MMs02988836
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 18 18  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   -0.0077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2433   -1.3105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4867   -2.6057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0133   -2.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7566   -1.2952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7699   -3.8932    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.2699   -3.8855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7699   -3.8779    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2300   -3.9086    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -3.7300   -3.9163    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4734   -5.2038    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -3.7433   -1.3182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4866   -2.6211    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5947    1.0423    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1053    1.0285    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9566   -1.2890    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4999   -0.0230    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2 16  1  0  0  0  0
  3  4  2  0  0  0  0
  3 13  1  0  0  0  0
  4  5  1  0  0  0  0
  4 10  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  3  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 13 14  1  0  0  0  0
 13 18  2  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  CHG  1  14  -1
M  END