IFLAB-ZINC03865752
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 19  0  0  1  0  0  0  0  0999 V2000
   -0.0140    1.4840    0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0540   -0.0310    0.0730 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4600   -0.4680   -0.9360 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9850   -0.8250   -2.2580 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3220   -1.3400   -0.1670 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1850    1.1580   -1.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4360    1.9750    0.0420 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.8520    1.7930    1.0410 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4510    3.3520   -0.2870 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6190    4.2990    0.3560 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.4100    5.5880   -0.2960 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3240    4.2830    1.7870 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4990    1.8090   -0.9210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6020    1.9030    0.8310 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2530   -0.3740    1.0930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8460   -0.5110   -0.3150 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2540    1.0870   -0.7960 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0430    1.5620   -2.0140 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8580    3.6210   -0.0170 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 13  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  2 15  1  0  0  0  0
  2 16  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  2  0  0  0  0
  3  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 17  1  0  0  0  0
  6 18  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  2  0  0  0  0
 10 19  1  0  0  0  0
M  CHG  1  19  -1
M  END