MMs00003015
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 20 20  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
   -0.7438   -1.3026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2438   -1.3097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0000   -0.0142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2561    1.2883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7562    1.2955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0123    2.5838    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -4.5123    2.5767    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2685    3.8864    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -4.4999   -0.0214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2438   -1.3239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7438   -1.3311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4876   -2.6336    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2000    0.0057    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1389   -2.3390    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8389   -2.3518    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1611    2.3375    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1142   -1.7290    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4465   -2.5067    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4999   -0.0356    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3 16  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 18  1  0  0  0  0
 11 19  1  0  0  0  0
 12 13  2  0  0  0  0
 12 20  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  20  -1
M  END