PUBCHEM-ZINC06360532
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 18  0  0  1  0  0  0  0  0999 V2000
    0.6410    0.6790   -0.5970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1390    0.1770    0.6240 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5390   -0.2780    1.3550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2980   -0.7750    0.3120 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.6390   -1.2760    1.2230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0070   -1.7960   -0.8010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6860   -1.5270   -1.8450 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7690    1.3300    1.2560 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.9890    1.3260 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6590    1.7340   -0.1540 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2710    2.4290    0.8410 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1590   -0.1460   -1.0960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0270    1.1630   -1.3190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2050   -2.7220   -0.5330 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.4620    0.1200   -0.0930 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.4740    0.0280   -1.1320 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2180    1.0700    0.2430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3550   -0.2010    0.2810 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7190    1.7950   -0.8290 O   0  5  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 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4 15  1  0  0  0  0
  6  7  2  0  0  0  0
  6 14  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  2  0  0  0  0
 10 19  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
M  CHG  1  14  -1
M  CHG  1  15   1
M  CHG  1  19  -1
M  END