KEYORGANICS-ZINC01395179
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 18  0  0  0  0  0  0  0  0999 V2000
   -0.0160    1.3620    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
    1.2080   -0.6960   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3980   -0.0260   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4110    1.3670   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1900    2.0700    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5340    3.4880    0.0050 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8330    3.5830   -0.0070 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4080    2.3080   -0.0170 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3590    2.1190   -0.0270 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6730   -0.7780   -0.0360 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.6610   -1.9960   -0.0420 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7340   -0.1800   -0.0420 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.6280   -0.9630    0.0130 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9570    1.8920    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2030   -1.7760   -0.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8360    4.3120    0.0160 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  9  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7 17  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  13  -1
M  END