MMs00010533
  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
    0.7571    1.2949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2571    1.2867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0142    2.5816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2713    3.8847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7713    3.8930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0142    2.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4858    2.6062    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.2429    1.3113    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2286    3.9094    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.0284    5.1797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0359    0.6057    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6057   -1.0359    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0359   -0.6057    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8514    0.2442    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2142    2.5751    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1770    4.9354    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2284    5.1731    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3 15  1  0  0  0  0
  4  5  1  0  0  0  0
  4 16  1  0  0  0  0
  5  6  2  0  0  0  0
  5 11  1  0  0  0  0
  6  7  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 11 18  1  0  0  0  0
M  CHG  1   8   1
M  CHG  1  10  -1
M  END