PUBCHEM-ZINC02545318
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 17  0  0  0  0  0  0  0  0999 V2000
    0.0480    1.3350   -0.0940 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0150    0.0090    0.0730 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2900   -0.7830    0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2780   -1.7740   -1.1520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5590   -2.5530   -1.2140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4300   -2.4820   -2.2320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7370   -3.2830   -2.2690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9680   -4.0370   -1.2830 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9990    1.8550   -0.0420 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8400    1.9280   -0.2880 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9020   -0.5440    0.2670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4070   -1.3200    0.9640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1550   -0.1130   -0.0750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1070   -1.2380   -2.0940 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4470   -2.4810   -1.0380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7770   -3.2130   -0.3750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2330   -1.8330   -3.0800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4290   -3.0760   -3.3070 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 10  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 12  1  0  0  0  0
  3 13  1  0  0  0  0
  4  5  1  0  0  0  0
  4 14  1  0  0  0  0
  4 15  1  0  0  0  0
  5  6  2  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  7 18  2  0  0  0  0
M  CHG  1   8  -1
M  END