IBS-ZINC01481960
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0180    1.5030    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
    0.0230   -0.7020    1.2000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0410   -2.0200    1.1980 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0380   -2.6830    0.0440 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0170   -1.9800   -1.1590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0050   -0.6570   -1.1480 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0330    0.0600   -2.3690 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0590   -4.1630    0.0380 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0570   -4.7670   -1.0150 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0040    1.8800    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8640   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8540    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0250   -0.1640    2.1370 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0150   -2.5140   -2.0970 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0800   -4.8410    1.2020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0930   -5.8060    1.1480 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3 14  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  9  1  0  0  0  0
  6  7  1  0  0  0  0
  6 15  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  2  0  0  0  0
  9 16  1  0  0  0  0
 16 17  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   8  -1
M  END