IFLAB-ZINC01802839
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 15 15  0  0  0  0  0  0  0  0999 V2000
   -0.0220    1.8050    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.7110   -0.4120   -1.6120 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4330    0.1400   -1.6960 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.3070    1.9430   -1.6150 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6670    2.4530   -0.0010 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.6710    2.5490   -1.8260 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4850    1.9790   -2.5130 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5530    2.1640   -0.8700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5360    2.1550    0.9080 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6700   -1.4900   -1.7630 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1350    0.0830   -2.3950 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6340    2.2940   -2.3970 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9810    3.7210   -1.2500 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8680    4.0700   -1.4140 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  9  1  0  0  0  0
  1 10  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  1  0  0  0  0
  3 12  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 13  1  0  0  0  0
  7  8  2  0  0  0  0
  7 14  1  0  0  0  0
 14 15  1  0  0  0  0
M  END