D0V8FG
 Wcorina  10100417263D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 15 16  0     0  0  0  0  0  0999 V2000
   -0.0190    1.5512    0.0106 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3566   -4.0370   -0.0313 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.3150   -2.7502   -0.0087 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0021   -0.0041    0.0020 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8923   -2.9110   -0.0212 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.5078    1.8475   -0.0024 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2559   -0.4270   -0.0122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7952   -1.7380   -0.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1775    0.7062   -0.0149 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1385   -1.9157   -0.0374 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5708    0.4454   -0.0292 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0186   -0.8335   -0.0395 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5372   -2.9194   -0.0463 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2744    1.2648   -0.0314 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0824   -1.0194   -0.0496 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  6  1  0  0  0  0
  2  5  1  0  0  0  0
  3  5  2  0  0  0  0
  4  7  2  0  0  0  0
  5  8  1  0  0  0  0
  6  9  2  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 12  2  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
M  CHG  2   2  -1   5   1
M  END

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