PUBCHEM-ZINC05828157
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 16  0  0  0  0  0  0  0  0999 V2000
    0.1420    1.7580    0.5350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1440    0.4110   -0.0800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1850   -0.6330    0.5680 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4990    2.2530    0.1350 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8710    2.7090   -1.0770 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2850    3.1690   -1.2170 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1850    2.7460   -0.4900 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7120    4.2500   -2.2130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8960    5.2160   -2.3520 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9710    2.7340   -2.3270 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5470    2.4100   -3.4050 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.6550    2.4590    0.2750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3310    0.4030   -1.1670 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1110    1.6480    1.6260 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2320    2.2600    0.9410 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8540    4.1220   -2.7610 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2580    2.9560   -2.1200 O   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 12  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 13  1  0  0  0  0
  4  5  2  0  0  0  0
  4 15  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 16  2  0  0  0  0
 10 11  1  0  0  0  0
 10 17  2  0  0  0  0
M  CHG  1   9  -1
M  CHG  1  11  -1
M  END