COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.223  -0.031  -0.345  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.549  -0.248  -0.013  1.00  0.00           C  
HETATM    3 BR   UNL     1      -4.778   1.189  -0.041  1.00  0.00          Br  
HETATM    4  C   UNL     1      -3.975  -1.516   0.338  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.076  -2.566   0.358  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.752  -2.349   0.027  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.326  -1.081  -0.324  1.00  0.00           C  
HETATM    8  C   UNL     1       0.117  -0.846  -0.691  1.00  0.00           C  
HETATM    9  O   UNL     1       0.857  -0.504   0.482  1.00  0.00           O  
HETATM   10  C   UNL     1       2.183  -0.259   0.325  1.00  0.00           C  
HETATM   11  C   UNL     1       2.758  -0.341  -0.938  1.00  0.00           C  
HETATM   12  C   UNL     1       4.102  -0.093  -1.102  1.00  0.00           C  
HETATM   13  C   UNL     1       4.889   0.242   0.003  1.00  0.00           C  
HETATM   14  C   UNL     1       6.330   0.509  -0.168  1.00  0.00           C  
HETATM   15  O   UNL     1       6.835   0.438  -1.272  1.00  0.00           O  
HETATM   16  N   UNL     1       7.088   0.832   0.899  1.00  0.00           N  
HETATM   17  C   UNL     1       4.307   0.324   1.271  1.00  0.00           C  
HETATM   18  C   UNL     1       2.961   0.079   1.426  1.00  0.00           C  
HETATM   19  H   UNL     1      -1.891   0.959  -0.623  1.00  0.00           H  
HETATM   20  H   UNL     1      -5.010  -1.685   0.597  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.408  -3.556   0.633  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.050  -3.169   0.043  1.00  0.00           H  
HETATM   23  H   UNL     1       0.532  -1.753  -1.131  1.00  0.00           H  
HETATM   24  H   UNL     1       0.181  -0.031  -1.412  1.00  0.00           H  
HETATM   25  H   UNL     1       2.149  -0.600  -1.792  1.00  0.00           H  
HETATM   26  H   UNL     1       4.548  -0.158  -2.084  1.00  0.00           H  
HETATM   27  H   UNL     1       6.685   0.889   1.780  1.00  0.00           H  
HETATM   28  H   UNL     1       8.035   1.007   0.786  1.00  0.00           H  
HETATM   29  H   UNL     1       4.912   0.582   2.128  1.00  0.00           H  
HETATM   30  H   UNL     1       2.510   0.146   2.405  1.00  0.00           H  
CONECT    1    2    7    7   19                                       
CONECT    2    3    4    4    1                                       
CONECT    3    2                                                      
CONECT    4    2    2    5   20                                       
CONECT    5    4    6    6   21                                       
CONECT    6    5    5    7   22                                       
CONECT    7    1    1    6    8                                       
CONECT    8    7    9   23   24                                       
CONECT    9    8   10                                                 
CONECT   10    9   11   11   18                                       
CONECT   11   10   10   12   25                                       
CONECT   12   11   13   13   26                                       
CONECT   13   12   12   17   14                                       
CONECT   14   15   15   13   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   27   28                                            
CONECT   17   18   18   13   29                                       
CONECT   18   10   17   17   30                                       
CONECT   19    1                                                      
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    6                                                      
CONECT   23    8                                                      
CONECT   24    8                                                      
CONECT   25   11                                                      
CONECT   26   12                                                      
CONECT   27   16                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30   18                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
