","""CC(C)(OCC(NC1=C(C(OC)=O)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""9A477AE4FAD5D1D2_B47A7D408859D291_6039_UN""","""CC(C)(OCCCOC1=CC=CC(=C1)C(F)(F)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""25CAE0A7669A2D09_60C1A0AC48C238D6_6039_UN""","""CC(C)(OCC(N(CC)CC1=CC(=CC=C1)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""30BDB9B6A4DC9B62_CD739B8A55EFD6D3_6039_UN""","""CC(C)(OCC1=NOC(=N1)C2=CC=C(OC)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""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"""
+"""F12E0523FCA63BB9_BF7DC25CD561F2C3_6039_UN""","""CC(C)(OCC(NC1CCC(C(F)(F)F)CC1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""CDD5F7515CABC193_164B841B3B9AD945_6039_UN""","""CC(C)(OCCON2C(=O)C1=C(C=CC=C1)C2=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""EFDC95ECDC6F2316_DE976983585FA415_6039_UN""","""CC(C)(OCC(NC1=C(C=C(C)C=C1)[N](=O)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""5B6448EBAEC74D65_4B64496C9B410A9E_6039_UN""","""CC(C)(OCC(NC1=C(C(C)(C)C)C=CC=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""B2645BEB467C3166_F3EBF17666BF42CC_6039_UN""","""CC(C)(OCC(C1=CC=C(CNC(C)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""CC0C40A0D2ABAE2E_08BCEF43FAF9E73B_6039_UN""","""CC(C)(OCC(NC1=CC=CC(=C1)C(OC)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""EA8C54FEA81B1582_E4D9ED6F09F183DE_6039_UN""","""CC(C)(OCC2=NN=C(C1=CC(=C(CC)S1)C)O2)C(F)F""",21,"""EF6E251F992375CB"""
+"""09C10128D404E47E_1D299288201A6B28_6039_UN""","""CC(C)(OCC(=O)N1CCC(=N1)C2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""D5AC8FBE02A96006_8042B3D6523415AA_6039_UN""","""CC(C)(OCC(NC(C1=C(OC)C=CC=C1)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""76859C826382ABAA_9AA4806C0BFF22C9_6039_UN""","""CC(C)(OCC(=O)NC1=C(C2=C(S1)CCC2)C#N)C(F)F""",21,"""EF6E251F992375CB"""
+"""E419A3F8BC7ED293_0A4B18C124B375F9_6039_UN""","""CC(C)(OCC1=COC(=N1)C2=CC(=C(F)C=C2)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""B2EF148D6E52FA40_5AD6BECF5AAC587D_6039_UN""","""CC(C)(OCC(NC1=C(C)C=C(C=C1)SC#N)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""62B0CBBB3644E048_1A1E0498D7775A81_6039_UN""","""CC(C)(OCC#CC1=C[N](N=C1)C2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""133200A0F46AE67F_B9B8F7F30830C8B2_6039_UN""","""CC(C)(OCC(N1CCN(C(OCC)=O)CC1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""94DD8B1B30936BA4_73BA7D1C8DE9EB97_6039_UN""","""CC(C)(OCCOC1=CC=C(OC(F)(F)F)C=C1)C(F)F""",21,"""EF6E251F992375CB"""
+"""BA02F362E64887B7_7DDD05CF798FEB6E_6039_UN""","""CC(C)(OCC1=CC=CC(=C1)[S](C(F)(F)F)(=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""C14F9928B5CCBB53_C7A206C553A72E38_6039_UN""","""CC(C)(OCC1=NC(=NO1)C2=NN=C(OC)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""3E23209160BA38C8_1332FF73D8FD810C_6039_UN""","""CC(C)(OCCC(NC(NCCC(F)(F)F)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""F5D97F2CC2435226_087E93C25856132D_6039_UN""","""CC(C)(OCCCNC(=O)OCC1=CC=CC=C1)C(F)F""",21,"""EF6E251F992375CB"""
+"""D10EAB0FEE97DD20_74EB536D48D71D72_6039_UN""","""CC(C)(OCCCC1=CC=CC(=C1)OC(F)(F)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""718C19200A01673B_EE0C9EA61CB15FB7_6039_UN""","""CC(C)(OCC1=C(C(OC)=O)C=CC=C1[N](=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""D6F2984D3D24A90D_F8383FD6D60E7532_6039_UN""","""CC(C)(OCC2=CC=C(C1(C(OC)=O)CC1)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""95FB8F12FDB98D38_4CF2773AECDD2CEF_6039_UN""","""CC(C)(OCC1=C2C(=C(C)N=C1)OC(OC2)(C)C)C(F)F""",21,"""EF6E251F992375CB"""
+"""62D08832A7C1BA5A_4E711B36553BB4F9_6039_UN""","""CC(C)(OCC2=N[N]1CCCCC1=C2C(OC)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""B3622A50EC0134E9_1C1014099B7A45EC_6039_UN""","""CC(C)(OCC(C(C1=CC=CC(=C1)OC)=O)(F)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""5C337D471994325B_282591B59AE5D1A1_6039_UN""","""CC(C)(OCC(C(C1=CC=C(OC)C=C1)=O)(F)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""C8DB88072734921A_BB041C746F7E3CBD_6039_UN""","""CC(C)(OCC1=COC(=N1)C2=CC=CC(=C2)OC)C(F)F""",21,"""EF6E251F992375CB"""
+"""6B275875723BDDFE_43149DACEC933166_6039_UN""","""CC(C)(OCC(NC1=C(C=C(OC)C=C1)OC)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""C9138641D65DF99A_9881C5EFBE56C37D_6039_UN""","""CC(C)(OCCC1=CC=C([S](N(C)C)(=O)=O)C=C1)C(F)F""",21,"""EF6E251F992375CB"""
+"""BFC29627AF1DC07F_E8E102BEEFF0A379_6039_UN""","""CC(C)(OCC(NC1=CC2=C(C=C1)[NH]C(=N2)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""778259BDE9C6C012_3E612377923278F3_6039_UN""","""CC(C)(OCC(C1=CC=C(C(F)(F)F)C=C1)(F)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""23656FBB95300283_CBBD764B5F258EAC_6039_UN""","""CC(C)(OCC2=NC=C(C1=CC=C(CC)C=C1)O2)C(F)F""",21,"""EF6E251F992375CB"""
+"""F37AABBC13C1736F_6817D982E735B814_6039_UN""","""CC(C)(OCC(NCC(C1=C(F)C=CC=C1)=O)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""6326C058A440E5F8_FD686F1DA412DB45_6039_UN""","""CC(C)(OCC1=C[N]2C(=N1)C=C(C(F)(F)F)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""FE15500ED56DF52E_728DE1365BC8F4C7_6039_UN""","""CC(C)(OCC(=O)NNC(=O)CC1=CC=CC=C1)C(F)F""",21,"""EF6E251F992375CB"""
+"""4F508086A1284C1C_8DD1F4601C702DA6_6039_UN""","""CC(C)(OCC2=CC1=C(C=C(C(OCC)=O)S1)S2)C(F)F""",21,"""EF6E251F992375CB"""
+"""9FB4D90B1536EB4A_F9A6CF43043D5782_6039_UN""","""CC(C)(OCC1=CC=C(C=C1)CC2=CC=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""4FD248D0F5529E1B_36B1F552823817FF_6039_UN""","""CC(C)(OCC(F)(F)C(=O)C1=CC=C(C=C1)C#N)C(F)F""",21,"""EF6E251F992375CB"""
+"""4A83448D00804743_735D3578C98CD8F4_6039_UN""","""CC(C)(OCC1=C(C)OC(=N1)C2=C(C=CC=C2)C)C(F)F""",21,"""EF6E251F992375CB"""
+"""1FCE576BFD2AACCA_3005AFAFFBEF9791_6039_UN""","""CC(C)(OCC1=C(C)OC(=N1)C2=CC=C(C=C2)F)C(F)F""",21,"""EF6E251F992375CB"""
+"""E711DDAA47DEE89A_D6E268EC01926B13_6039_UN""","""CC(C)(OCC(N1C2=C(C(C1C)C)C=CC=C2)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""4310D22808B2C242_8C380412D0928E9E_6039_UN""","""CC(C)(OCC1=CC(=C(C=C1)C)CCCCOC)C(F)F""",21,"""EF6E251F992375CB"""
+"""56B0DF4FC0CCAD5A_6D1C922C57CB973E_6039_UN""","""CC(C)(OCC(C1=CC=C([S](NC)(=O)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""86E9EC3D77BBBBE4_AE730843CEB6CD3B_6039_UN""","""CC(C)(OCC1=NOC(=N1)C2=CC(=CC=C2)C#N)C(F)F""",21,"""EF6E251F992375CB"""
+"""09AF68ABA90C0C46_B97385CA0ED245B7_6039_UN""","""CC(C)(OCC1=NOC(=N1)C2=CC=C(C=C2)C#N)C(F)F""",21,"""EF6E251F992375CB"""
+"""07F33C511408814E_DA7082D6F2FDEDD7_6039_UN""","""CC(C)(OCCC2=C(C)N=C1CCCCN1C2=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""986741D191A6C0EB_7FD1A76898890C2D_6039_UN""","""CC(C)(OCC1=NOC(=N1)C2=C(OC)C=CC=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""584F4D620BC59399_55D5F5B445373B58_6039_UN""","""CC(C)(OCC1=CSC(=N1)C2=CC=C(C=C2)C#N)C(F)F""",21,"""EF6E251F992375CB"""
+"""7B58712A300609D9_BFCB83C310E318D1_6039_UN""","""CC(C)(OCC1=NOC(=N1)C2=CC=CC(=C2)OC)C(F)F""",21,"""EF6E251F992375CB"""
+"""85045A49FEAEF948_9A75F2B100D24B20_6039_UN""","""CC(C)(OCC1=NC(=NO1)CC2=CC=C(F)C=C2)C(F)F""",21,"""EF6E251F992375CB"""
+"""501986E2CC2E9864_CEBD5AA060B3B04E_6039_UN""","""CC(C)(OCC(NC1=CC=C(SC(F)F)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""64D209A1F1B72A4D_466E0F41CD1EFBBE_6039_UN""","""CC(C)(OCC(NC1=CC=C(C(NC)=O)C=C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""FEA77A6ACF7345AB_21B04162ABA5C53A_6039_UN""","""CC(C)(OCC(N1CCCC(C(OCC)=O)C1)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""8DD1790F9491060A_CA45A7BB2F41835E_6039_UN""","""CC(C)(OCC(OC1CC(CCC1C(C)C)C)=O)C(F)F""",21,"""EF6E251F992375CB"""
+"""E53672C1D2717396_D549D58A71DF59DA_6039_UN""","""CC(C)(OCC(NC1=CC(=C(OC)C=C1)OC)=O)C(F)F""",21,"""EF6E251F992375CB"""
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+"""C34581BB72871148_2C36CBD838AE9609_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C(CC)C)=O""",21,"""FE60D7262686537D"""
