MMs01226733
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  0  0  0  0  0  0999 V2000
    0.0000   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.0084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9714   -1.4156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7628   -2.3041    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.4556   -1.4291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8796   -1.9006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3351   -3.3297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8351   -3.3381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3066   -1.9141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0980   -1.0257    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.7357   -1.4585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8448   -2.4684    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -3.4006   -1.8712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7206   -3.3367    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.7107    0.9669    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1999    0.9831    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6244   -4.2966    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5350   -4.3128    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0557    0.0069    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5097   -0.8613    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  2  0  0  0  0
  1 15  1  0  0  0  0
  2  3  2  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3 13  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 10  1  0  0  0  0
  7  8  1  0  0  0  0
  7 17  1  0  0  0  0
  8  9  2  0  0  0  0
  8 18  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 19  2  0  0  0  0
 13 14  1  0  0  0  0
 13 20  2  0  0  0  0
M  CHG  1  12  -1
M  CHG  1  14  -1
M  END