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macro-atrop.sdf
RDKit 2D
0 0 0 0 0 0 0 0 0 0999 V3000
M V30 BEGIN CTAB
M V30 COUNTS 24 25 0 0 0
M V30 BEGIN ATOM
M V30 1 C 0.711990 -0.445053 0.000000 0
M V30 2 C 1.423980 -0.856121 0.000000 0
M V30 3 C 2.135971 -0.445053 0.000000 0
M V30 4 C 2.135971 0.377082 0.000000 0
M V30 5 F 1.423980 -1.678257 0.000000 0
M V30 6 C -1.423981 -0.856121 0.000000 0
M V30 7 C -1.423981 -1.678257 0.000000 0
M V30 8 C -0.711991 -2.089324 0.000000 0
M V30 9 C 0.000000 -1.678257 0.000000 0
M V30 10 C 0.000000 -0.856121 0.000000 0
M V30 11 C -0.711991 -0.445053 0.000000 0
M V30 12 C -0.711991 0.377082 0.000000 0
M V30 13 F -0.711991 -2.911461 0.000000 0
M V30 14 C -1.423981 0.788150 0.000000 0
M V30 15 C -1.423981 1.610286 0.000000 0
M V30 16 Cl -2.135971 -0.445053 0.000000 0
M V30 17 C 1.423980 0.788150 0.000000 0
M V30 18 C 0.000000 1.610286 0.000000 0
M V30 19 C -0.711991 2.021354 0.000000 0
M V30 20 C -0.882923 2.825524 0.000000 0
M V30 21 C -1.700554 2.911461 0.000000 0
M V30 22 C -2.034947 2.160402 0.000000 0
M V30 23 C 0.000000 0.788150 0.000000 0
M V30 24 C 0.711990 0.377082 0.000000 0
M V30 END ATOM
M V30 BEGIN BOND
M V30 1 2 24 1
M V30 2 1 1 2
M V30 3 2 2 3
M V30 4 1 3 4
M V30 5 2 4 17
M V30 6 1 17 24
M V30 7 1 2 5
M V30 8 2 6 7
M V30 9 1 7 8
M V30 10 2 8 9
M V30 11 1 10 9 CFG=3
M V30 12 2 10 11
M V30 13 1 11 6
M V30 14 1 8 13
M V30 15 1 1 10
M V30 16 1 12 14
M V30 17 1 14 15
M V30 18 1 6 16
M V30 19 1 18 19
M V30 20 1 19 20
M V30 21 1 20 21
M V30 22 1 21 22
M V30 23 1 22 15
M V30 24 1 18 23
M V30 25 1 23 24
M V30 END BOND
M V30 END CTAB
M END
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