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+"""E074F4D8C08CC8EA_61E81DD2E8FB7CB2_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=CN=CC=C3""",21,"""FE60D7262686537D"""
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+"""5F49BCE908DA2BA7_5F057E1E25633F70_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCCN(C)C""",21,"""FE60D7262686537D"""
+"""B728B513A8947CCF_7C07BF951E77AA5F_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=CN=C[N]3C""",21,"""FE60D7262686537D"""
+"""3E6DB8D536F666A0_8A5AA3480FC463F6_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(=O)CCC=C""",21,"""FE60D7262686537D"""
+"""6F62BFDD7C397157_726F07A05AE16596_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCOCCOC""",21,"""FE60D7262686537D"""
+"""C47630E0EDD68C78_1F6292D4879558A3_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=CC=N[N]3C""",21,"""FE60D7262686537D"""
+"""12C1347E2F59478B_9A08F9FDD0D3AC03_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NN=C(C)S3""",21,"""FE60D7262686537D"""
+"""B466C89D27221313_989B21D7DA4E5E35_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=C(C)OC=N3""",21,"""FE60D7262686537D"""
+"""E9055F35FB6B1F5C_25D851F000B945C7_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCSC(C)=O""",21,"""FE60D7262686537D"""
+"""225C4E6F269348CE_E0BCDBC7514D181C_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCSCC(C)C""",21,"""FE60D7262686537D"""
+"""E88863DE74772E44_E535D3B2356BA741_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=C[N](C)N=N3""",21,"""FE60D7262686537D"""
+"""768FFF134F09D998_5633B9BCB7A0B565_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(=C)[S](=O)(=O)Cl""",21,"""FE60D7262686537D"""
+"""7A06A778CDBDB612_85AA65B2B6B09FA6_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(=O)NC3CC3""",21,"""FE60D7262686537D"""
+"""E2B93FC368D1DF2E_1DD5B6D42AF0C88E_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCN3CCCC3""",21,"""FE60D7262686537D"""
+"""E0CD2D6DB2611EC0_3F8CA5315219BECC_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(NC(C)C)=O""",21,"""FE60D7262686537D"""
+"""ED88A147D2219CE5_D6D6D780063416CD_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCC(CC)=O""",21,"""FE60D7262686537D"""
+"""3D8E630094973A20_E46EADBF6D0EB0A8_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCCC(C)=O""",21,"""FE60D7262686537D"""
+"""3ACD15371EFB34C6_F4FE58CDE4A45B80_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NC=CC=C3""",21,"""FE60D7262686537D"""
+"""22DBA4C4FB0043CB_21AB8F1833A9F280_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NN=N[N]3C""",21,"""FE60D7262686537D"""
+"""DD23DF7AB19B8486_CF9BB7CDB8EFA895_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC([S](F)(=O)=O)=C""",21,"""FE60D7262686537D"""
+"""618B7056F9A60457_84440989A9D94412_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(N(CC)C)=O""",21,"""FE60D7262686537D"""
+"""942156F7441FAE03_9F3EC32E4983452A_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCN(CC)CC""",21,"""FE60D7262686537D"""
+"""E7A9227DDDD3B706_D0CEF82542B1CFF8_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=C(C)ON=C3""",21,"""FE60D7262686537D"""
+"""35F756BEF2406AEF_2424341E02E3225C_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3=C[NH]N=C3""",21,"""FE60D7262686537D"""
+"""DF744D6B4E4A9E5B_B14123D3BC74EF12_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCC(C)(C)C""",21,"""FE60D7262686537D"""
+"""D3A43B79A7F59BCC_A197F4933A751405_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3CCCO3""",21,"""FE60D7262686537D"""
+"""95130826EE1EBD38_F9F9FAFF98470D03_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C(O)=O)(F)F""",21,"""FE60D7262686537D"""
+"""578B4BFE341F09CD_B7C95ADC347FF5C1_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCOCC(F)F""",21,"""FE60D7262686537D"""
+"""8782DAC9FDB7E416_7B58455D2B134A30_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3CCC(C)O3""",21,"""FE60D7262686537D"""
+"""0439EDFEBFCAA522_5AD2BC76F50EE253_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C(C)(C)C)=O""",21,"""FE60D7262686537D"""
+"""6EB0AD48E67BC1ED_CBABBC589780C6CF_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=C[N](C)C=N3""",21,"""FE60D7262686537D"""
+"""58E68C3D924526FC_15C9B9A7E48D0495_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NC=CC=N3""",21,"""FE60D7262686537D"""
+"""FF7596D2AF4E9BA1_9D62E7BC34F6EC74_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(=O)CC3CC3""",21,"""FE60D7262686537D"""
+"""DE5AD62D2804009D_09D985F5D5945B12_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCCCC=C""",21,"""FE60D7262686537D"""
+"""ECFBAA8F510DC6C2_1984BED36D3CC0FE_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=N[N](C)N=N3""",21,"""FE60D7262686537D"""
+"""1D844A5AE206FD99_AD6517F1360DBC8F_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C3(C)CC3)=O""",21,"""FE60D7262686537D"""
+"""805A2192F4F6872D_034F647F4E265FFE_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3CNC(=O)O3""",21,"""FE60D7262686537D"""
+"""CBCE3878AEF74678_25C9ED9C92B64C0C_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCSC(C)(C)C""",21,"""FE60D7262686537D"""
+"""16AA760DFCC89A67_7D129F0DA1D2D06B_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCOC(C)C#N""",21,"""FE60D7262686537D"""
+"""249FFF71E5C0B7DB_47F2D7EB4EC4EB54_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3=CSC=N3""",21,"""FE60D7262686537D"""
+"""A41B24D9E9433622_B7B2B3B1CD0FB433_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=N[N](C)C=C3""",21,"""FE60D7262686537D"""
+"""4526D2E26F79542C_C84FCB4D72C66F46_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=CN=N[N]3C""",21,"""FE60D7262686537D"""
+"""E353E96CB3605A3E_9E2DC3EFCA970DD5_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCOC3CCC3""",21,"""FE60D7262686537D"""
+"""589684E1FBA30A86_44DB3D7F14CAEBC4_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=N[N](C)N=C3""",21,"""FE60D7262686537D"""
+"""F61A89B60F2D3400_D408D0191E5B1826_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC(OCC)=N""",21,"""FE60D7262686537D"""
+"""8151A314257F8453_E7D99B7955D9DEF7_6039_DP""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCCCCN""",21,"""FE60D7262686537D"""
+"""385D20BB7F110615_A6075D736686161B_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=C(C)N=CS3""",21,"""FE60D7262686537D"""
+"""57E9CE1F12D56E33_E5E8E0656F8658DB_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3=C[NH]N=N3""",21,"""FE60D7262686537D"""
+"""4B5D5862E169FA69_E0AF048A1AE98618_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCOCCC#N""",21,"""FE60D7262686537D"""
+"""FC77562416D06284_421209B056F42AEA_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=COC(=N3)C""",21,"""FE60D7262686537D"""
+"""3DD827C5444C9B2F_9A7876F649F21986_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(=O)NCC=C""",21,"""FE60D7262686537D"""
+"""6A2B20242445CF72_114100CE665CAD05_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=CON=C3C""",21,"""FE60D7262686537D"""
+"""2A17599F8EF0595C_C0257F78D6A42313_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=CN=CN=C3""",21,"""FE60D7262686537D"""
+"""C8AC2FF310CDE98D_6364BBE89B6FCF66_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(NCCC)=O""",21,"""FE60D7262686537D"""
+"""11D4597EE86F0577_BBB7704827515C7D_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC(=C(F)F)F""",21,"""FE60D7262686537D"""
+"""7BB819ADD0998928_D6EBC0067A00D153_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC[S](CC)(=O)=O""",21,"""FE60D7262686537D"""
+"""3E845A56E54EF1BD_B25D45BE6575B184_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NC=N[N]3C""",21,"""FE60D7262686537D"""
+"""C4124D269F462346_BE3CE38E3AA82B6C_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C=NO)=NO""",21,"""FE60D7262686537D"""
+"""19080B8BD9FC90C9_B71C1931F4CED03A_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3CCOC3""",21,"""FE60D7262686537D"""
+"""3D94F090A871A2A8_86ABDE1002119C66_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3N(C)CCC3""",21,"""FE60D7262686537D"""
