MMs02983009
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  1  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
    0.0044   -1.5000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.0436   -0.9000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3056   -2.2462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6024   -1.4924    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2925   -2.2538    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5937   -1.5076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7548   -0.0162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2230    0.2914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9692   -1.0099    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9622   -2.1216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2698   -3.5898    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -3.1522   -4.5902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6951   -4.0574    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.2000    0.0035    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0035    1.2000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2000   -0.0035    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8654    0.7893    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7142    1.3862    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3099   -3.7462    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  6  1  0  0  0  0
  4  5  2  0  0  0  0
  4 20  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 11  2  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 19  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
M  CHG  1  12   1
M  CHG  1  14  -1
M  CHG  1  20  -1
M  END