NCID-ZINC01701054
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 19  0  0  1  0  0  0  0  0999 V2000
    0.0630    1.7270   -0.1400 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0070    0.2070    0.0050 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.5380   -1.3570    1.0080 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.3360   -2.3050    0.4980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6300   -1.1330    2.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8240   -0.2830    1.5570 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9650   -1.3560    1.6250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5210   -0.2160    1.6960 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7710   -0.5620   -1.1470 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7490   -1.8320   -1.1300 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0980    2.0870   -0.1800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4240    2.0540   -1.0660 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4360    2.2420    0.6900 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0740   -0.5030    2.9860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3310   -2.0810    2.6650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4250   -0.2170    0.0590 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0090    0.5200    0.4750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3850   -2.4810    2.0190 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.3630    0.1830   -1.9920 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  6  1  0  0  0  0
  2  9  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  7  1  0  0  0  0
  3 16  1  0  0  0  0
  5  6  1  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  0  0  0  0
  7  8  2  0  0  0  0
  7 18  1  0  0  0  0
  9 10  2  0  0  0  0
  9 19  1  0  0  0  0
 16 17  1  0  0  0  0
M  CHG  1  18  -1
M  CHG  1  19  -1
M  END