PUBCHEM-ZINC04473005
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 15 15  0  0  0  0  0  0  0  0999 V2000
    0.1610    1.2700    0.2590 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2310   -0.1120    0.1000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4340   -0.6740   -0.3120 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5360    0.0630   -0.5800 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4350    1.4060   -0.4140 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2830    2.0620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2600    3.5540    0.1550 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1680    4.0770    0.5390 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.5350   -2.4370   -0.5510 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.9740   -2.6800    0.3020 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9490   -2.8960    0.8950 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7680    1.7340    0.5830 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6440   -0.7230    0.2970 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3440    1.9610   -0.6350 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3350    4.1740   -0.1120 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 12  1  0  0  0  0
  2  3  2  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3  9  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  5 14  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 15  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  3  0  0  0  0
M  CHG  1   8  -1
M  END