NCID-ZINC01677331
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 17  0  0  1  0  0  0  0  0999 V2000
   -0.1810    1.6750    0.0820 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0030    0.1600   -0.0040 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5710   -0.1540    0.8830 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7830   -0.2500   -1.2740 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.3620    0.2040   -2.1770 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2990    0.0720   -1.1270 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9540   -0.9860   -0.8390 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3510   -0.5790    0.0840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2640   -1.7990   -0.3020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7800    2.1960    0.1200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7410    2.0540   -0.7790 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7290    1.9580    0.9870 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6720    1.2460   -1.3610 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.6670   -1.7500   -1.4730 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.6430   -2.0400   -2.4480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2260   -2.0870   -0.9640 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5310   -2.1180   -1.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3480    0.0540    0.5070 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 10  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  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4 14  1  0  0  0  0
  6  7  2  0  0  0  0
  6 13  1  0  0  0  0
  8  9  2  0  0  0  0
  8 18  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
M  CHG  1  13  -1
M  CHG  1  14   1
M  CHG  1  18  -1
M  END