NCID-ZINC01684999
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  1  0  0  0  0  0999 V2000
   -0.0590    1.5170   -0.1330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1320   -0.0120   -0.0060 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3110   -0.5610    1.3540 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.2740   -0.1020    2.1600 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0870   -0.2380    1.6290 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.0880    1.8140    1.5830 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3570    2.0960   -0.0670 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.9940    1.6380   -0.8330 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4130    3.6290   -0.2360 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3730    4.2730    0.0880 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1930   -2.0950    1.4760 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2510   -2.7550    0.3980 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5010    1.7960   -1.0990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7070    1.9690    0.6300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1730   -0.3160   -0.1790 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4480   -0.4660   -0.8220 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4930    4.0740   -0.7290 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0060   -2.5250    2.6540 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  1  0  0  0  0
  3  5  1  0  0  0  0
  3 11  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 17  1  0  0  0  0
 11 12  2  0  0  0  0
 11 18  1  0  0  0  0
M  CHG  1  17  -1
M  CHG  1  18  -1
M  END