D0I4NN
 Wcorina  10100417213D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 14 14  0     0  0  0  0  0  0999 V2000
    1.7898    3.6400    0.0045 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.9918    0.8302   -0.0322 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.0201   -2.0943    0.0012 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0166    1.3734    0.0096 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4090   -0.3598    0.0246 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
    1.3227   -0.4021   -0.0127 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2627    1.8239   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1023    0.7584   -0.0139 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1685   -0.8863    0.0092 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8120    1.9286    0.0165 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6861   -1.4190   -0.0211 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1836   -0.9436    0.0294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5273    0.6030    0.0310 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  2  9  1  0  0  0  0
  3 10  2  0  0  0  0
  4  6  1  0  0  0  0
  4  8  1  0  0  0  0
  4 11  1  0  0  0  0
  5 10  1  0  0  0  0
  5 13  1  0  0  0  0
  5 14  1  0  0  0  0
  6  7  2  0  0  0  0
  6 10  1  0  0  0  0
  7  9  1  0  0  0  0
  7 12  1  0  0  0  0
  8  9  2  0  0  0  0
M  END

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