NCID-ZINC01587149
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 17  0  0  1  0  0  0  0  0999 V2000
   -0.1490    1.5880    0.2700 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0380    0.0850    0.0660 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.9220   -0.4400    0.1580 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9410   -0.5470    1.1730 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7620   -1.4230    0.7620 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3430   -0.4280   -2.3020 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3540   -0.7520   -3.6470 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0460   -1.8130   -3.6610 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8580    2.2830   -0.4800 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1210    1.5940   -1.1420 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1160    1.9050   -0.1370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0880    1.9160    1.3100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0080    0.4340   -2.4280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9480   -1.2970   -2.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7090   -0.1640    2.3560 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.6780   -0.1360   -1.2710 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2680   -0.9830   -1.1580 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1150    0.0600   -4.5890 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  9  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 16  1  0  0  0  0
  4  5  2  0  0  0  0
  4 15  1  0  0  0  0
  6  7  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
  6 16  1  0  0  0  0
  7  8  2  0  0  0  0
  7 18  1  0  0  0  0
  9 10  1  0  0  0  0
 16 17  1  0  0  0  0
M  CHG  1  15  -1
M  CHG  1  18  -1
M  END