MMs02552247
  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
   -1.5000    0.0087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2424    1.3121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7424    1.3208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4849    2.6067    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0789    3.6494    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0151    2.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7726    3.8927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7575    1.2947    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2575    1.2860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9999   -0.0174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2424   -1.3121    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2575   -1.2860    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -3.7575   -1.2773    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5150   -2.5893    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5940   -1.0427    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0560    2.4689    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3875    1.6899    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4999   -0.0261    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0939   -1.0688    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  9  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 11 12  2  0  0  0  0
 11 19  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1  13   1
M  CHG  1  15  -1
M  END