D00SJT
 Wcorina  10100417213D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 17 17  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
   -3.0614    3.0094    4.7798 F   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
   -1.8429    1.0204    1.9996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7276    3.1399    2.0038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5592    1.3937    3.1210 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4423    3.5153    3.1254 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3614    2.6432    3.6839 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9970    0.0459    1.5604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0106    3.8200    1.5680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2731    0.7113    3.5580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2845    4.4887    3.5658 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
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2 11  1  0  0  0  0
  5 16  1  0  0  0  0
  5 17  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 12  1  0  0  0  0
  8 10  2  0  0  0  0
  8 13  1  0  0  0  0
  9 11  2  0  0  0  0
  9 14  1  0  0  0  0
 10 11  1  0  0  0  0
 10 15  1  0  0  0  0
M  END

$$$$