COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.413   2.395   0.231  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.761   1.663   0.208  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.056   1.773  -0.472  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.093   0.280  -0.251  1.00  0.00           C  
HETATM    5  C   UNL     1       0.524  -0.370   0.001  1.00  0.00           C  
HETATM    6  O   UNL     1      -1.573  -2.641   0.386  1.00  0.00           O  
HETATM    7  C   UNL     1      -2.287  -1.686   0.150  1.00  0.00           C  
HETATM    8  O   UNL     1      -3.625  -1.694  -0.027  1.00  0.00           O  
HETATM    9  N   UNL     1      -4.038  -0.570  -0.250  1.00  0.00           N  
HETATM   10  N   UNL     1      -1.911  -0.416   0.013  1.00  0.00           N  
HETATM   11  O   UNL     1      -1.968   2.283   0.322  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.697   0.268   0.080  1.00  0.00           C  
HETATM   13  C   UNL     1       1.691   0.375   0.019  1.00  0.00           C  
HETATM   14 BR   UNL     1       3.368  -0.494  -0.094  1.00  0.00          Br  
HETATM   15  C   UNL     1       1.633   1.752   0.134  1.00  0.00           C  
HETATM   16  H   UNL     1       0.376   3.471   0.320  1.00  0.00           H  
HETATM   17  H   UNL     1      -2.882   1.990  -1.526  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.996   2.221  -0.150  1.00  0.00           H  
HETATM   19  H   UNL     1       0.569  -1.446  -0.084  1.00  0.00           H  
HETATM   20  H   UNL     1       2.546   2.329   0.149  1.00  0.00           H  
CONECT    1   15   15    2   16                                       
CONECT    2    1   11   12   12                                       
CONECT    3   11    4   17   18                                       
CONECT    4    3   10    9    9                                       
CONECT    5   13   13   12   19                                       
CONECT    6    7    7                                                 
CONECT    7    6    6   10    8                                       
CONECT    8    7    9                                                 
CONECT    9    4    4    8                                            
CONECT   10    4    7   12                                            
CONECT   11    2    3                                                 
CONECT   12    2    2    5   10                                       
CONECT   13    5    5   15   14                                       
CONECT   14   13                                                      
CONECT   15    1    1   13   20                                       
CONECT   16    1                                                      
CONECT   17    3                                                      
CONECT   18    3                                                      
CONECT   19    5                                                      
CONECT   20   15                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
