PUBCHEM-ZINC05428849
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3770    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
    1.2150   -0.6800   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4060    0.0350   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3800    1.4160   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1700    2.0860    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6480    2.1790   -0.0200 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.7140    1.5890   -0.0330 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6260    3.3970   -0.0140 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.2380   -2.0780   -0.0200 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1650   -2.7210   -0.0130 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7210   -3.2520   -0.0070 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9600    1.9040    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9250   -0.5570    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3510   -0.4880   -0.0320 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1530    3.1660    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0850   -2.5500   -0.0310 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 10  1  0  0  0  0
  4  5  2  0  0  0  0
  4 15  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6 16  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
 10 17  1  0  0  0  0
 11 12  3  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  11   1
M  END