+"""F40666EC8D3FFC5D_64D558AAC1E6955F_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3=CON=C3""",21,"""FE60D7262686537D"""
+"""6DF615C1585F0AA2_4B2349422B3548CE_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3CCC(=O)O3""",21,"""FE60D7262686537D"""
+"""0D05FE2D058EC0A0_7D5A679DE89850C6_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(COCC)=O""",21,"""FE60D7262686537D"""
+"""A4DFB316FB317A71_CFE6AF25BB019DCA_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NNC(=O)S3""",21,"""FE60D7262686537D"""
+"""00CA46AB10D0B442_DC9F58D061DC3495_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC(OC)(C)C""",21,"""FE60D7262686537D"""
+"""98004E35611C9ED0_76B6860BE241CCA9_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC=CCCC""",21,"""FE60D7262686537D"""
+"""AAB88400D2246857_3B20BCD53DBE2B21_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCOC(C)C""",21,"""FE60D7262686537D"""
+"""D8BF571176DC2D1D_DF2DF46CCF561B52_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3CCCC3""",21,"""FE60D7262686537D"""
+"""1DDDB1B813E6D093_22B9EA1B27F111C4_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3OCCO3""",21,"""FE60D7262686537D"""
+"""0C501AB2E958B1FB_83363D1C59075794_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCN(CC)C""",21,"""FE60D7262686537D"""
+"""12040CD50B2B1209_B541C629F4898265_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=CSC(=C3)C""",21,"""FE60D7262686537D"""
+"""5AD932697516A1B2_067143B3742CD72F_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3=CN=CS3""",21,"""FE60D7262686537D"""
+"""B85ED356B696C446_D3870C0AFC7C9FBC_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3=NN=N[NH]3""",21,"""FE60D7262686537D"""
+"""612A570DB9CDB9B3_FF899430321E2D6F_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NC=C(C)S3""",21,"""FE60D7262686537D"""
+"""97461FCD889AD0E2_2A30F911D68E9F44_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C(C)=O)=NO""",21,"""FE60D7262686537D"""
+"""51ADE279EEDEB979_EA93F675AFD2217E_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC(CC)(C)C""",21,"""FE60D7262686537D"""
+"""D10C83308145EF14_D6AA7CA195181A01_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3CC3(Cl)Cl""",21,"""FE60D7262686537D"""
+"""C16922DC11D70C52_C2F0C90143D532ED_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C)NC(=O)C""",21,"""FE60D7262686537D"""
+"""B78FB559DE2859C0_655F2ADA5F77C418_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(OC)C(C)C""",21,"""FE60D7262686537D"""
+"""61DC8601CCC981B2_8B22AAF9900AE6F7_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(OC)C3CC3""",21,"""FE60D7262686537D"""
+"""E8B5775BD8DD781E_A27D34A70AE8C4C0_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)C[C@@H]3N(C)CCC3""",21,"""FE60D7262686537D"""
+"""8777BC5D78662848_A5CAD060D87903AE_6039_DP""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(CC(O)=O)=O""",21,"""FE60D7262686537D"""
+"""FE5D8A30BBBBD05F_B4D1A78F882C9B4F_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC(OC)OC""",21,"""FE60D7262686537D"""
+"""A691EBEDCA2D0FCD_3900ACE1AA58421D_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCN(C)CC=C""",21,"""FE60D7262686537D"""
+"""9D6E0E4D1038DEDC_0D1328AB3F04BFA8_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)C[C@@H]3CCC(=O)N3""",21,"""FE60D7262686537D"""
+"""6D85D9E9E55C57BB_64905D8456B15517_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCC3CCC3""",21,"""FE60D7262686537D"""
+"""534CCEA2F2996264_C04B63A1A9131E88_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3SCCS3""",21,"""FE60D7262686537D"""
+"""BE7FEEC47E9B0ACB_739A526273079B26_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCCN=[N]#N""",21,"""FE60D7262686537D"""
+"""46527DB38FEB3903_428CA1CD26C51A42_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(COC)OC""",21,"""FE60D7262686537D"""
+"""8AA2F1CCF622868D_6B5F3062F429ABC5_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC(C)C(=O)C""",21,"""FE60D7262686537D"""
+"""2D4747C8083669E3_D78A395F7864EB62_6039_DP""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3OCCNC3""",21,"""FE60D7262686537D"""
+"""CA8AF775C6ED7A88_87455EBB747BBB3B_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=C[NH]C(=N3)C""",21,"""FE60D7262686537D"""
+"""3CE5A2FC6B4BFA1C_2E34810A37A82431_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCCCC#C""",21,"""FE60D7262686537D"""
+"""52BB9046ABD7B3FD_BE228D82D9AE2431_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=C(C)C=CS3""",21,"""FE60D7262686537D"""
+"""5988D36F2D90D016_C67DC9BC4EBBE6A2_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(CCCC)=O""",21,"""FE60D7262686537D"""
+"""BA51A1B5C678AC62_45E7449973D5099C_6039_DP""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(CC(C)C)N""",21,"""FE60D7262686537D"""
+"""A27576084C226968_367BDE2B49E97F82_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC[N]3C=NN=N3""",21,"""FE60D7262686537D"""
+"""1DEA7B039FD04B55_07037F282E2DDD65_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCSC(F)(F)F""",21,"""FE60D7262686537D"""
+"""97B323B79A96E25A_5733AB1A043EDF04_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=CC(=NS3)C""",21,"""FE60D7262686537D"""
+"""8F675512B168DA1B_75B2AD5D633B1B21_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=N[NH]C=C3C""",21,"""FE60D7262686537D"""
+"""E6DF6A9E8B0784F6_07136D67040105D8_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NOC=C3C""",21,"""FE60D7262686537D"""
+"""06563B7A5605B8E0_50F2915B87E244CC_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3ON=C(C)C3""",21,"""FE60D7262686537D"""
+"""2C7D8AA68AD2A976_B3493A24E1B5F555_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C(F)(F)F)=O""",21,"""FE60D7262686537D"""
+"""2C6B08148D2EBFAB_78AD1D7960057EEB_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCC(C)(F)F""",21,"""FE60D7262686537D"""
+"""567A69CC207DE204_1F4122384667303E_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C3CC3C)=O""",21,"""FE60D7262686537D"""
+"""15AC1B14CAAEB1F8_AA1C0C13D120E79D_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3=CC=NS3""",21,"""FE60D7262686537D"""
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+"""4D024370AE569258_FF03D780220CE312_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NC(=O)NN3""",21,"""FE60D7262686537D"""
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+"""679B06740DC21464_18B611C2CCC17142_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC(CC)(F)F""",21,"""FE60D7262686537D"""
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+"""5177EB03ECE05A8A_EB4A251AB3498CC8_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCCOC(F)F""",21,"""FE60D7262686537D"""
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+"""026693E888564DDC_BC20926AB7FF343D_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3(CC3)C#N""",21,"""FE60D7262686537D"""
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+"""710C0F067925C3F3_CFBDCEAA2D3E0659_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC=C(C)C(=O)O""",21,"""FE60D7262686537D"""
+"""FCAF5561761555C5_0A42E6F6682A6A73_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCOCC3CO3""",21,"""FE60D7262686537D"""
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+"""9BE360ADE84BBB99_BEA39B73E7691429_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NOC(C)C3""",21,"""FE60D7262686537D"""
+"""AC9094E31DF1D369_84C3F8145F4AFEFB_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NOC(=N3)O""",21,"""FE60D7262686537D"""
+"""07A49A1719258871_28D9E2F3F5DAF572_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NC=CN=C3""",21,"""FE60D7262686537D"""
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+"""B4EFEC23398BA4E2_F7402A97C6B98C52_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC[Si](Cl)(Cl)Cl""",21,"""FE60D7262686537D"""
+"""E09DF224FBC3913F_8BF0CD840634D2F7_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC#CCSC#N""",21,"""FE60D7262686537D"""
+"""D04684828FC76506_C2934DDF3EBC83D3_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC[N]3C=NC=N3""",21,"""FE60D7262686537D"""
