D0CP3M
 Wcorina  10100417253D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 15 16  0     0  0  0  0  0  0999 V2000
   -2.8089   -0.4901    0.0265 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.5210   -2.2443   -0.0438 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.9698   -3.6474   -0.0001 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.1790   -4.5184   -0.0321 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.0167    1.3771    0.0096 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0805    0.7763   -0.0136 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
    1.3570   -0.3730   -0.0129 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9834   -0.9830    0.0058 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7019   -1.7283   -0.0231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6270   -2.3158   -0.0052 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7120   -2.6860   -0.0184 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2767    1.7992   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8056    1.9414    0.0166 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5903    2.8327    0.0014 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  2 10  1  0  0  0  0
  3 11  1  0  0  0  0
  4 12  1  0  0  0  0
  5  7  1  0  0  0  0
  5 13  1  0  0  0  0
  5 14  1  0  0  0  0
  6  8  1  0  0  0  0
  6 13  2  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  2  0  0  0  0
 10 12  2  0  0  0  0
 11 12  1  0  0  0  0
 13 15  1  0  0  0  0
M  END

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