PUBCHEM-ZINC04096456
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  1  0  0  0  0  0999 V2000
   -0.0660    1.3170    0.1120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0330   -0.0070    0.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4440   -0.4620    0.0230 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.6970   -0.9650   -0.9160 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1690    0.7890    0.0720 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2990    1.8310    0.1670 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5970    3.0110    0.2600 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8120   -1.2750    1.2570 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2250   -1.8510    1.1940 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7130   -2.0490    0.0480 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1560   -0.9390   -0.1460 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2850   -0.4240    0.0990 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9550    1.9250    0.1200 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7360   -0.6530    2.1590 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1320   -2.1260    1.3800 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7400   -2.0860    2.3270 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8780   -2.1110   -0.5220 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2 11  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  8  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  8  9  1  0  0  0  0
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
  9 10  2  0  0  0  0
  9 16  1  0  0  0  0
 11 12  1  0  0  0  0
 11 17  2  0  0  0  0
M  CHG  1  12  -1
M  CHG  1  16  -1
M  END