NCID-ZINC01688660
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 17  0  0  0  0  0  0  0  0999 V2000
   -0.0160    1.3580    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
    1.2270   -0.7010   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4160    0.0370   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3770    1.4300   -0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1660    2.0840    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6380    2.2050   -0.0200 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.6040    3.4230   -0.0130 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7090    1.6260   -0.0330 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.7610   -1.0980   -0.0390 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.6800   -2.4180   -0.0350 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4620   -2.0270   -0.0220 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9620    1.8790    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9280   -0.5530    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1360    3.1640    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9850   -3.4540   -0.0440 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 13  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 12  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6 15  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 16  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  END