BA1598.sdf
  ChemDraw01222615352D

  0  0  0     0  0              0 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS 19 20 0 0 1
M  V30 BEGIN ATOM
M  V30 1 C -0.008612 1.619061 0.000000 0
M  V30 2 N -0.008612 0.794061 0.000000 0
M  V30 3 C 0.705859 0.381561 0.000000 0
M  V30 4 C 1.420330 0.794061 0.000000 0
M  V30 5 C 1.420330 1.619061 0.000000 0
M  V30 6 N 0.705859 2.031561 0.000000 0
M  V30 7 C -0.723083 0.381561 0.000000 0
M  V30 8 C -1.476758 0.717119 0.000000 0
M  V30 9 C -2.028791 0.104024 0.000000 0
M  V30 10 C -1.616291 -0.610447 0.000000 0
M  V30 11 O -0.809319 -0.438919 0.000000 0
M  V30 12 C -1.951849 -1.364122 0.000000 0
M  V30 13 O -1.466926 -2.031561 0.000000 0
M  V30 14 O -2.849272 0.190260 0.000000 0
M  V30 15 O -0.723083 2.031561 0.000000 0
M  V30 16 O 2.134801 2.031561 0.000000 0
M  V30 17 C 2.134801 0.381561 0.000000 0
M  V30 18 C 2.134801 -0.443439 0.000000 0
M  V30 19 Br 2.849272 -0.855939 0.000000 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 2 3
M  V30 3 2 3 4
M  V30 4 1 4 5
M  V30 5 1 5 6
M  V30 6 1 6 1
M  V30 7 1 7 2 CFG=3
M  V30 8 1 7 8
M  V30 9 1 8 9
M  V30 10 1 9 10
M  V30 11 1 10 11
M  V30 12 1 11 7
M  V30 13 1 10 12 CFG=3
M  V30 14 1 12 13
M  V30 15 1 9 14 CFG=1
M  V30 16 2 1 15
M  V30 17 2 5 16
M  V30 18 1 4 17
M  V30 19 2 17 18
M  V30 20 1 18 19
M  V30 END BOND
M  V30 BEGIN COLLECTION
M  V30 MDLV30/STEABS ATOMS=(3 7 9 10)
M  V30 END COLLECTION
M  V30 END CTAB
M  END
$$$$
