NCID-ZINC01608858
  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
    1.2070   -0.6800   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4000    0.0320   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3780    1.4200   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1690    2.0900    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1440    3.5690    0.0100 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0790    4.1600    0.0230 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1880    4.1960    0.0030 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.6210   -0.6480   -0.0350 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2340   -2.7750   -0.0230 I   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9600    1.9050    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9260   -0.5560    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3040    1.9760   -0.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6360   -1.6180   -0.0400 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4530   -0.1500   -0.0400 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 12  1  0  0  0  0
  2  3  2  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  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 14  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
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  END