COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.067   1.265   0.005  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.641  -1.475  -0.011  1.00  0.00           C  
HETATM    3  C   UNL     1       1.106   0.489   0.002  1.00  0.00           C  
HETATM    4  C   UNL     1       1.000  -0.925  -0.004  1.00  0.00           C  
HETATM    5  C   UNL     1       2.376   1.089   0.005  1.00  0.00           C  
HETATM    6  C   UNL     1       3.490   0.260   0.002  1.00  0.00           C  
HETATM    7  C   UNL     1       3.308  -1.143  -0.004  1.00  0.00           C  
HETATM    8  O   UNL     1       5.817   0.108   0.111  1.00  0.00           O  
HETATM    9  C   UNL     1       4.848   0.835   0.004  1.00  0.00           C  
HETATM   10  N   UNL     1       5.016   2.168  -0.112  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.271   0.616   0.002  1.00  0.00           C  
HETATM   12 BR   UNL     1      -2.883   1.605   0.014  1.00  0.00          Br  
HETATM   13  N   UNL     1       4.416  -1.969  -0.007  1.00  0.00           N  
HETATM   14  N   UNL     1       2.106  -1.679  -0.006  1.00  0.00           N  
HETATM   15  N   UNL     1      -0.209  -1.495  -0.006  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.306  -0.776  -0.009  1.00  0.00           C  
HETATM   17  F   UNL     1      -2.445  -2.855   0.106  1.00  0.00           F  
HETATM   18  F   UNL     1      -3.408  -1.020   1.068  1.00  0.00           F  
HETATM   19  F   UNL     1      -3.310  -1.199  -1.208  1.00  0.00           F  
HETATM   20  H   UNL     1      -0.018   2.344   0.014  1.00  0.00           H  
HETATM   21  H   UNL     1       2.483   2.164   0.009  1.00  0.00           H  
HETATM   22  H   UNL     1       5.909   2.546  -0.111  1.00  0.00           H  
HETATM   23  H   UNL     1       4.243   2.748  -0.198  1.00  0.00           H  
HETATM   24  H   UNL     1       4.305  -2.928  -0.092  1.00  0.00           H  
HETATM   25  H   UNL     1       5.304  -1.588   0.077  1.00  0.00           H  
CONECT    1    3    3   11   20                                       
CONECT    2   19   16   17   18                                       
CONECT    3    4    5    1    1                                       
CONECT    4   14   15   15    3                                       
CONECT    5    6    6    3   21                                       
CONECT    6    7    9    5    5                                       
CONECT    7   13   14   14    6                                       
CONECT    8    9    9                                                 
CONECT    9    8    8    6   10                                       
CONECT   10    9   22   23                                            
CONECT   11   16   16    1   12                                       
CONECT   12   11                                                      
CONECT   13    7   24   25                                            
CONECT   14    7    7    4                                            
CONECT   15    4    4   16                                            
CONECT   16   15    2   11   11                                       
CONECT   17    2                                                      
CONECT   18    2                                                      
CONECT   19    2                                                      
CONECT   20    1                                                      
CONECT   21    5                                                      
CONECT   22   10                                                      
CONECT   23   10                                                      
CONECT   24   13                                                      
CONECT   25   13                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
