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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 22 24 0 0 0
M V30 BEGIN ATOM
M V30 1 C 0.707022 0.821826 0.000000 0
M V30 2 C 0.707028 0.005419 0.000000 0
M V30 3 C 1.414057 -0.402784 0.000000 0
M V30 4 C 2.121084 0.005423 0.000000 0
M V30 5 C 2.121076 0.821829 0.000000 0
M V30 6 F 1.414057 -1.219191 0.000000 0
M V30 7 C -1.414056 -0.402800 0.000000 0
M V30 8 C -1.414049 -1.219206 0.000000 0
M V30 9 C -0.707017 -1.627405 0.000000 0
M V30 10 C 0.000009 -1.219196 0.000000 0
M V30 11 C 0.000003 -0.402789 0.000000 0
M V30 12 C -0.707029 0.005409 0.000000 0
M V30 13 C -0.707036 0.821815 0.000000 0
M V30 14 F -0.707017 -2.443811 0.000000 0
M V30 15 C -1.220822 1.456279 0.000000 0
M V30 16 C -0.812624 2.163310 0.000000 0
M V30 17 Cl -2.121084 0.005403 0.000000 0
M V30 18 C 1.414048 1.230034 0.000000 0
M V30 19 C 0.700758 2.443811 0.000000 0
M V30 20 C -0.006268 2.035603 0.000000 0
M V30 21 C 1.407790 2.035613 0.000000 0
M V30 22 Cl -0.000007 1.230029 0.000000 0
M V30 END ATOM
M V30 BEGIN BOND
M V30 1 2 1 2
M V30 2 1 2 3
M V30 3 2 3 4
M V30 4 1 4 5
M V30 5 2 5 18
M V30 6 1 18 1
M V30 7 1 3 6
M V30 8 2 7 8
M V30 9 1 8 9
M V30 10 2 9 10
M V30 11 1 11 10 CFG=1
M V30 12 2 11 12
M V30 13 1 12 7
M V30 14 1 12 13
M V30 15 1 9 14
M V30 16 1 2 11
M V30 17 1 13 15
M V30 18 1 15 16
M V30 19 1 7 17
M V30 20 1 21 19
M V30 21 1 19 20
M V30 22 1 20 16
M V30 23 1 18 21
M V30 24 1 1 22
M V30 END BOND
M V30 END CTAB
M END
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