D0UM1I
 Wcorina  10100417213D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 20 20  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
    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
   -0.6672    4.2359    0.8738 N   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
   -2.1154    1.2892    3.3731 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8988    5.5509    1.1624 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
   -1.1555    3.2421    1.7168 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4309    0.9400    2.3000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8840    3.5682    2.8608 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3507    2.5539    3.6697 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2609   -0.1063    2.0933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0800    4.6008    3.1093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1624    3.9949    0.0814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9156    2.7971    4.5574 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
   -0.5626    5.7833    2.0849 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4863    6.1522    0.4650 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  1  8  1  0  0  0  0
  4  7  1  0  0  0  0
  4  9  1  0  0  0  0
  4 15  1  0  0  0  0
  5 17  1  0  0  0  0
  5 18  1  0  0  0  0
  6 10  2  0  0  0  0
  6 12  1  0  0  0  0
  7 19  1  0  0  0  0
  7 20  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
  9 11  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 16  1  0  0  0  0
M  END

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