NCID-ZINC01714720
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  0  0  0  0  0  0999 V2000
   -0.0150    1.3400    0.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0100   -0.0530    0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2610   -0.6940    0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4670    0.0170    0.0480 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4240    1.4270    0.1030 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1760    2.0630    0.1090 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0580    3.8610    0.1770 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.4440    4.3190    0.2110 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3350    4.1700   -1.0550 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6150   -0.7660    0.0360 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2670   -2.0350   -0.0190 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5980   -2.3830   -0.0600 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.4060   -3.4220   -0.0560 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.0630   -4.0610   -1.3250 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7230   -2.7930   -0.0070 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9680    1.8650    0.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9130   -0.6240   -0.0300 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3470    1.9960    0.1400 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3060    4.0740    1.4110 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.0200   -4.1610    1.1450 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 16  1  0  0  0  0
  2  3  2  0  0  0  0
  2 17  1  0  0  0  0
  3  4  1  0  0  0  0
  3 12  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5 18  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  2  0  0  0  0
  7 19  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  2  0  0  0  0
 13 20  1  0  0  0  0
M  CHG  1  19  -1
M  CHG  1  20  -1
M  END