PUBCHEM-ZINC04507480
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 19  0  0  1  0  0  0  0  0999 V2000
    0.0610    1.5020   -0.0360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0070   -0.0390   -0.0700 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5380   -0.4450   -0.9300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4420   -0.5650   -0.0480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9240   -1.0030    0.9980 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0960   -0.5360   -1.2520 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4580   -1.0380   -1.4490 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8800   -1.0160   -2.9340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0120   -0.5030   -3.7060 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7260    2.0090    0.6560 S   0  5  0  0  0  0  0  0  0  0  0  0
   -0.1120    1.8890   -1.0470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7610    1.8950    0.5770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6880   -0.1680   -2.1130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5050   -2.0610   -1.0610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1350   -0.4090   -0.8620 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0150   -1.5070   -3.1890 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.7200   -0.5260    1.1520 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0710   -0.5700    1.9460 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4120    0.2510    1.3250 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2100   -1.4110    1.0210 H   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  4  1  0  0  0  0
  2 17  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 13  1  0  0  0  0
  7  8  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
  8  9  2  0  0  0  0
  8 16  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 17 20  1  0  0  0  0
M  CHG  1  10  -1
M  CHG  1  16  -1
M  CHG  1  17   1
M  END