NCID-ZINC01616555
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 19  0  0  0  0  0  0  0  0999 V2000
   -0.0530    0.9730   -0.6560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1170   -0.3490    0.1640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6250   -1.1670   -0.3610 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4380   -0.3960    0.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4190    1.1420   -0.1760 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3670    1.7500   -1.2080 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7100    1.0580   -2.2130 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6440   -0.1860    1.5860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1720    0.8150    2.2390 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1610    0.8150   -1.7370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7540    1.7610   -0.3620 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9770   -0.7550    0.9250 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7810   -0.9820   -0.8200 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7430    2.9390   -0.9450 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.5010    1.8850    1.1270 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4290    2.8930    0.9440 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3880    1.7220    1.6040 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7100    1.5540    1.7980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4810   -1.0300    2.0140 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  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 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5  6  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  2  0  0  0  0
  6 14  1  0  0  0  0
  8  9  2  0  0  0  0
  8 19  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
M  CHG  1  14  -1
M  CHG  1  15   1
M  CHG  1  19  -1
M  END