NCID-ZINC04972904
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 16  0  0  1  0  0  0  0  0999 V2000
   -0.0090    1.5480   -0.1680 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0360    0.0240   -0.1570 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5970   -0.3930   -0.9990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4290   -0.4650   -0.1280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6870   -0.9910    1.0080 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6170    2.2350    0.1030 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.9980    1.6200    1.3790 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3800    1.7890   -1.0560 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2780    3.7790    0.1630 N   0  5  0  0  0  0  0  0  0  0  0  0
    0.7420    3.9220    0.9960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3760    1.9190   -1.1320 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6670    1.9280    0.6230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1220   -0.3060   -1.1590 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.7150   -0.4770    1.1080 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1070   -0.7440    1.7040 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3030    0.2750    1.5500 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2800   -1.3120    0.9470 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 11  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 14  1  0  0  0  0
  4  5  2  0  0  0  0
  4 13  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  2  0  0  0  0
  6  9  1  0  0  0  0
  9 10  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
M  CHG  1   9  -1
M  CHG  1  13  -1
M  CHG  1  14   1
M  END