MMs03544653
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 17 17  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
   -1.0788    1.0422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4034    0.3383    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1432   -1.1390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6579   -1.3480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0461   -2.6726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5451   -2.7253    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -3.1854   -2.2177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6408   -1.8545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0539   -0.4126    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -6.5093   -0.0494    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0117    0.6662    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.1818    0.2081    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9115    2.2305    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8549   -3.3713    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4746   -2.7176    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7491   -3.9445    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  5  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
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 17  2  0  0  0  0
  8  9  2  0  0  0  0
  8 15  1  0  0  0  0
  9 10  1  0  0  0  0
  9 16  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
M  CHG  1   7  -1
M  CHG  1  10   1
M  CHG  1  12  -1
M  END