D0X5RA
 Wcorina  10100417263D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 14 14  0     0  0  0  0  0  0999 V2000
    1.2632   -2.5490   -0.0231 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.4702   -0.4708   -0.0341 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1000    3.2815    0.0092 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0166    1.3699    0.0096 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3245    1.4377   -0.0125 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1731   -0.7124    0.0090 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0021   -0.0041    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2022   -0.6590   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3886    0.0917   -0.0203 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1350    2.0662    0.0023 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8647    1.8407    0.0161 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1432    1.9581   -0.0172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0220   -0.2433    0.0194 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1548   -1.6822    0.0036 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  4  7  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 12  1  0  0  0  0
  6  7  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
M  END

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