COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.458  -0.092  -0.008  1.00  0.00           N  
HETATM    2  C   UNL     1       2.693   0.570  -0.007  1.00  0.00           C  
HETATM    3  C   UNL     1       4.146   2.254  -0.904  1.00  0.00           C  
HETATM    4  C   UNL     1       0.227   0.539   0.010  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.152   1.876   0.038  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.489   2.213   0.051  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.466   1.228   0.037  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.109  -0.105   0.010  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.762  -0.457  -0.005  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.040  -1.744  -0.033  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.630  -3.081  -0.055  1.00  0.00           C  
HETATM   12  C   UNL     1       0.251  -4.284  -0.083  1.00  0.00           C  
HETATM   13  C   UNL     1       1.307  -1.430  -0.034  1.00  0.00           C  
HETATM   14  C   UNL     1       2.929   1.601  -0.906  1.00  0.00           C  
HETATM   15  C   UNL     1       5.133   1.879  -0.003  1.00  0.00           C  
HETATM   16  C   UNL     1       4.895   0.852   0.899  1.00  0.00           C  
HETATM   17  C   UNL     1       3.679   0.199   0.898  1.00  0.00           C  
HETATM   18  O   UNL     1       1.457  -4.152  -0.088  1.00  0.00           O  
HETATM   19  O   UNL     1      -0.292  -5.515  -0.103  1.00  0.00           O  
HETATM   20  O   UNL     1      -1.839  -3.212  -0.050  1.00  0.00           O  
HETATM   21  O   UNL     1       6.332   2.518  -0.005  1.00  0.00           O  
HETATM   22 BR   UNL     1      -4.293   1.713   0.057  1.00  0.00          Br  
HETATM   23  H   UNL     1       4.331   3.053  -1.606  1.00  0.00           H  
HETATM   24  H   UNL     1       0.600   2.651   0.050  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.778   3.253   0.073  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.870  -0.870  -0.001  1.00  0.00           H  
HETATM   27  H   UNL     1       2.114  -2.148  -0.056  1.00  0.00           H  
HETATM   28  H   UNL     1       2.161   1.893  -1.608  1.00  0.00           H  
HETATM   29  H   UNL     1       5.664   0.561   1.600  1.00  0.00           H  
HETATM   30  H   UNL     1       3.494  -0.600   1.601  1.00  0.00           H  
HETATM   31  H   UNL     1       0.319  -6.264  -0.121  1.00  0.00           H  
HETATM   32  H   UNL     1       6.368   3.289   0.579  1.00  0.00           H  
CONECT    1    4   13    2                                            
CONECT    2    1   14   14   17                                       
CONECT    3   14   15   15   23                                       
CONECT    4    9    9    5    1                                       
CONECT    5    6    6    4   24                                       
CONECT    6    7    5    5   25                                       
CONECT    7   22    8    8    6                                       
CONECT    8    7    7    9   26                                       
CONECT    9    8   10    4    4                                       
CONECT   10    9   11   13   13                                       
CONECT   11   20   20   10   12                                       
CONECT   12   11   18   18   19                                       
CONECT   13   10   10    1   27                                       
CONECT   14    2    2    3   28                                       
CONECT   15    3    3   16   21                                       
CONECT   16   17   17   15   29                                       
CONECT   17    2   16   16   30                                       
CONECT   18   12   12                                                 
CONECT   19   12   31                                                 
CONECT   20   11   11                                                 
CONECT   21   15   32                                                 
CONECT   22    7                                                      
CONECT   23    3                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    8                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29   16                                                      
CONECT   30   17                                                      
CONECT   31   19                                                      
CONECT   32   21                                                      
MASTER        0    0    0    0    0    0    0    0   32    0   32    0
END
