IBS-ZINC00501234
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0190    1.5300    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
    1.7750   -0.4180   -0.0170 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.3540    1.2510   -0.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9990    1.7250   -0.0280 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3170    2.0830    0.0010 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5240    3.5330    0.0060 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6080    4.0240    1.4290 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5060    3.2420    2.3440 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5560    1.8830   -0.8700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5390    1.8740    0.9040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4730   -0.3980    0.9010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4900   -0.3880   -0.8920 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4510    3.7700   -0.5150 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6890    4.0210   -0.4980 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7970    5.3290    1.6790 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8440    5.5960    2.6070 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  1  0  0  0  0
  2 12  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  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
  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
 16 17  1  0  0  0  0
M  END