PUBCHEM-ZINC06184884
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 13 12  0  0  1  0  0  0  0  0999 V2000
    0.1000    1.5590   -0.0430 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0180    0.0430   -0.0130 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.6450   -0.4430   -0.7670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4390   -0.4690   -0.1920 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8060   -1.1870    0.7990 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0540   -0.1510   -1.2430 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.4530   -0.4330    1.2870 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4960    2.0950   -0.3570 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1460    1.4930   -1.2590 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8250    3.1310    0.2950 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.5620    1.9710   -0.8150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2290    1.9690    0.9200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3440   -0.9550    1.5770 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  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  7  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  7 13  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
M  CHG  1   6  -1
M  CHG  1  10  -1
M  END