D00KLR
 Wcorina  10100417223D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 17 16  0     0  0  0  0  0  0999 V2000
   -0.0186    1.5178    0.0104 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
    1.3536    1.8869   -0.0007 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8787    1.8625   -1.0669 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5787    5.3014    3.1903 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8599    3.4739    1.7272 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7815    1.9514    1.5980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5035    3.8396    3.0662 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1444    3.8947    1.6798 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4617    3.8772    0.9127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7859    1.5305    1.6454 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1798    1.5481    2.4125 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9017    3.4363    3.8807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5078    3.4188    3.1136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0771    5.7053    2.4115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0004    5.5687    4.0672 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3880   -0.3878   -0.7973 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  7  1  0  0  0  0
  2 17  1  0  0  0  0
  5  8  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
M  END

$$$$