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+"""CE5016697788D819_45AD0C638615062E_6039_DP""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C3CNC3)=O""",21,"""FE60D7262686537D"""
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+"""F5F8F604B9CCF5D3_8B4783268B71F4AA_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=C(C)N=NS3""",21,"""FE60D7262686537D"""
+"""80B25CF26992357B_844550E002FC70CE_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=NC(=N[NH]3)C""",21,"""FE60D7262686537D"""
+"""170F37A958529FBA_8F031DA4278F2BE5_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCOCC(C)C""",21,"""FE60D7262686537D"""
+"""D7489B97EF9B5691_559975999210E13A_6039_DP""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC3CCNC3""",21,"""FE60D7262686537D"""
+"""9F08F99F232DE51D_6AC97A236F254DDF_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=C(C)[NH]C=N3""",21,"""FE60D7262686537D"""
+"""6D81F198B611445E_25E63743F6DF9314_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCN(CC)C#N""",21,"""FE60D7262686537D"""
+"""3F6D21F55825D674_F6FDDA4E89D6E3D9_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CCC(=C(C)C)C""",21,"""FE60D7262686537D"""
+"""6BB431886C9A9DB3_7E7C6E06EFA93DE6_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC3=C(C)N=CO3""",21,"""FE60D7262686537D"""
+"""1B8967154304693A_E4CB753EEFD30342_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC[S](=O)(=O)C=C""",21,"""FE60D7262686537D"""
+"""0576BE30784530CB_B4C3EB3160386712_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC(C(F)F)(F)F""",21,"""FE60D7262686537D"""
+"""4539496922C7CB73_BEDE00B967B690B4_6039_UN""","""O(C1=CC=C(C=C1)C2C(F)(F)C2(F)F)CC[S](NC)(=O)=O""",21,"""FE60D7262686537D"""
+"""6113575330ECE47F_5502BACF3698D7AD_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC(NCC(OC)=O)=O""",21,"""C66D83F2092CDCE2"""
+"""6770591AAE384C34_00BC3A84F59448DB_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC(=O)N3CCNC3=O""",21,"""C66D83F2092CDCE2"""
+"""528B96BED9C5BBB6_7DE4D68373394C7A_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=CC=C(SC)C=C3""",21,"""C66D83F2092CDCE2"""
+"""B43F10BC3C86283A_39AE32CFE76420F6_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC(NC(NCC)=O)=O""",21,"""C66D83F2092CDCE2"""
+"""DA0EC6DE2E45D76B_3940BE5462F3ECC4_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC(NC(C(C)C)=O)=O""",21,"""C66D83F2092CDCE2"""
+"""838E10609436D746_ADB12ACA67CCDC81_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC=NNC(C(C)C)=O""",21,"""C66D83F2092CDCE2"""
+"""C6EB33A3EF0E9D92_48133CD984ED2C39_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=CC(=CC=C3)C#N""",21,"""C66D83F2092CDCE2"""
+"""21C568A4F5FA08E9_27D6F1167CF7CC75_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC(NC(C)C3CC3)=O""",21,"""C66D83F2092CDCE2"""
+"""830E6847611695DC_560293358FFB6CAE_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC(=O)N3CCOC3=O""",21,"""C66D83F2092CDCE2"""
+"""AE7A33CD7B76F38A_97E088EFDACABED6_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=CC(=CC(=C3)C)C""",21,"""C66D83F2092CDCE2"""
+"""D6A81500C0C5F536_401C36183CB4113C_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC(=O)NC3=NN=CS3""",21,"""C66D83F2092CDCE2"""
+"""BB4A0C2AF37CE924_0F3507E5E6016230_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=C(C=CC=C3)C#N""",21,"""C66D83F2092CDCE2"""
+"""77E6CA69BD06C772_17B6CE7E45288C10_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=CSC(=N3)CCC""",21,"""C66D83F2092CDCE2"""
+"""2B8CC51BC9651031_160A7F84114393F3_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=NC(=NO3)C4CC4""",21,"""C66D83F2092CDCE2"""
+"""277C9D3C9567F2BF_705B5AA49364DA17_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=NN=N[N]3C4CC4""",21,"""C66D83F2092CDCE2"""
+"""8F140B930DC841FE_2F84C05F887B5F32_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=NC(=NO3)C(C)C""",21,"""C66D83F2092CDCE2"""
+"""77BF4865BF015F1F_A6E6391511B6DDD3_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC(=O)NC3=NOC=C3""",21,"""C66D83F2092CDCE2"""
+"""327C92A7479A1D2E_24C9A82BBCC0B9BA_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=NOC(=N3)CCC""",21,"""C66D83F2092CDCE2"""
+"""C5B62A92DF35E26F_4084874D77B5ADF1_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=NC(=NO3)CCC""",21,"""C66D83F2092CDCE2"""
+"""F086CB649E60E07B_CC9FBBF374615DC8_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC(C3=CC=C(C)S3)=O""",21,"""C66D83F2092CDCE2"""
+"""A87338475C53677E_45D7A68EEA8C84D6_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CCN3C(SC=C3C)=O""",21,"""C66D83F2092CDCE2"""
+"""AF51DFE3F133D5F6_7427537BB553A4D0_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CCN3C(=O)CNC3=O""",21,"""C66D83F2092CDCE2"""
+"""5090E731CACF9DC4_85AFECD6E3E43EEE_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CCN3C(=O)CCC3=O""",21,"""C66D83F2092CDCE2"""
+"""E7FF4DB3DB15E825_978521D7ED665E02_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CCOC3CCCCC3""",21,"""C66D83F2092CDCE2"""
+"""68BB110911C8CE47_0D6E76033D203FA5_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=C(C=C(F)C=C3)F""",21,"""C66D83F2092CDCE2"""
+"""CE490CD3B5606E1A_655BDF8F89C5842C_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC3=NN=N[N]3CCC""",21,"""C66D83F2092CDCE2"""
+"""5F4FFF463BA6BD5F_E457C295A0E65CD2_6039_UN""","""O(C1CCN(C1)C2=CC=CC=C2)CC(N(CC)C3CC3)=O""",21,"""C66D83F2092CDCE2"""
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+"""C4979625B49326A9_8EA33CD6B5AB39B9_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCCCC(O)=O)S2""",21,"""52F48F38535C2F4E"""
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+"""600323FE8AF553EC_B95DE1B9915778A6_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=NC=CC=N2)S3""",21,"""52F48F38535C2F4E"""
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+"""E6B7D83F5A2B4B58_E84F6561611097F7_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=N[N](C)N=C2)S3""",21,"""52F48F38535C2F4E"""
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+"""78E62E66B1852A2F_CFF0E3F6EEB5B355_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC(NCCC)=O)S2""",21,"""52F48F38535C2F4E"""
+"""452F34C043BFCD0E_17232856528B204E_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCC(=C(F)F)F)S2""",21,"""52F48F38535C2F4E"""
+"""A4CCAF3284D36421_7A7F98180FDAAD60_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC[S](CC)(=O)=O)S2""",21,"""52F48F38535C2F4E"""
+"""502D16CD7CE1725F_1EC91DA010AFCDB7_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=NC=N[N]2C)S3""",21,"""52F48F38535C2F4E"""
+"""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"""
+"""46FFA6CBB90B69BA_2A3F860E77CBE055_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2N(C)CCC2)S3""",21,"""52F48F38535C2F4E"""
+"""ADE06E2E4CB7D879_C84100B4B43CE96C_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCCC2=CON=C2)S3""",21,"""52F48F38535C2F4E"""
+"""5EE4B2FB032171E1_E7B7115C5EEF34FD_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2CCC(=O)O2)S3""",21,"""52F48F38535C2F4E"""
+"""E0E51A6EECFBEB96_D1CE3F839D422CF5_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC(COCC)=O)S2""",21,"""52F48F38535C2F4E"""
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+"""AC1B84481E423FF1_307D90BB59F54864_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC(C(C)(C)F)=O)S2""",21,"""52F48F38535C2F4E"""
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+"""824163F8A2494835_0B29875AF5202543_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC[N]2N=CN=C2)S3""",21,"""52F48F38535C2F4E"""
+"""081392D3DA889B48_FDCFAD7717C952F3_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC(NC(C)=O)=O)S2""",21,"""52F48F38535C2F4E"""
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+"""CB428142EC146BD4_48B1739B205BA270_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCCC(OC)=N)S2""",21,"""52F48F38535C2F4E"""
