IFLAB-ZINC04228028
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  1  0  0  0  0  0999 V2000
   -0.0190    1.5240    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0920   -0.5660    1.3480 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.6810    0.1580    0.8430 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.1020   -0.4220    0.0210 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4550    1.5730    0.3940 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4200    2.3080    0.3920 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3100    2.0940    0.0010 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6500    0.1440    2.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9630   -1.2810    2.4030 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4640   -2.1920    1.7860 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5590    1.8740   -0.8690 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5420    1.8650    0.9040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0060   -0.3860    0.1610 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3840   -0.3610   -0.9540 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3680    2.9970   -0.3480 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5700    0.6580    1.7500 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1920    0.6520    2.8770 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7980   -1.5380    3.4220 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9680   -2.4680    3.6260 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2 14  1  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  9  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8 16  1  0  0  0  0
  9 10  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
 10 11  2  0  0  0  0
 10 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  END