COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.026  -3.928  -4.543  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.212  -3.825  -3.071  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.575  -2.393  -2.715  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.582  -1.868  -3.185  1.00  0.00           O  
HETATM    5  N   UNL     1       0.348  -1.801  -1.840  1.00  0.00           N  
HETATM    6  C   UNL     1       0.328  -0.511  -1.310  1.00  0.00           C  
HETATM    7  C   UNL     1       1.338  -0.090  -0.451  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.702   0.363  -1.639  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.720   1.656  -1.107  1.00  0.00           C  
HETATM   10  C   UNL     1       0.278   2.104  -0.244  1.00  0.00           C  
HETATM   11  C   UNL     1       1.313   1.211   0.079  1.00  0.00           C  
HETATM   12  C   UNL     1       2.292   1.694   0.944  1.00  0.00           C  
HETATM   13  N   UNL     1       2.288   2.936   1.464  1.00  0.00           N  
HETATM   14  C   UNL     1       1.251   3.699   1.084  1.00  0.00           C  
HETATM   15  N   UNL     1       0.244   3.351   0.257  1.00  0.00           N  
HETATM   16  N   UNL     1       3.368   0.851   1.316  1.00  0.00           N  
HETATM   17  C   UNL     1       4.701   1.116   1.668  1.00  0.00           C  
HETATM   18  C   UNL     1       5.365   2.223   1.131  1.00  0.00           C  
HETATM   19  C   UNL     1       5.374   0.274   2.558  1.00  0.00           C  
HETATM   20  C   UNL     1       6.699   0.536   2.908  1.00  0.00           C  
HETATM   21  C   UNL     1       7.356   1.642   2.369  1.00  0.00           C  
HETATM   22  C   UNL     1       6.689   2.485   1.481  1.00  0.00           C  
HETATM   23 BR   UNL     1       7.580   3.984   0.752  1.00  0.00          Br  
HETATM   24  H   UNL     1       0.239  -4.881  -4.988  1.00  0.00           H  
HETATM   25  H   UNL     1       0.012  -3.039  -5.163  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.034  -4.471  -2.745  1.00  0.00           H  
HETATM   27  H   UNL     1       1.137  -2.393  -1.555  1.00  0.00           H  
HETATM   28  H   UNL     1       2.138  -0.784  -0.202  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.500   0.054  -2.308  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.537   2.321  -1.379  1.00  0.00           H  
HETATM   31  H   UNL     1       1.217   4.705   1.485  1.00  0.00           H  
HETATM   32  H   UNL     1       3.120  -0.131   1.331  1.00  0.00           H  
HETATM   33  H   UNL     1       4.840   2.878   0.438  1.00  0.00           H  
HETATM   34  H   UNL     1       4.871  -0.591   2.984  1.00  0.00           H  
HETATM   35  H   UNL     1       7.217  -0.120   3.600  1.00  0.00           H  
HETATM   36  H   UNL     1       8.388   1.833   2.653  1.00  0.00           H  
CONECT    1    2    2   24   25                                       
CONECT    2    1    1    3   26                                       
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3    6   27                                            
CONECT    6    5    7    7    8                                       
CONECT    7    6    6   11   28                                       
CONECT    8    6    9    9   29                                       
CONECT    9    8    8   10   30                                       
CONECT   10    9   15   15   11                                       
CONECT   11    7   10   12   12                                       
CONECT   12   11   11   13   16                                       
CONECT   13   12   14   14                                            
CONECT   14   13   13   15   31                                       
CONECT   15   10   10   14                                            
CONECT   16   12   17   32                                            
CONECT   17   16   18   18   19                                       
CONECT   18   17   17   22   33                                       
CONECT   19   17   20   20   34                                       
CONECT   20   19   19   21   35                                       
CONECT   21   20   22   22   36                                       
CONECT   22   18   21   21   23                                       
CONECT   23   22                                                      
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31   14                                                      
CONECT   32   16                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
CONECT   35   20                                                      
CONECT   36   21                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
