COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.796  -2.110  -0.007  1.00  0.00           O  
HETATM    2  C   UNL     1       2.156  -0.946  -0.001  1.00  0.00           C  
HETATM    3  N   UNL     1       3.426  -0.514  -0.019  1.00  0.00           N  
HETATM    4  C   UNL     1       4.652  -1.316  -0.097  1.00  0.00           C  
HETATM    5  C   UNL     1       5.830  -0.454   0.372  1.00  0.00           C  
HETATM    6  C   UNL     1       5.833   0.870  -0.399  1.00  0.00           C  
HETATM    7  C   UNL     1       4.653   1.731   0.075  1.00  0.00           C  
HETATM    8  C   UNL     1       3.409   0.878   0.030  1.00  0.00           C  
HETATM    9  C   UNL     1       2.147   1.271   0.047  1.00  0.00           C  
HETATM   10  N   UNL     1       1.347   0.134   0.018  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.054   0.113   0.012  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.767   1.305   0.034  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.148   1.281   0.028  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.821   0.073   0.001  1.00  0.00           C  
HETATM   15 BR   UNL     1      -4.712   0.045  -0.007  1.00  0.00          Br  
HETATM   16  C   UNL     1      -2.112  -1.116  -0.021  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.731  -1.098  -0.022  1.00  0.00           C  
HETATM   18  H   UNL     1       4.559  -2.190   0.546  1.00  0.00           H  
HETATM   19  H   UNL     1       4.818  -1.632  -1.127  1.00  0.00           H  
HETATM   20  H   UNL     1       5.730  -0.252   1.438  1.00  0.00           H  
HETATM   21  H   UNL     1       6.764  -0.984   0.188  1.00  0.00           H  
HETATM   22  H   UNL     1       6.768   1.399  -0.212  1.00  0.00           H  
HETATM   23  H   UNL     1       5.733   0.671  -1.466  1.00  0.00           H  
HETATM   24  H   UNL     1       4.831   2.070   1.095  1.00  0.00           H  
HETATM   25  H   UNL     1       4.535   2.590  -0.585  1.00  0.00           H  
HETATM   26  H   UNL     1       1.800   2.293   0.075  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.243   2.248   0.055  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.703   2.208   0.045  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.640  -2.058  -0.043  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.179  -2.026  -0.043  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   10                                       
CONECT    3    2    4    8                                            
CONECT    4    3    5   18   19                                       
CONECT    5    4    6   20   21                                       
CONECT    6    5    7   22   23                                       
CONECT    7    6    8   24   25                                       
CONECT    8    3    7    9    9                                       
CONECT    9    8    8   10   26                                       
CONECT   10    2    9   11                                            
CONECT   11   10   12   12   17                                       
CONECT   12   11   11   13   27                                       
CONECT   13   12   14   14   28                                       
CONECT   14   13   13   15   16                                       
CONECT   15   14                                                      
CONECT   16   14   17   17   29                                       
CONECT   17   11   16   16   30                                       
CONECT   18    4                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    6                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25    7                                                      
CONECT   26    9                                                      
CONECT   27   12                                                      
CONECT   28   13                                                      
CONECT   29   16                                                      
CONECT   30   17                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
