MMs01290121
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 17 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    0.0079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2431    1.3108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4863    2.6059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0136    2.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7568    1.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2568    1.2872    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -3.0000   -0.0157    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0136    2.5823    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.4842    3.7259    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8577    3.1230    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7087    1.6304    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8287    0.6326    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5945   -1.0424    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1054   -1.0282    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6191    3.6341    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9680    1.0094    0.0000 H   0  0  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 12  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 16  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 17  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  END