PUBCHEM-ZINC05426313
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 16  0  0  1  0  0  0  0  0999 V2000
   -0.0960    1.4770    0.1580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0540   -0.0360    0.0250 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.2170   -0.3070   -1.0050 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9570   -0.6310    0.9330 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0460    0.0330    1.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2820    1.2660    0.5280 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2890    2.0270   -0.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5220    3.1080   -0.5660 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3860   -0.6090    1.9630 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4420   -0.6580    0.3290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1560   -0.0480    1.1770 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7640    1.9120   -0.5930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4380    1.7970    1.1490 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2110    1.6570    0.5300 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9250    0.5580    2.3340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7170   -1.6970   -0.3410 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  7  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 10  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  5  9  1  0  0  0  0
  6  7  1  0  0  0  0
  6 14  1  0  0  0  0
  7  8  2  0  0  0  0
  9 15  1  0  0  0  0
 10 11  2  0  0  0  0
 10 16  1  0  0  0  0
M  CHG  1  16  -1
M  END