D0T1EO
 Wcorina  10100417213D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
  7  6  0     1  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
    1.3615    1.8562   -0.0010 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5066    1.8922   -1.5271 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6950    1.1836   -2.1622 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6041    2.8200   -1.7926 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2718   -0.3984    0.8427 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  1  0  0  0  0
  2  7  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
M  END

$$$$