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+"""208F6237E75FB088_6EE55F480C6978E8_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCC(C(C)=O)F)S2""",21,"""52F48F38535C2F4E"""
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+"""83CD1E3F356ED337_B42249DCB91B0D71_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCC(CC)(F)F)S2""",21,"""52F48F38535C2F4E"""
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+"""774CD5C589A9CCFF_AA881291B4E37C2F_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC(C(C)(F)F)=O)S2""",21,"""52F48F38535C2F4E"""
+"""036AAC393E6D2D20_5201AB7CBD3FF554_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC(C(C)=O)(F)F)S2""",21,"""52F48F38535C2F4E"""
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+"""57984F7EE7E1A9A7_D97DA5522D5C7017_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=CC(=N[NH]2)C)S3""",21,"""52F48F38535C2F4E"""
+"""FE39DDBA02B9A109_FEEACF5245B05FE3_6039_DP""","""COC(=O)C2=CC1=C(C=CC=C1OC[C@@H](C(OC)=O)N)S2""",21,"""52F48F38535C2F4E"""
+"""92B3C54846B35697_47DE7D04C693F0FB_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCCOC(F)F)S2""",21,"""52F48F38535C2F4E"""
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+"""83A486D3FB996229_C2A284FC7FACA060_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=NC(=NS2)C)S3""",21,"""52F48F38535C2F4E"""
+"""E3C05D90E5B5A187_A9FCCE26E7DAC62E_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=NN=CC=C2)S3""",21,"""52F48F38535C2F4E"""
+"""66C28030375DAEA5_10B4CA74C225480E_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCCC2(CC2)C#N)S3""",21,"""52F48F38535C2F4E"""
+"""D74A321E85057B7C_803C8135AE8CA621_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCO[Si](C)(C)C)S2""",21,"""52F48F38535C2F4E"""
+"""2C45073EBA746D7B_D8FFAD46087E7B25_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCC(C)C(F)F)S2""",21,"""52F48F38535C2F4E"""
+"""43783C3B7955B29F_358C063E6CD56C18_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCCC2CN(C)C2)S3""",21,"""52F48F38535C2F4E"""
+"""3360FBBC1E6AABDF_21E1C32A02A44B6B_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCOCCC=C)S2""",21,"""52F48F38535C2F4E"""
+"""DC44D191EA7A5929_94D271AB3D9F69B3_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC(SC)C(=O)O)S2""",21,"""52F48F38535C2F4E"""
+"""E1CCE21469A18BED_632996B458E47A6A_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCC=C(C)C(=O)O)S2""",21,"""52F48F38535C2F4E"""
+"""65140658345286AE_A6D6BEE81DF01640_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCCOCC2CO2)S3""",21,"""52F48F38535C2F4E"""
+"""E55E0E2D946C02EF_354F99B6F5EECA38_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=NC=NC=C2)S3""",21,"""52F48F38535C2F4E"""
+"""BE7600BD25557745_1237C36D92B3681A_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=NOC(C)C2)S3""",21,"""52F48F38535C2F4E"""
+"""A46294E6553BFB63_2857A00A2A9082C8_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=NOC(=N2)O)S3""",21,"""52F48F38535C2F4E"""
+"""834DA1276F380B72_844DBAED80008941_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC2=NC=CN=C2)S3""",21,"""52F48F38535C2F4E"""
+"""C06F7FC87BBD8883_C0E8E6F4271E05FA_6039_DP""","""COC(=O)C3=CC1=C(C=CC=C1OCC(C2(N)CC2)=O)S3""",21,"""52F48F38535C2F4E"""
+"""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"""
+"""824163F8A2494835_6E0715C14B66FFE0_6039_UN""","""COC(=O)C3=CC1=C(C=CC=C1OCC[N]2C=NC=N2)S3""",21,"""52F48F38535C2F4E"""
+"""E00DC8BF9435B082_EC890D5E277883D3_6039_UN""","""COC(=O)C2=CC1=C(C=CC=C1OCCCC(F)(F)F)S2""",21,"""52F48F38535C2F4E"""
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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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+"""E9C01C9433CA8E2A_FC00A2FD6DAD76DD_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NN=C(O2)C3CC3""",21,"""BE31E61089F8B603"""
+"""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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+"""CB4871BDC7B1AB5F_F0C71A32DB3B1236_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCOCC2CCCC2""",21,"""BE31E61089F8B603"""
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+"""C3956573B86E0946_6BE59EB47CCCE011_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NC=C(O2)C3CC3""",21,"""BE31E61089F8B603"""
+"""D56C69B67B032C62_AF20F9C812F23AB2_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC(=NC=C2)OC""",21,"""BE31E61089F8B603"""
+"""5357648683FB57B2_EC0BBA42B0C6F85E_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=NN=C(CC)[N]2C""",21,"""BE31E61089F8B603"""
+"""2C9DB6075440CDC8_3BFE9CB88448D5F4_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CN=C(N(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"""
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+"""573CF1AB13F3802D_DF9EFBF2CB718523_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CC2=CC=C(C=C2)C#C""",21,"""BE31E61089F8B603"""
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+"""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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+"""E934B5767E26AACB_366FB82865594594_6039_UN""","""O(C(CC1=CC=CC=C1)C(=O)O)CCC2=C[N](CC)N=N2""",21,"""BE31E61089F8B603"""
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+"""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"""
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+"""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"""
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+"""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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+"""9D7CFDC49F70CCF9_E434FEC82437C442_6039_UN""","""CC(C)(C)N1CCC1COCC2=NC(=NO2)C[S](C)(=O)=O""",21,"""33BF6BB6D5C6E13A"""
+"""D70056E1654C632F_5D3D4A49274F6C77_6039_UN""","""CC(C)(C)N1CCC1COCC2=NC(=NO2)C3=N[NH]C=N3""",21,"""33BF6BB6D5C6E13A"""
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+"""920B48E8B4EDBB2E_5CCAC59A0AA421B1_6039_UN""","""CC(C)(C)N1CCC1COCC(C2=CC(=CS2)C(O)=O)=O""",21,"""33BF6BB6D5C6E13A"""
+"""2D8E404FE794AC86_7B182221BD17B8E7_6039_UN""","""CC(C)(C)N1CCC1COCC2=NOC(=N2)C3=COC=C3""",21,"""33BF6BB6D5C6E13A"""
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+"""EAFC06D0AE0971CE_EC9DEFC8F3B64940_6039_UN""","""CC(C)(C)N1CCC1COCC2=C(N=C(C)S2)C(F)(F)F""",21,"""33BF6BB6D5C6E13A"""
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+"""CE1B63D4AFAB1948_8B03727C19DD8C7F_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC(=C(OC)C(=C2)F)F""",21,"""33BF6BB6D5C6E13A"""
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+"""992F5E05DF275DC6_6AE10FEA0EF1F613_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC=C([Si](C)(C)C)C=C2""",21,"""33BF6BB6D5C6E13A"""
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+"""B21E0BB8AE1B3309_1C1D2D73C3235DD3_6039_UN""","""CC(C)(C)N1CCC1COCC2=NN=C3[N]2CCCCC3""",21,"""33BF6BB6D5C6E13A"""
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+"""620D1FB4A30EC04E_C21A8BAC89C84F64_6039_UN""","""CC(C)(C)N1CCC1COCC2=C([S](N)(=O)=O)C=CC=C2""",21,"""33BF6BB6D5C6E13A"""
+"""3E483290EA70C992_08153E5771562C37_6039_UN""","""CC(C)(C)N1CCC1COCC(C(C(OCC)=O)(C)C)=O""",21,"""33BF6BB6D5C6E13A"""
+"""C9FBD40DDD6203B4_7FDE291B9A8FD90D_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC=C([S](Cl)(=O)=O)C=C2""",21,"""33BF6BB6D5C6E13A"""
+"""1B0C2BE25E79464E_8395525541393863_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC3=C(N=C2)C=CC=C3""",21,"""33BF6BB6D5C6E13A"""
+"""21AB906FCF55D1AB_17B2065CCC3F65AF_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC=C([S](C)(=O)=O)C=C2""",21,"""33BF6BB6D5C6E13A"""
+"""A26400F39B224245_AF7C24A9C944C658_6039_UN""","""CC(C)(C)N1CCC1COCC2=C(C=CC=C2)[S](=O)(=O)Cl""",21,"""33BF6BB6D5C6E13A"""
+"""84936A37ECB6226F_9F7703FB0FA9BA32_6039_UN""","""CC(C)(C)N1CCC1COCCCC2(CCOCC2)C#N""",21,"""33BF6BB6D5C6E13A"""
+"""1A392B54DA97639B_D612C75906A3CD16_6039_UN""","""CC(C)(C)N1CCC1COCC2=C(OC)N=C(C=C2C)C""",21,"""33BF6BB6D5C6E13A"""
+"""930FDB95673E882E_C401A25203ABF12D_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC(=CC=C2)[S](=O)(=O)Cl""",21,"""33BF6BB6D5C6E13A"""
