File size: 710 Bytes
35aaa09 | 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 | REMARK Name = Example Ligand
REMARK 2 active torsions:
REMARK status: ('A' for Active; 'I' for Inactive)
REMARK 1 A between atoms: C_2 and C_3
REMARK 2 A between atoms: C_3 and O_4
ROOT
ATOM 1 C UNL 1 0.000 0.000 0.000 0.00 0.00 +0.000 C
ATOM 2 C UNL 1 1.540 0.000 0.000 0.00 0.00 +0.000 C
ENDROOT
BRANCH 2 3
ATOM 3 C UNL 1 2.078 1.421 0.000 0.00 0.00 +0.000 C
BRANCH 3 4
ATOM 4 O UNL 1 3.490 1.421 0.000 0.00 0.00 +0.000 OA
ATOM 5 H UNL 1 3.787 2.332 0.000 0.00 0.00 +0.000 HD
ENDBRANCH 3 4
ENDBRANCH 2 3
TORSDOF 2
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