PUBCHEM-ZINC05178357
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 17  0  0  0  0  0  0  0  0999 V2000
    0.0650    0.9790    0.1660 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0780   -0.3510    0.3280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1270   -1.0570    0.7530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4970   -2.3310    0.5370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7890   -3.2640   -0.1780 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7030   -2.7720    1.0250 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3580   -1.1990    0.1700 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1890   -2.2280   -0.5730 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.1780    1.8070   -0.3640 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0560    1.3570   -1.0950 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2190    3.3240   -0.1200 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2400    3.7920    0.5480 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8320    1.5530    0.3810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8430   -0.4410    1.2960 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1070   -2.8620   -0.4500 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7100   -3.6900    0.7020 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3420   -0.8830    0.8920 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1940    3.9830   -0.6000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  9  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  1  0  0  0  0
  3  4  2  0  0  0  0
  3 14  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5 15  1  0  0  0  0
  6 16  1  0  0  0  0
  7  8  1  0  0  0  0
  7 17  2  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 18  2  0  0  0  0
M  CHG  1   8  -1
M  CHG  1  12  -1
M  END