+"""CFA8F5633D1A495A_4B927E654E1FCDA2_6039_UN""","""CC(C)(C)N1CCC1COCC2=C(C(F)(F)F)C=CC=C2""",21,"""33BF6BB6D5C6E13A"""
+"""8A75823AC766D6EE_83577A4D2AB7A734_6039_UN""","""CC(C)(C)N1CCC1COCC(=O)COC2=CC=CC=C2""",21,"""33BF6BB6D5C6E13A"""
+"""5096274CA03A09C6_9741683BA25550EC_6039_UN""","""CC(C)(C)N1CCC1COCCC(CC(OCC)=O)(C)C""",21,"""33BF6BB6D5C6E13A"""
+"""7E2F66162218F5B5_A74AC1D7938FDB3B_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC=C(NC(C)=O)C=C2""",21,"""33BF6BB6D5C6E13A"""
+"""B4ADD5F829101C74_DFAB23010E544DCB_6039_UN""","""CC(C)(C)N1CCC1COCC(C2=CC(=NC=C2)OC)=O""",21,"""33BF6BB6D5C6E13A"""
+"""930FDB95673E882E_EDFE3FF7063D9544_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC=CC(=C2)[S](Cl)(=O)=O""",21,"""33BF6BB6D5C6E13A"""
+"""AEA811D45E419A4F_977AA806268A4034_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC=C([S](F)(=O)=O)C=C2""",21,"""33BF6BB6D5C6E13A"""
+"""DEB37C9CEB8203FA_16257E130942FBFA_6039_UN""","""CC(C)(C)N1CCC1COCC(C2=CC=CC(=N2)OC)=O""",21,"""33BF6BB6D5C6E13A"""
+"""4F1007090FCC604C_12A732BB3153F53F_6039_UN""","""CC(C)(C)N1CCC1COCCN2C3=C(CC2)C=CC=C3""",21,"""33BF6BB6D5C6E13A"""
+"""75B03D77F82E8133_C17BC08029076184_6039_UN""","""CC(C)(C)N1CCC1COCC2=C(N=C(C(C)C)C=C2)C""",21,"""33BF6BB6D5C6E13A"""
+"""15C9497C01010FA7_C4E4601EFF49B16C_6039_UN""","""CC(C)(C)N1CCC1COCC2=NC(=CS2)C(OCC)=O""",21,"""33BF6BB6D5C6E13A"""
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+"""09416336E29DB419_6D2FC43B13A88C06_6039_UN""","""CC(C)(C)N1CCC1COCC(C2=C(OC)C=CC=C2)=O""",21,"""33BF6BB6D5C6E13A"""
+"""C52DA5CFD604190D_014AEADBFBDC8089_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC=CC(=C2)C(F)(F)F""",21,"""33BF6BB6D5C6E13A"""
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+"""CE3C6FF2381582BB_F73B1BD3AB7F025F_6039_UN""","""CC(C)(C)N1CCC1COCC2=C(C(F)(F)F)N=CC=N2""",21,"""33BF6BB6D5C6E13A"""
+"""692B75C55E30606E_ACCF7CB392A3B6E2_6039_UN""","""CC(C)(C)N1CCC1COCC2=CC=CC(=C2)[S](C)(=N)=O""",21,"""33BF6BB6D5C6E13A"""
+"""F493AED603CC77D6_40A6A94CBC926E92_6039_UN""","""CC(C)(C)N1CCC1COCC2=NOC(=N2)C(OCC)=O""",21,"""33BF6BB6D5C6E13A"""
+"""478C31A26632CC93_5198AF8062923466_6039_UN""","""CC(C)(C)N1CCC1COCC2=N[N](C)C=C2[S](=O)(=O)Cl""",21,"""33BF6BB6D5C6E13A"""
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+"""A1A3D5A81CCFDBB4_B779519619E089AB_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC=CC(=C2C#N)F)F""",21,"""37D5B129C4DC888D"""
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+"""B5251AE595406EC3_B74E3BE1D43455CF_6039_UN""","""COC1=C(C(=NC=C1)COCC(N2CCCC2(C)C)=O)F""",21,"""37D5B129C4DC888D"""
+"""DC5552543984C451_F3484AB5ADB1EDBB_6039_UN""","""COC1=C(C(=NC=C1)COCC(=O)NC2(CCC2)C#N)F""",21,"""37D5B129C4DC888D"""
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+"""FAE7A97C6DA1F367_DE533B296C9C5B9C_6039_UN""","""COC1=C(C(=NC=C1)COCCCCN2CCOCC2)F""",21,"""37D5B129C4DC888D"""
+"""CCAEDDC0F3169A7D_69FA6BE85AAA6F39_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC(=C(C=C2)C#N)F)F""",21,"""37D5B129C4DC888D"""
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+"""06700D6A900E6F7A_829689338CD9E581_6039_UN""","""COC1=C(C(=NC=C1)COCC3CCC2(CC2)C(=O)O3)F""",21,"""37D5B129C4DC888D"""
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+"""31486FC641BE9F7B_CFE584AF5C8FD829_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NN=C(O2)C3CCC3)F""",21,"""37D5B129C4DC888D"""
+"""F87CC2118543D427_057E97478AF66760_6039_UN""","""COC1=C(C(=NC=C1)COCCC(=O)C2=CC=CC=C2)F""",21,"""37D5B129C4DC888D"""
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+"""119598E035AF726E_1911A91B93488301_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C(C=CC(=C2)F)C#N)F""",21,"""37D5B129C4DC888D"""
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+"""CBA41BD22A5BBCF2_F4E4F028EDF5BC9E_6039_UN""","""COC1=C(C(=NC=C1)COCCC[N]2N=C(C)C=C2C)F""",21,"""37D5B129C4DC888D"""
+"""B738C1BDD9E78828_004373E2A4575B0A_6039_DP""","""COC1=C(C(=NC=C1)COCC2=NC(=NO2)C(N)(C)C)F""",21,"""37D5B129C4DC888D"""
+"""124E928F032616EF_F93C94ED45DB4434_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NOC(=N2)C(C)(C)C)F""",21,"""37D5B129C4DC888D"""
+"""42DC5A16CB5BC33B_3BA70A3E43D4BD2F_6039_UN""","""COC1=C(C(=NC=C1)COCC(N(C)CC(F)(F)F)=O)F""",21,"""37D5B129C4DC888D"""
+"""5D9299232CD220EB_CCD41FEBDEFA9127_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CN=C(N(C)C)C=C2)F""",21,"""37D5B129C4DC888D"""
+"""2958A75DACEBDA12_40DD2C42D06EABD4_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC=C(C(OC)=O)O2)F""",21,"""37D5B129C4DC888D"""
+"""2740395980F26BBF_73DDA5A084399480_6039_UN""","""COC1=C(C(=NC=C1)COCCN2C(NC(C)C2=O)=O)F""",21,"""37D5B129C4DC888D"""
+"""D130A08F70453984_033F31512C80BF9A_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC=C(C=C2)N=[N]#N)F""",21,"""37D5B129C4DC888D"""
+"""72D0DF6C815869E0_8B713624CA891459_6039_UN""","""COC1=C(C(=NC=C1)COCCCC(NCC(C)C)=O)F""",21,"""37D5B129C4DC888D"""
+"""7FDBB63AE02636DB_F6DDE168345DC485_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CSC(=N2)C(OC)C)F""",21,"""37D5B129C4DC888D"""
+"""1DC16D9EB91D683C_6668A39384B46D09_6039_UN""","""COC1=C(C(=NC=C1)COCC3CN(C2CC2)C(=O)O3)F""",21,"""37D5B129C4DC888D"""
+"""2B6DAAFA7D57AE53_942AD175B37FBFAD_6039_UN""","""COC1=C(C(=NC=C1)COCCC2(CCCCC2)C#N)F""",21,"""37D5B129C4DC888D"""
+"""9E61A80193632F13_668B64C76CCA0A43_6039_UN""","""COC1=C(C(=NC=C1)COCCCCCCCC(O)=O)F""",21,"""37D5B129C4DC888D"""
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+"""13E3E7F58C259835_612E602F3043E297_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC=C(C=C2)CC#N)F""",21,"""37D5B129C4DC888D"""
+"""B808572503CB3D10_1B35E19F355758D8_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NN=C(C(F)(F)F)S2)F""",21,"""37D5B129C4DC888D"""
+"""CAD5B3772D7333EF_38F3EE18F87B120D_6039_UN""","""COC1=C(C(=NC=C1)COCCN2CC(C)CC(C2)C)F""",21,"""37D5B129C4DC888D"""
+"""D277BC396760B38D_09BC17B723F92696_6039_UN""","""COC1=C(C(=NC=C1)COCCC2=C(F)C=CC=C2F)F""",21,"""37D5B129C4DC888D"""
+"""C5C22CDD4C2B14B3_ACB7B24DF5AD0078_6039_UN""","""COC1=C(C(=NC=C1)COCC(C2=N[N](CC)N=C2)=O)F""",21,"""37D5B129C4DC888D"""
+"""2E80195BA482D542_2ECD8A4BBDF06B08_6039_UN""","""COC1=C(C(=NC=C1)COCC2=N[N](C(C)(C)C)N=N2)F""",21,"""37D5B129C4DC888D"""
+"""6FABADE6517C8865_8513A95B213F1844_6039_UN""","""COC1=C(C(=NC=C1)COCCN2NC(=O)C=CC2=O)F""",21,"""37D5B129C4DC888D"""
+"""80EE3F26F88B7F54_76C00BA3CF5B78AE_6039_UN""","""COC1=C(C(=NC=C1)COCC(C2(C(OC)=O)CC2)=O)F""",21,"""37D5B129C4DC888D"""
+"""948BE6D4564E5C52_389D2FC3E5BD6085_6039_UN""","""COC1=C(C(=NC=C1)COCCN2C(CN(C)C2=O)=O)F""",21,"""37D5B129C4DC888D"""
+"""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"""
+"""1E5CC15E979CDAB1_193E02CDC89C4A74_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C[N](C(C)(C)C)N=C2)F""",21,"""37D5B129C4DC888D"""
+"""85EBE0226D99A28C_57E5B8F3B94F28D2_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC3=C(C=C2)C=N[NH]3)F""",21,"""37D5B129C4DC888D"""
+"""5B822B4C518B00DB_3D668C9C8ED2403B_6039_UN""","""COC1=C(C(=NC=C1)COCCSC2=CC=CC(=C2)F)F""",21,"""37D5B129C4DC888D"""
+"""9A626B94F75E0EE9_C39C2CC9A9C5F70D_6039_UN""","""COC1=C(C(=NC=C1)COCCOCC2=CC=CC=C2)F""",21,"""37D5B129C4DC888D"""
+"""2EA347DBB4320D56_236A6FCD471E78C0_6039_UN""","""COC1=C(C(=NC=C1)COCC[P](N(C)C)(=O)N(C)C)F""",21,"""37D5B129C4DC888D"""
+"""E050D9930FCD1F3B_01B693809F76453B_6039_UN""","""COC1=C(C(=NC=C1)COCC(N=[S](N(C)C)(=O)C)=O)F""",21,"""37D5B129C4DC888D"""
+"""81756EA1C065960F_817921FA55A77893_6039_UN""","""COC1=C(C(=NC=C1)COCCSC2=CC=CC(=C2)C)F""",21,"""37D5B129C4DC888D"""
+"""1BAD7B256B338BBF_5E4ED9C12A11EA7B_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NC(=N[N]2C)C3CC3)F""",21,"""37D5B129C4DC888D"""
+"""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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+"""BB4A2C92DAB14378_4A929C6FCBB41A95_6039_UN""","""COC1=C(C(=NC=C1)COCC3=NC2=C(CCCC2)[NH]3)F""",21,"""37D5B129C4DC888D"""
