File: BMS-986142_atrop2.mrv.noReapply.expected.sdf

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     RDKit          2D

  0  0  0  0  0  0  0  0  0  0999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS 42 47 0 0 0
M  V30 BEGIN ATOM
M  V30 1 F 2.837613 1.234053 0.000000 0
M  V30 2 F 8.092467 -6.191733 0.000000 0
M  V30 3 O -8.960280 0.897680 0.000000 0
M  V30 4 O -1.248333 6.698907 0.000000 0
M  V30 5 O 4.103587 -0.719787 0.000000 0
M  V30 6 O 2.513747 -5.812053 0.000000 0
M  V30 7 N -2.729347 4.057013 0.000000 0
M  V30 8 N 3.308760 -3.265920 0.000000 0
M  V30 9 N 1.418573 6.729893 0.000000 0
M  V30 10 N 5.116067 -5.227413 0.000000 0
M  V30 11 C -5.895960 1.207920 0.000000 0
M  V30 12 C -4.953107 -0.089600 0.000000 0
M  V30 13 C -5.232360 2.668213 0.000000 0
M  V30 14 C -7.428120 1.052800 0.000000 0
M  V30 15 C -3.359160 0.090160 0.000000 0
M  V30 16 C -3.634680 2.811200 0.000000 0
M  V30 17 C -2.729347 1.565387 0.000000 0
M  V30 18 C -1.264760 2.041200 0.000000 0
M  V30 19 C -1.264760 3.581200 0.000000 0
M  V30 20 C -7.583240 2.584773 0.000000 0
M  V30 21 C -7.273000 -0.479360 0.000000 0
M  V30 22 C 0.111533 1.217813 0.000000 0
M  V30 23 C 0.111720 4.404587 0.000000 0
M  V30 24 C 1.506867 2.009280 0.000000 0
M  V30 25 C 0.093800 -0.321813 0.000000 0
M  V30 26 C 1.507053 3.613307 0.000000 0
M  V30 27 C 1.418573 -1.107120 0.000000 0
M  V30 28 C 0.093800 5.944400 0.000000 0
M  V30 29 C -1.248520 -1.076507 0.000000 0
M  V30 30 C 1.400653 -2.646933 0.000000 0
M  V30 31 C 2.760893 -0.352613 0.000000 0
M  V30 32 C -1.266253 -2.616133 0.000000 0
M  V30 33 C 0.058147 -3.401627 0.000000 0
M  V30 34 C 4.441080 -2.222267 0.000000 0
M  V30 35 C 3.646253 -4.768400 0.000000 0
M  V30 36 C 5.911080 -2.681280 0.000000 0
M  V30 37 C 6.248573 -4.183760 0.000000 0
M  V30 38 C 7.073640 -1.576027 0.000000 0
M  V30 39 C 5.453747 -6.729893 0.000000 0
M  V30 40 C 7.772333 -4.685333 0.000000 0
M  V30 41 C 8.608600 -2.042320 0.000000 0
M  V30 42 C 8.960280 -3.607520 0.000000 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 24
M  V30 2 1 2 40
M  V30 3 1 3 14
M  V30 4 2 4 28
M  V30 5 2 5 34
M  V30 6 2 6 35
M  V30 7 1 7 16
M  V30 8 1 7 19
M  V30 9 1 8 30
M  V30 10 1 8 34
M  V30 11 1 8 35 CFG=1
M  V30 12 1 9 28
M  V30 13 1 10 35
M  V30 14 1 10 37
M  V30 15 1 10 39
M  V30 16 1 11 12
M  V30 17 1 11 13
M  V30 18 1 11 14 CFG=3
M  V30 19 1 12 15
M  V30 20 1 13 16
M  V30 21 1 14 20
M  V30 22 1 14 21
M  V30 23 1 15 17
M  V30 24 2 16 17
M  V30 25 1 17 18
M  V30 26 2 18 19
M  V30 27 1 18 22
M  V30 28 1 19 23
M  V30 29 2 22 24
M  V30 30 1 22 25
M  V30 31 2 23 26
M  V30 32 1 23 28
M  V30 33 1 24 26
M  V30 34 2 25 27
M  V30 35 1 25 29
M  V30 36 1 30 27
M  V30 37 1 27 31
M  V30 38 2 29 32
M  V30 39 2 30 33
M  V30 40 1 32 33
M  V30 41 1 34 36
M  V30 42 2 36 37
M  V30 43 1 36 38
M  V30 44 1 37 40
M  V30 45 2 38 41
M  V30 46 2 40 42
M  V30 47 1 41 42
M  V30 END BOND
M  V30 END CTAB
M  END