PUBCHEM-ZINC06482244
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  1  0  0  0  0  0999 V2000
   -0.0180    1.4480    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5980   -0.6000   -1.0430 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0880    0.0700   -1.9210 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6580   -2.1040   -1.1200 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3850   -2.5200   -2.4000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4450   -4.0470   -2.4780 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.9030   -4.4400   -1.5700 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2660   -4.4570   -3.6730 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7180   -4.8000   -4.6940 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0840   -4.5850   -2.6110 N   0  5  0  0  0  0  0  0  0  0  0  0
   -0.3620   -4.2350   -3.4460 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0050    1.8250    0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5450    1.8090   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5280    1.7990    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1950   -2.4910   -0.2540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3550   -2.5070   -1.1290 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8480   -2.1330   -3.2650 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3970   -2.1170   -2.3900 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6070   -4.4420   -3.6030 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0910   -4.7130   -4.3950 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  5 17  1  0  0  0  0
  6  7  1  0  0  0  0
  6 18  1  0  0  0  0
  6 19  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 11  1  0  0  0  0
  9 10  2  0  0  0  0
  9 20  1  0  0  0  0
 11 12  1  0  0  0  0
 20 21  1  0  0  0  0
M  CHG  1  11  -1
M  END