D04MKQ
 Wcorina  10100417263D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 20 20  0     1  0  0  0  0  0999 V2000
   -0.0212    1.7157    0.0115 P   0  3  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
    1.2361    2.4647    0.0035 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2492    2.5476    1.3644 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6532    2.6286    0.0242 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.4234    4.0736   -0.3368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5763    4.4919   -1.6455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0651    4.9819    0.6417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3654    5.8173   -1.9766 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8542    6.3073    0.3106 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0020    6.7245   -0.9990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3285    2.1758   -0.7018 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8602    3.7830   -2.4092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9502    4.6561    1.6650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4842    6.1439   -2.9991 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5747    7.0170    1.0752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4725    1.5931    1.6037 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6418    2.9611    2.0559 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8369    7.7600   -1.2577 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4564   -0.3954    0.7607 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  5  1  0  0  0  0
  2 20  1  0  0  0  0
  4  5  1  0  0  0  0
  4 17  1  0  0  0  0
  4 18  1  0  0  0  0
  5  6  1  0  0  0  0
  5 12  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 13  1  0  0  0  0
  8 10  2  0  0  0  0
  8 14  1  0  0  0  0
  9 11  2  0  0  0  0
  9 15  1  0  0  0  0
 10 11  1  0  0  0  0
 10 16  1  0  0  0  0
 11 19  1  0  0  0  0
M  CHG  1   1   1
M  END

$$$$