IFLAB-ZINC02458611
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 25 26  0  0  0  0  0  0  0  0999 V2000
   -0.0130    1.0860    0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7420    1.5850   -1.2130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0660    1.8250   -2.3700 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7670    2.2900   -3.4970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0950    2.4980   -3.4380 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7840    2.2660   -2.3010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1380    1.8050   -1.1740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8980    1.5480    0.0660 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8590    0.5880    0.2140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4280    0.5340    1.4560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9420    1.4500    2.3480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6970    2.4240    1.5770 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3850    1.5940    3.7340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2530    0.8640    4.1730 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1650    2.5080   -4.5370 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0100    1.4630    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5230    1.4370    0.9050 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    1.6600   -2.4210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8500    2.4400   -2.2750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1480   -0.0760   -0.5870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2000   -0.1750    1.7130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5640    2.8190   -4.2240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8310    2.5370    4.5250 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1890    2.5560    5.4230 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  2  3  2  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  3 19  1  0  0  0  0
  4  5  1  0  0  0  0
  4 15  2  0  0  0  0
  5  6  1  0  0  0  0
  5 23  1  0  0  0  0
  6  7  2  0  0  0  0
  6 20  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 12  1  0  0  0  0
  9 10  1  0  0  0  0
  9 21  1  0  0  0  0
 10 11  2  0  0  0  0
 10 22  1  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 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  END