D0K1XK
 Wcorina  10100417233D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 20 21  0     0  0  0  0  0  0999 V2000
   -0.0164    1.3618    0.0095 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3336    1.4382   -0.0125 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4628    2.0427   -0.0205 N   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
    1.1698    3.4844    0.0091 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4252    4.1463    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1735    2.0705    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0080    4.2379    0.0249 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4671    5.5460    0.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0684    5.5999    0.0314 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5857    3.3497   -0.0151 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2996    6.2503    0.0227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9695    3.7460    0.0314 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4154    6.0629    0.0011 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5638    3.8076   -0.0220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8406    6.1830    0.0436 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3303    7.3298    0.0285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8630    1.8353    0.0161 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5405   -0.3627    0.7764 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9349   -0.3784    0.0090 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  7  1  0  0  0  0
  1 18  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3 11  2  0  0  0  0
  4 19  1  0  0  0  0
  4 20  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  2  0  0  0  0
  6  9  2  0  0  0  0
  6 11  1  0  0  0  0
  8 10  1  0  0  0  0
  8 13  1  0  0  0  0
  9 12  1  0  0  0  0
  9 14  1  0  0  0  0
 10 12  2  0  0  0  0
 10 16  1  0  0  0  0
 11 15  1  0  0  0  0
 12 17  1  0  0  0  0
M  END

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