COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.521   0.376   0.001  1.00  0.00           C  
HETATM    2  C   UNL     1       0.271  -0.050  -0.411  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.153  -0.612   0.125  1.00  0.00           C  
HETATM    4  C   UNL     1       0.643   2.567   0.403  1.00  0.00           C  
HETATM    5  C   UNL     1       1.707   1.685   0.408  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.606   2.142  -0.009  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.792   0.834  -0.415  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.154   0.371  -0.864  1.00  0.00           C  
HETATM    9 BR   UNL     1       2.974  -0.834   0.015  1.00  0.00          Br  
HETATM   10  N   UNL     1      -2.901  -0.140   0.288  1.00  0.00           N  
HETATM   11  O   UNL     1      -4.661  -0.613  -0.976  1.00  0.00           O  
HETATM   12  C   UNL     1      -4.921  -1.137   1.310  1.00  0.00           C  
HETATM   13  H   UNL     1       0.126  -1.071  -0.729  1.00  0.00           H  
HETATM   14  H   UNL     1       0.788   3.589   0.720  1.00  0.00           H  
HETATM   15  H   UNL     1       2.683   2.017   0.730  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.437   2.831  -0.012  1.00  0.00           H  
HETATM   17  H   UNL     1      -2.695   1.207  -1.306  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.043  -0.421  -1.605  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.494  -0.139   1.169  1.00  0.00           H  
HETATM   20  H   UNL     1      -4.729  -2.204   1.423  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.602  -0.613   2.211  1.00  0.00           H  
HETATM   22  H   UNL     1      -5.987  -0.974   1.154  1.00  0.00           H  
CONECT    1    9    2    2    5                                       
CONECT    2    1    1    7   13                                       
CONECT    3   12   10   11   11                                       
CONECT    4    5    5    6   14                                       
CONECT    5    1    4    4   15                                       
CONECT    6    7    7    4   16                                       
CONECT    7    2    8    6    6                                       
CONECT    8   10    7   17   18                                       
CONECT    9    1                                                      
CONECT   10    3    8   19                                            
CONECT   11    3    3                                                 
CONECT   12    3   20   21   22                                       
CONECT   13    2                                                      
CONECT   14    4                                                      
CONECT   15    5                                                      
CONECT   16    6                                                      
CONECT   17    8                                                      
CONECT   18    8                                                      
CONECT   19   10                                                      
CONECT   20   12                                                      
CONECT   21   12                                                      
CONECT   22   12                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
