PUBCHEM-ZINC02558026
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 19  0  0  1  0  0  0  0  0999 V2000
    0.0880    1.5270    0.0480 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0710    0.0200    0.0240 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.1720   -0.4650   -0.9170 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030    0.7800    0.0720 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.9650    0.7940   -0.8580 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2120    0.8150    1.3060 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2590   -0.2710    1.9920 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4760   -0.7510    1.2070 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.6510   -0.0670    2.0480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8510   -1.4400    0.9350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9230   -2.6030    1.4420 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1800    2.0490   -0.8640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2200    2.0470    0.9490 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7970    1.8960    1.6100 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.6970   -0.7830    0.2740 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5410   -1.7280    1.7320 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1420   -2.2440    2.5200 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4260   -1.1690    2.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8140   -2.3960    1.0120 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  4  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  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
  6  7  2  0  0  0  0
  6 14  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 16  1  0  0  0  0
 10 11  2  0  0  0  0
 10 15  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
M  CHG  1  14  -1
M  CHG  1  15  -1
M  CHG  1  16   1
M  END