SPECS-ZINC05045721
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 12 12  0  0  0  0  0  0  0  0999 V2000
   -0.0160    1.3340    0.0090 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
    1.2550   -0.5700   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2650    0.3530   -0.0180 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5680    1.9670   -0.0020 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.6960    0.0460   -0.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0690   -1.1120   -0.0420 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5850   -2.6390   -0.0270 I   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7500   -1.1520    0.0130 I   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9140    1.9340    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6000    1.0470   -0.0360 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5190    0.7460   -0.0460 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  5  1  0  0  0  0
  1 10  1  0  0  0  0
  2  3  1  0  0  0  0
  2  9  1  0  0  0  0
  3  4  2  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
M  END