+"""7E5BF734FB7D9071_D6EC688675851233_6039_UN""","""COC1=C(C(=NC=C1)COCC2CCCC(O2)C3CC3)F""",21,"""37D5B129C4DC888D"""
+"""94E5220288822066_3D9768CF3CCFC925_6039_UN""","""COC1=C(C(=NC=C1)COCC3=NC2=C(CCCC2)S3)F""",21,"""37D5B129C4DC888D"""
+"""21A72AE62A1095DA_9D23E27571AF00AA_6039_UN""","""COC1=C(C(=NC=C1)COCC3=CC2=NSN=C2C=C3)F""",21,"""37D5B129C4DC888D"""
+"""2D9C0F12E1352CBF_C967B7289C132494_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC(=CC=C2)C3CC3)F""",21,"""37D5B129C4DC888D"""
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+"""2DE7617F94A28422_420942CD2BB8A605_6039_UN""","""COC1=C(C(=NC=C1)COCC(C2=C[N](CC)N=C2)=O)F""",21,"""37D5B129C4DC888D"""
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+"""B3BEE57CBCC7D6DF_128D0A50A6012356_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NC(=NO2)C(C)(F)F)F""",21,"""37D5B129C4DC888D"""
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+"""D69C53C53410CF73_03EC439C0CCFF5BF_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CON=C2C(C)(C)C)F""",21,"""37D5B129C4DC888D"""
+"""5CC30D338834694C_0A8402E953BCD282_6039_DP""","""COC1=C(C(=NC=C1)COCC3=C(C2CNC2)OC=N3)F""",21,"""37D5B129C4DC888D"""
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+"""BD3B046F7E835FCA_C313BDB7698EE124_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CON=C2C3CCC3)F""",21,"""37D5B129C4DC888D"""
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+"""5BE0190AEDC253DE_E5DE4986A4AEAE12_6039_UN""","""COC1=C(C(=NC=C1)COCCCN[S](=O)(=O)C2CC2)F""",21,"""37D5B129C4DC888D"""
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+"""E60191E9CDA73A7B_BB61D879B3F1FE1C_6039_UN""","""COC1=C(C(=NC=C1)COCC(C2=C(C)C=CC=C2)=O)F""",21,"""37D5B129C4DC888D"""
+"""B4BCA606D90A679B_BAB44DE02EA7BF0F_6039_DP""","""COC1=C(C(=NC=C1)COCC3CC2(CCNCC2)O3)F""",21,"""37D5B129C4DC888D"""
+"""E228731CBB358270_4524E731A9EC5B43_6039_UN""","""COC1=C(C(=NC=C1)COCCC2(C(F)(F)F)CCC2)F""",21,"""37D5B129C4DC888D"""
+"""E39BC286AA4D53F6_FA682627D16299E9_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CSC=C2C(F)(F)F)F""",21,"""37D5B129C4DC888D"""
+"""3AAEAD9587F41D04_FC9261458D7F6A1E_6039_UN""","""COC1=C(C(=NC=C1)COCCN2C(C)(COCC2)C)F""",21,"""37D5B129C4DC888D"""
+"""1E994F67C5AAB34F_E9021D4222FA8D61_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C([S](C)(=O)=O)C=CS2)F""",21,"""37D5B129C4DC888D"""
+"""A7C1265C51AFCE57_59BF529CCE888D69_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C(OC)C=CC(=N2)C)F""",21,"""37D5B129C4DC888D"""
+"""081A34E4886D9734_B00968E62A4A4780_6039_UN""","""COC1=C(C(=NC=C1)COCCN2CC[S](=O)(=O)CC2)F""",21,"""37D5B129C4DC888D"""
+"""756C1150F64EBA8F_A8933B1DF4EF32A9_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NSC(=C2)C(F)(F)F)F""",21,"""37D5B129C4DC888D"""
+"""3DD881994A584C6F_0628CC29ECEC618C_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C(N=C(OC)C=C2)C)F""",21,"""37D5B129C4DC888D"""
+"""1CBDE105737E1EFB_3585ACE675A915DD_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CSC(=C2)C(F)(F)F)F""",21,"""37D5B129C4DC888D"""
+"""09F5AD4328D42D42_B2175946EAB6AF92_6039_UN""","""COC1=C(C(=NC=C1)COCCCCCC2OCCO2)F""",21,"""37D5B129C4DC888D"""
+"""F10AE64409D5F599_853BD982F3B1E873_6039_UN""","""COC1=C(C(=NC=C1)COCC3CC2(CC2)[S](=O)(=O)N3)F""",21,"""37D5B129C4DC888D"""
+"""A790405BC6158EC6_38C6EC419FDFBA89_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC3=C(C=C2)N=N[NH]3)F""",21,"""37D5B129C4DC888D"""
+"""EDB6E891DE35989F_E276610744140759_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC=CC3=CC=N[N]23)F""",21,"""37D5B129C4DC888D"""
+"""80600165E4E7D474_ED9201644BF6DC3C_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C(COC)C=CC=C2)F""",21,"""37D5B129C4DC888D"""
+"""8B381387107E4A10_1601C2B7DE979327_6039_UN""","""COC1=C(C(=NC=C1)COCCCC2=C(C)C=CN=C2)F""",21,"""37D5B129C4DC888D"""
+"""DC3608AAEAAD145E_C5D1A16D8FDE90A6_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NC(C(OC)=O)CO2)F""",21,"""37D5B129C4DC888D"""
+"""C2B20E4E8101091C_4A0900F4A771FEC8_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NC(=CC=C2)CC#N)F""",21,"""37D5B129C4DC888D"""
+"""F64CC4A0A0E91370_F7D92BEC0092A1C1_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC(=CS2)C(F)(F)F)F""",21,"""37D5B129C4DC888D"""
+"""348C991EF5500268_C7C060B4451FC42A_6039_UN""","""COC1=C(C(=NC=C1)COCC2=N[N](C)C=C2[N](=O)=O)F""",21,"""37D5B129C4DC888D"""
+"""AD0F40CA932757E8_DC66EC81E2D1DDAE_6039_DP""","""COC1=C(C(=NC=C1)COCC2=CC(=NO2)C3CNC3)F""",21,"""37D5B129C4DC888D"""
+"""5508A18A9D4CF919_B9A2E2686386EE3E_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC3=C(C=C2)C=CO3)F""",21,"""37D5B129C4DC888D"""
+"""5A007BE7DEEA3D70_7E0CDC75F3430EF4_6039_DP""","""COC1=C(C(=NC=C1)COCC(N2CCNCC2C)=O)F""",21,"""37D5B129C4DC888D"""
+"""ED34F33E2A572857_6F3BFDA29C207947_6039_DP""","""COC1=C(C(=NC=C1)COCC(NC2CCNCC2)=O)F""",21,"""37D5B129C4DC888D"""
+"""3B563EF3107536CE_805FAC4758923094_6039_DP""","""COC1=C(C(=NC=C1)COCCC2(CCNCC2)C#N)F""",21,"""37D5B129C4DC888D"""
+"""7A72987C03435765_3899B93F2B891D54_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NN=C3C=CC=N[N]23)F""",21,"""37D5B129C4DC888D"""
+"""5BF5D1DCD9D3C2D1_0192EC55F35DF98E_6039_DP""","""COC1=C(C(=NC=C1)COCC3=CC2=C(CNC2)C=C3)F""",21,"""37D5B129C4DC888D"""
+"""CA7D47458B61870B_19DFDB0B43BB2F37_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NCC(C(OC)=O)O2)F""",21,"""37D5B129C4DC888D"""
+"""4415DE7A61F89283_72BF7AB2F8EB33AF_6039_UN""","""COC1=C(C(=NC=C1)COCCNC(=O)N2CCCC2)F""",21,"""37D5B129C4DC888D"""
+"""12E1C29768A5CC82_625E67405BFCCD49_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NOC(=C2)CC(C)C)F""",21,"""37D5B129C4DC888D"""
+"""2B9516FC9505B845_D111F505DD3ADC43_6039_UN""","""COC1=C(C(=NC=C1)COCC2=N[NH]C(=C2)C(OC)=O)F""",21,"""37D5B129C4DC888D"""
+"""26C83089336F98EC_D9BED2EA50BCEEEE_6039_DP""","""COC1=C(C(=NC=C1)COCC(N2CC(C)NCC2)=O)F""",21,"""37D5B129C4DC888D"""
+"""3671814B76D2F3B5_0D3C08D75A3A8375_6039_UN""","""COC1=C(C(=NC=C1)COCC3=CC2=C(C=CC=N2)S3)F""",21,"""37D5B129C4DC888D"""
+"""8B7C22A8DABF642C_84AFDF5594898611_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC(=NC(=C2)C)OC)F""",21,"""37D5B129C4DC888D"""
+"""BBDCD38547099392_C0F753C60021265A_6039_DP""","""COC1=C(C(=NC=C1)COCC2CNCC3(O2)CCC3)F""",21,"""37D5B129C4DC888D"""
+"""6A194A27300788F3_CAE869B16BF0FCE7_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC(=NC(=N2)OC)C)F""",21,"""37D5B129C4DC888D"""
+"""D2A13D5FC87C8479_EF9CCBD368E3960F_6039_UN""","""COC1=C(C(=NC=C1)COCCN2CCCO[P]2(N)=O)F""",21,"""37D5B129C4DC888D"""
+"""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"""
+"""DF52CF9DD7CB858D_E65262F0B74ED42D_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C(C(F)F)C=NC=C2)F""",21,"""37D5B129C4DC888D"""
+"""3BD5EF32072D0353_6A9CA5D9BC6DC23F_6039_UN""","""COC1=C(C(=NC=C1)COCC2=C(C(F)(F)F)SC=C2)F""",21,"""37D5B129C4DC888D"""
+"""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"""
+"""8AD33FE053140BAD_87FC92D22A1D7B73_6039_UN""","""COC1=C(C(=NC=C1)COCCOCCOCCOC)F""",21,"""37D5B129C4DC888D"""
+"""E36BF0F0356550B9_4F3427B442AEE5B0_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NN=C(C(F)(F)Cl)S2)F""",21,"""37D5B129C4DC888D"""
+"""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"""
+"""2EA50C6848041C81_0E930BFC23686F0B_6039_UN""","""COC1=C(C(=NC=C1)COCC2=NOC(=C2)CC3CC3)F""",21,"""37D5B129C4DC888D"""
+"""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"""
+"""52859AD7C5839E34_44C094D8F0B21F68_6039_DP""","""COC1=C(C(=NC=C1)COCCC3CC2CCC(N2)C3)F""",21,"""37D5B129C4DC888D"""
+"""C46D4C900DCF30F4_E4DE82FC6B2A7BD9_6039_UN""","""COC1=C(C(=NC=C1)COCC2=CC=CC(=C2)C(N)=O)F""",21,"""37D5B129C4DC888D"""
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+"""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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+"""CD31E6405B8E9F6E_72470AC06B5E4117_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCCCC2=C[N](C)N=C2)C""",21,"""00F9030A5E100ABA"""
