NCID-ZINC01676462
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 16  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3790    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2090   -0.6790   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3970    0.0280   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3780    1.4110   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1710    2.0860    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1510    3.5660    0.0100 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0880    4.1610    0.0240 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1970    4.1900    0.0040 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.0030    2.3790   -0.0230 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.6880   -0.6950   -0.0360 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.7050   -1.9120   -0.0430 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7350   -0.0710   -0.0430 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.6220   -0.9720    0.0130 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9590    1.9060    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2240   -1.7590   -0.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 15  1  0  0  0  0
  2  3  2  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3 16  1  0  0  0  0
  4  5  2  0  0  0  0
  4 11  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  11   1
M  CHG  1  13  -1
M  END