IFLAB-ZINC03865751
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  1  0  0  0  0  0999 V2000
   -0.0190    1.5460    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3390   -0.3910    1.1940 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.1530   -1.4310    0.6680 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7870   -0.5160    2.4980 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2280    1.2020    1.0580 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4490    2.0060   -0.0010 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.8810    1.8300   -0.9860 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5180    3.4000    0.3080 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6220    4.1440   -0.4310 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.6770    5.4460    0.1360 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7390    3.2660   -0.4730 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5340    1.9180   -0.8760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5160    1.9080    0.9100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9510   -0.4060    0.3460 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2470   -0.3820   -0.9900 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2170    1.7240    2.0150 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2540    1.0360    0.7290 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1600    4.3210   -1.8700 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7940    4.7870   -2.4320 H   0  0  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
 19 20  1  0  0  0  0
M  END