PUBCHEM-ZINC05819299
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  0  0  0  0  0  0999 V2000
   -0.0190    1.3520    0.4840 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0330   -0.1560    0.2930 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6010   -0.5260   -1.0800 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6320   -2.0200   -1.2960 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1690   -2.6290   -2.1880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1980   -4.0430   -2.4870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0020   -4.5790   -3.4120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6770   -2.7890   -0.4540 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8760   -2.4410   -0.6550 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9810    1.7910    0.4110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6570    1.8220   -0.2720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4260    1.5950    1.4700 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6470   -0.5930    1.0900 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9780   -0.5660    0.4040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0010   -0.0420   -1.8590 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6150   -0.1200   -1.1880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8690   -2.0170   -2.7540 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4620   -4.6990   -1.9230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6850   -3.9770   -4.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9890   -5.6490   -3.5950 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2070   -3.6490    0.3430 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 10  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 13  1  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3 15  1  0  0  0  0
  3 16  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  5 17  1  0  0  0  0
  6  7  2  0  0  0  0
  6 18  1  0  0  0  0
  7 19  1  0  0  0  0
  7 20  1  0  0  0  0
  8  9  1  0  0  0  0
  8 21  2  0  0  0  0
M  CHG  1   9  -1
M  END