COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 BR   UNL     1      -5.058  -0.628  -0.051  1.00  0.00          Br  
HETATM    2  C   UNL     1      -3.341  -0.085  -0.839  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.331   0.188   0.278  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.994   0.610  -0.336  1.00  0.00           C  
HETATM    5  O   UNL     1      -0.051   0.865   0.707  1.00  0.00           O  
HETATM    6  C   UNL     1       1.195   1.253   0.330  1.00  0.00           C  
HETATM    7  C   UNL     1       1.489   2.593   0.170  1.00  0.00           C  
HETATM    8  O   UNL     1       0.524   3.525   0.391  1.00  0.00           O  
HETATM    9  C   UNL     1       0.890   4.895   0.209  1.00  0.00           C  
HETATM   10  C   UNL     1       2.201   0.292   0.104  1.00  0.00           C  
HETATM   11  C   UNL     1       3.496   0.719  -0.289  1.00  0.00           C  
HETATM   12  C   UNL     1       3.754   2.090  -0.447  1.00  0.00           C  
HETATM   13  C   UNL     1       2.767   3.000  -0.217  1.00  0.00           C  
HETATM   14  C   UNL     1       1.943  -1.076   0.263  1.00  0.00           C  
HETATM   15  C   UNL     1       2.956  -1.992   0.033  1.00  0.00           C  
HETATM   16  C   UNL     1       2.690  -3.438   0.198  1.00  0.00           C  
HETATM   17  N   UNL     1       3.694  -4.354  -0.030  1.00  0.00           N  
HETATM   18  N   UNL     1       1.505  -3.845   0.558  1.00  0.00           N  
HETATM   19  C   UNL     1       4.235  -1.558  -0.356  1.00  0.00           C  
HETATM   20  C   UNL     1       4.504  -0.237  -0.515  1.00  0.00           C  
HETATM   21  H   UNL     1      -2.967  -0.883  -1.480  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.482   0.820  -1.430  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.705   0.986   0.919  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.190  -0.717   0.869  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.620  -0.188  -0.977  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.136   1.515  -0.927  1.00  0.00           H  
HETATM   27  H   UNL     1       1.703   5.147   0.890  1.00  0.00           H  
HETATM   28  H   UNL     1       1.216   5.050  -0.819  1.00  0.00           H  
HETATM   29  H   UNL     1       0.030   5.531   0.418  1.00  0.00           H  
HETATM   30  H   UNL     1       4.736   2.424  -0.745  1.00  0.00           H  
HETATM   31  H   UNL     1       2.976   4.053  -0.336  1.00  0.00           H  
HETATM   32  H   UNL     1       0.962  -1.414   0.562  1.00  0.00           H  
HETATM   33  H   UNL     1       4.575  -4.050  -0.298  1.00  0.00           H  
HETATM   34  H   UNL     1       3.519  -5.302   0.079  1.00  0.00           H  
HETATM   35  H   UNL     1       0.799  -3.201   0.718  1.00  0.00           H  
HETATM   36  H   UNL     1       5.014  -2.285  -0.532  1.00  0.00           H  
HETATM   37  H   UNL     1       5.492   0.081  -0.814  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3   21   22                                       
CONECT    3    2    4   23   24                                       
CONECT    4    3    5   25   26                                       
CONECT    5    4    6                                                 
CONECT    6    5    7    7   10                                       
CONECT    7    8    6    6   13                                       
CONECT    8    9    7                                                 
CONECT    9    8   27   28   29                                       
CONECT   10    6   14   14   11                                       
CONECT   11   10   12   20   20                                       
CONECT   12   13   13   11   30                                       
CONECT   13    7   12   12   31                                       
CONECT   14   10   10   15   32                                       
CONECT   15   14   16   19   19                                       
CONECT   16   18   18   17   15                                       
CONECT   17   16   33   34                                            
CONECT   18   16   16   35                                            
CONECT   19   15   15   20   36                                       
CONECT   20   11   11   19   37                                       
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    9                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   17                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
