PUBCHEM-ZINC05851695
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 16  0  0  1  0  0  0  0  0999 V2000
   -0.0190    1.5340    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  5  3  0  0  0  0  0  0  0  0  0
   -0.4890   -0.3690   -0.9000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4860   -0.4250   -0.0140 C   0  5  3  0  0  0  0  0  0  0  0  0
    1.8090   -0.5770   -1.0440 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2320    0.7920    0.5860 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4530    1.9950   -0.0010 C   0  5  0  0  0  0  0  0  0  0  0  0
    1.6160    3.2070    0.9190 C   0  5  0  0  0  0  0  0  0  0  0  0
    2.9800    3.6340    0.9080 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7800    4.2700    0.4580 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5330    1.9060   -0.8760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5160    1.8960    0.9100 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1690    0.7860    1.6750 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2720    0.8080    0.2590 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1560    4.4000    1.4710 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8320    5.0730    0.9960 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  7  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
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 15  1  0  0  0  0
 10 16  1  0  0  0  0
M  CHG  1   2  -1
M  CHG  1   4  -1
M  CHG  1   7  -1
M  CHG  1   8  -1
M  END