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+"""9E9AA2985C2B58B3_54188302FAD05467_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCCCOCC(F)(F)F)C""",21,"""00F9030A5E100ABA"""
+"""5012D7ED26070A5B_11B63C69C8035989_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC(NCCN(C)C)=O)C""",21,"""00F9030A5E100ABA"""
+"""EC9F60E5454BC2F0_8D0557DB86A1E97C_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=C[N]3C(=N2)SC=C3)C""",21,"""00F9030A5E100ABA"""
+"""B01A0DF34BAD3172_39166C5DEA2C4AD0_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCCCN2CCOCC2)C""",21,"""00F9030A5E100ABA"""
+"""2DB49E988A9AD192_538AB15DCD3473A0_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2OCCN(CC)C2)C""",21,"""00F9030A5E100ABA"""
+"""113D7973A3758ABE_B69D1F1FA86749E2_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=NN=N[N]2C(C)C)C""",21,"""00F9030A5E100ABA"""
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+"""C54C08FC6D0A5C8A_5E9B1937E97BF8DB_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=NC=N[N]2C(C)C)C""",21,"""00F9030A5E100ABA"""
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+"""5712AE5561A03C01_D361B8458C4B1773_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=CN=C(OC)N=C2)C""",21,"""00F9030A5E100ABA"""
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+"""ED2F57E6703AE889_C1C2C854E3F6BA00_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC(C2=N[N](C)N=C2)=O)C""",21,"""00F9030A5E100ABA"""
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+"""E4071F802F470B6D_81C75F1B6B8B1FD8_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=COC(=N2)C3CC3)C""",21,"""00F9030A5E100ABA"""
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+"""8FC4B27048C7C4D8_3659D14FA3B5AE87_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=C([N](N=C2C)C)C)C""",21,"""00F9030A5E100ABA"""
+"""90B921F2AC2305B9_DD5366DC0266083A_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=NC(=NS2)C3CC3)C""",21,"""00F9030A5E100ABA"""
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+"""850D8B2B06D86E88_1FCC542A69106815_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCCSC2=CC=NC=C2)C""",21,"""00F9030A5E100ABA"""
+"""F15047BCD4AEC869_6B40F021DCC23B3F_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC(NCC(C)(C)C)=O)C""",21,"""00F9030A5E100ABA"""
+"""C488365B61401B0B_2A68DAD7BB37D01B_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC3CC2CCCC2O3)C""",21,"""00F9030A5E100ABA"""
+"""6F6851A15EEE5E8E_3E59C64697C0ABA3_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=C(C)C(NC2=O)=O)C""",21,"""00F9030A5E100ABA"""
+"""8928A26AD336A3DF_4210E9616EE51D91_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2CCC(O2)C3CC3)C""",21,"""00F9030A5E100ABA"""
+"""DD423D1178C101C4_3C83F86EDD6FDF84_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=COC(=N2)C(F)F)C""",21,"""00F9030A5E100ABA"""
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+"""193C60CE9729654E_55345094FBDB5B5E_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCCCCC[S](Cl)(=O)=O)C""",21,"""00F9030A5E100ABA"""
+"""C76BC346705AEF84_9C7B219B50790C71_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC3CC2COCC2O3)C""",21,"""00F9030A5E100ABA"""
+"""E1BDA19EBF20AE39_A05CE70A2DD68A97_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=CN=C(C(C)C)S2)C""",21,"""00F9030A5E100ABA"""
+"""23381A4F58C6D126_58B14B262529833F_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC(CC[S](C)(=O)=O)=O)C""",21,"""00F9030A5E100ABA"""
+"""F70DB71E4DF1ED83_B3D88ACF9F371980_6039_UN""","""COC(=O)C1=C(C=C(C=C1)OCC2=CC(=C(C=C2)F)C)C""",21,"""00F9030A5E100ABA"""
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+"""C3BF9320E585831C_6AEB36B6780A9C34_6039_UN""","""COC(COCC(NC1=NN=C(C)S1)=O)C2CCCCC2""",21,"""7CED175701B741FF"""
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+"""B4806444FC913D08_C8F1D20D7B565239_6039_UN""","""COC(COCCCCCCCCCC)C1CCCCC1""",21,"""7CED175701B741FF"""
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+"""B33F7DA500C09745_851E81606E15CFE1_6039_UN""","""COC(COCC(C1=CC=C(C)C=C1)=O)C2CCCCC2""",21,"""7CED175701B741FF"""
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+"""3995962C9C176AA1_ED31FFEF3C8F59A7_6039_UN""","""COC(COCCC(=O)NC1CCCC1)C2CCCCC2""",21,"""7CED175701B741FF"""
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+"""E2AF20B530F6E2EB_EE8B15A743D96181_6039_UN""","""COC(COCC(N(C(C)C)C(C)C)=O)C1CCCCC1""",21,"""7CED175701B741FF"""
+"""25D5043A78CCD8B0_DF8E3E97687C5CDD_6039_UN""","""COC(COCC1=C[N]2C(=N1)C=CC=C2)C3CCCCC3""",21,"""7CED175701B741FF"""
+"""3DFB0F08D7C80C3D_CC5E540D7F17004F_6039_UN""","""COC(COCC(C1=C(C)[NH]C(=C1)C)=O)C2CCCCC2""",21,"""7CED175701B741FF"""
+"""347E0B965C16053F_8A4A2CC7EE784D8C_6039_UN""","""COC(COCCSC1=CC=C(C)C=C1)C2CCCCC2""",21,"""7CED175701B741FF"""
+"""A8DA9EF11F4A0428_FF4148F71730E8AB_6039_UN""","""COC(COCC(=O)NC(=O)NC1CC1)C2CCCCC2""",21,"""7CED175701B741FF"""
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+"""CBDB9763F391A18C_40BA59973869CA4E_6039_UN""","""COC(COCC2=C[N]1C=CC=NC1=N2)C3CCCCC3""",21,"""7CED175701B741FF"""
+"""BE4C2B54602EB980_DF282757F4CFAECB_6039_UN""","""COC(COCCOC1CCCCC1C)C2CCCCC2""",21,"""7CED175701B741FF"""
+"""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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+"""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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+"""9C16326CDA7342CB_38C4BEB814B888F6_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC(C(C)=O)F""",21,"""04D56EC84B8DDF50"""
+"""6E052A1B900A50C4_8C3DCF10E8080D90_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)C[C@H]3OCC[C@H]3C""",21,"""04D56EC84B8DDF50"""
+"""ABFE83519BED6DEE_E203A82CA1CAFD6F_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCC(CC)(F)F""",21,"""04D56EC84B8DDF50"""
+"""B4089423EE51B65F_4A225B455A079CB6_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=CN=C(C)O3""",21,"""04D56EC84B8DDF50"""
+"""CC0159B282264DB3_FCA9F361AC328C31_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(C(C)(F)F)=O""",21,"""04D56EC84B8DDF50"""
+"""DB531EFB8C6D2B8B_04204A8CA5EE054A_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(C(C)=O)(F)F""",21,"""04D56EC84B8DDF50"""
+"""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"""
+"""C23EF08A4A28270C_A8CB2EA25D61AFFD_6039_DP""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)C[C@@H](C(OC)=O)N""",21,"""04D56EC84B8DDF50"""
+"""78F4723C69D03B1B_11FF9CF4DE4200E5_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CCCOC(F)F""",21,"""04D56EC84B8DDF50"""
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+"""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"""
+"""94ED9EC0066C7BEC_7E7641FA324172D6_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NOC(=N3)O""",21,"""04D56EC84B8DDF50"""
+"""683D5DA4BDC6EF31_D26C5B1D98D1795F_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=NC=CN=C3""",21,"""04D56EC84B8DDF50"""
+"""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"""
+"""80EC72DE17F3D67A_907CC3CD022EC1F2_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC3=C(C)[NH]C=N3""",21,"""04D56EC84B8DDF50"""
+"""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"""
+"""A429521B79DD6D93_4E7652DF0D33EB3F_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC(C(F)F)(F)F""",21,"""04D56EC84B8DDF50"""
+"""BE70CE74456082A7_446BB9570ABD1C99_6039_UN""","""O(CC1=C[NH]C(=N1)CC2=CC=CC=C2)CC[S](NC)(=O)=O""",21,"""04D56EC84B8DDF50"""
+"""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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+"""949E2D02BCB399C7_7FC188AE7006629D_6039_UN""","""CSC1=CC(=C(C=C1)OCCCC#C[Si](C)(C)C)C(=O)O""",21,"""94D8BBDD97AE8345"""
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+"""AC4AAE0D93ABB70C_708E409318557E91_6039_DP""","""CSC1=CC(=C(C=C1)OCC3CCC2(CNC2)O3)C(=O)O""",21,"""94D8BBDD97AE8345"""
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