IFLAB-ZINC02458579
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  0  0  0  0  0  0999 V2000
   -0.1140    1.3510    0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1020   -0.0770    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1770   -0.6110   -0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3450    0.6540   -0.0200 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.1580    1.8790    0.0060 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5410    3.2750    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6880    3.7140   -0.0040 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5630   -2.0110   -0.0260 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8410   -2.5500   -0.0560 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8480   -3.9780   -0.0630 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5720   -4.4890   -0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3880   -3.2750   -0.0060 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2790   -5.9230   -0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2720   -6.7200   -0.0630 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.0190    1.9450    0.0390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0050   -0.6760    0.0210 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6940    3.9830    0.0280 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7470   -1.9570   -0.0730 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7420   -4.5920   -0.0850 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0590   -6.2820   -0.0120 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  2  0  0  0  0
  1 15  1  0  0  0  0
  2  3  2  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 17  1  0  0  0  0
  8  9  2  0  0  0  0
  8 12  1  0  0  0  0
  9 10  1  0  0  0  0
  9 18  1  0  0  0  0
 10 11  2  0  0  0  0
 10 19  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 20  2  0  0  0  0
M  CHG  1  14  -1
M  END