D0LJ5P
 Wcorina  10100417243D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 19 19  0     0  0  0  0  0  0999 V2000
   -0.0172    1.4168    0.0098 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0021   -0.0041    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1617    2.2101    0.0028 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9002    1.8797   -1.3124 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9297    1.8941    1.4396 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8430    1.0179    1.9980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7255    3.1414    2.0022 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5607    1.3856    3.1176 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4364    3.5211    3.1220 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3633    2.6442    3.6868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1049    3.0321    4.8488 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7128    3.3502    5.8014 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9948    0.0440    1.5565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0078    3.8192    1.5641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2739    0.7009    3.5522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2759    4.4950    3.5605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7531    2.3264   -1.1939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5646    1.7043   -2.2054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2566    3.6347    6.6534 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  4 17  1  0  0  0  0
  4 18  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 13  1  0  0  0  0
  7  9  2  0  0  0  0
  7 14  1  0  0  0  0
  8 10  2  0  0  0  0
  8 15  1  0  0  0  0
  9 10  1  0  0  0  0
  9 16  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  3  0  0  0  0
 12 19  1  0  0  0  0
M  END

$$$$