COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.280   1.943   1.207  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.229   0.945   0.971  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.018   1.021   1.671  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.042   0.092   1.450  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.436  -0.091   0.050  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.445  -1.023  -0.165  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.244  -0.933   0.531  1.00  0.00           C  
HETATM    8  C   UNL     1       2.050  -1.626  -0.064  1.00  0.00           C  
HETATM    9  C   UNL     1       2.633  -0.290  -0.313  1.00  0.00           C  
HETATM   10  C   UNL     1       3.867   0.052   0.247  1.00  0.00           C  
HETATM   11  C   UNL     1       4.406   1.302   0.010  1.00  0.00           C  
HETATM   12  C   UNL     1       3.725   2.214  -0.779  1.00  0.00           C  
HETATM   13  C   UNL     1       2.501   1.878  -1.336  1.00  0.00           C  
HETATM   14  C   UNL     1       1.956   0.632  -1.112  1.00  0.00           C  
HETATM   15  C   UNL     1       1.840  -3.772   0.124  1.00  0.00           C  
HETATM   16  C   UNL     1       0.640  -3.241   0.433  1.00  0.00           C  
HETATM   17  F   UNL     1       4.531  -0.837   1.018  1.00  0.00           F  
HETATM   18  F   UNL     1       4.256   3.435  -1.007  1.00  0.00           F  
HETATM   19  N   UNL     1       0.760  -1.879   0.312  1.00  0.00           N  
HETATM   20  N   UNL     1       2.682  -2.774  -0.172  1.00  0.00           N  
HETATM   21 BR   UNL     1      -4.070  -0.208  -0.894  1.00  0.00          Br  
HETATM   22  H   UNL     1      -4.213   1.882   0.666  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.856   1.815   2.385  1.00  0.00           H  
HETATM   24  H   UNL     1       0.891   0.153   1.991  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.600  -1.823  -0.874  1.00  0.00           H  
HETATM   26  H   UNL     1       5.360   1.569   0.442  1.00  0.00           H  
HETATM   27  H   UNL     1       1.977   2.592  -1.954  1.00  0.00           H  
HETATM   28  H   UNL     1       1.002   0.373  -1.547  1.00  0.00           H  
HETATM   29  H   UNL     1       2.083  -4.824   0.121  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.248  -3.785   0.721  1.00  0.00           H  
HETATM   31  O   UNL     1      -3.102   2.832   2.012  1.00  0.00           O  
CONECT    1    2   22   31   31                                       
CONECT    2    5    5    3    1                                       
CONECT    3    4    4    2   23                                       
CONECT    4    7    3    3   24                                       
CONECT    5    6   21    2    2                                       
CONECT    6    7    7    5   25                                       
CONECT    7   19    6    6    4                                       
CONECT    8   20   20    9   19                                       
CONECT    9   14    8   10   10                                       
CONECT   10    9    9   11   17                                       
CONECT   11   12   12   10   26                                       
CONECT   12   13   18   11   11                                       
CONECT   13   14   14   12   27                                       
CONECT   14   13   13    9   28                                       
CONECT   15   20   16   16   29                                       
CONECT   16   15   15   19   30                                       
CONECT   17   10                                                      
CONECT   18   12                                                      
CONECT   19    8   16    7                                            
CONECT   20   15    8    8                                            
CONECT   21    5                                                      
CONECT   22    1                                                      
CONECT   23    3                                                      
CONECT   24    4                                                      
CONECT   25    6                                                      
CONECT   26   11                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29   15                                                      
CONECT   30   16                                                      
CONECT   31    1    1                                                 
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
