MMs00449138
  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
    1.3025   -0.7440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3094   -2.2440    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5980    0.0120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9005   -0.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1961    0.0239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1892    1.5239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8867    2.2679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5911    1.5119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4986   -0.7201    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    7.7941    0.0359    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5055   -2.2201    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5952    1.0420    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0420    0.5952    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5952   -1.0420    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9060   -1.9320    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2257    2.1287    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8812    3.4679    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2887    2.2560    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2831    3.4559    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  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  9  2  0  0  0  0
  5  6  2  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  6 10  1  0  0  0  0
  7  8  2  0  0  0  0
  7 17  1  0  0  0  0
  8  9  1  0  0  0  0
  8 18  1  0  0  0  0
  9 19  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  END