MMs03079636
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 20 20  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
   -0.6303    1.3611    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.4789    0.5126    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4694    2.3812    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.3179    3.2298    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7794    1.6506    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.6279    0.8020    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1405    2.2809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3670    1.4173    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4559    1.9216    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2905    3.8705    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.1020    1.6512    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4897    2.7869    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
    0.2669   -1.1700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4548    3.2657    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9913    3.1272    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4893    0.1789    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.5071   -1.0210    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6844    0.0711    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 18  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 12  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4 11  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 18  1  0  0  0  0
  8  9  1  0  0  0  0
  8 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 10  1  0  0  0  0
 12 13  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1  11  -1
M  CHG  1  18   1
M  END