MMs03607636
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 20 19  0  0  1  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
    1.3019    0.7450    0.0000 S   0  3  0  0  0  0  0  0  0  0  0  0
    1.3066    1.9449    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5981   -0.0101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9000    0.7349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1961   -0.0202    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.2353   -0.6202    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4981    0.7248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7942   -0.0303    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5039    2.2248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1903   -1.5202    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    4.1487   -2.1161    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5960    1.0416    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0416   -0.5960    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5960   -1.0416    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8231   -0.9263    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3658   -0.9323    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1322    1.6571    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6749    1.6511    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5454    2.8207    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 16  1  0  0  0  0
  4 17  1  0  0  0  0
  5  6  1  0  0  0  0
  5 18  1  0  0  0  0
  5 19  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 11  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 20  1  0  0  0  0
 11 12  1  0  0  0  0
M  CHG  1   2   1
M  CHG  1  11  -1
M  END