MMs02264902
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 18 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
    1.4196    0.4846    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5490   -0.5025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2589   -1.9741    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9686   -0.0178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1950   -0.8814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3954    0.0181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9108    1.4377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4109    1.4155    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6913    2.3757    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8287   -0.4242    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    8.9284    0.5959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1622   -1.8867    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.3877    1.1356    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1356   -0.3877    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3877   -1.1356    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2128   -2.0813    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6016    2.4188    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  9  1  0  0  0  0
  6  7  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  2  0  0  0  0
  7 11  1  0  0  0  0
  8  9  1  0  0  0  0
  8 18  1  0  0  0  0
  9 10  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  13  -1
M  END