PUBCHEM-ZINC05134581
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  1  0  0  0  0  0999 V2000
   -0.2480    1.1390    0.2670 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1620   -0.3500    0.1670 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5750    0.0860    0.6350 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.2490    1.4930    0.0650 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.4720    1.5970   -1.0090 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7920    2.6980    0.7920 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9840    3.6420    1.0650 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8690   -0.1340    2.1300 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0900    0.3770    2.9960 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9250    1.4900   -0.5170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6680    1.4180    1.2400 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3870   -1.0250    0.8300 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0960   -0.7440   -0.8560 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0490    2.7270    0.9930 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.8550   -0.9050    2.3960 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.5720   -0.5530   -0.2610 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0180   -1.3020    0.2900 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3590    0.0880   -0.4040 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 10  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  1  0  0  0  0
  2 12  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  1  0  0  0  0
  3 16  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  2  0  0  0  0
  8 15  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
M  CHG  1  14  -1
M  CHG  1  15  -1
M  END