NCID-ZINC01690007
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
    0.0580    1.4760    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0230   -0.0280   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0100   -0.7270    1.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500   -2.1260    1.2240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0430   -2.8620    0.0430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0070   -2.1590   -1.1620 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0220   -0.7580   -1.2170 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0480    0.0780   -2.7370 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0010   -2.9320   -2.3780 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.1020   -3.1420   -2.9030 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0930   -3.3370   -2.7920 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.0620   -2.9920    2.8080 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.5900   -4.2580    2.4850 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7100   -2.1000    3.6680 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9650    1.8460   -0.4770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250    1.8870   -0.4890 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0610    1.8620    1.0370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0060   -0.1860    2.1530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0650   -3.9490    0.0710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4920   -3.0660    3.0850 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3 18  1  0  0  0  0
  4  5  1  0  0  0  0
  4 12  1  0  0  0  0
  5  6  2  0  0  0  0
  5 19  1  0  0  0  0
  6  7  1  0  0  0  0
  6  9  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  2  0  0  0  0
 12 20  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  CHG  1  20  -1
M  END