COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 BR   UNL     1       5.457   0.815  -0.447  1.00  0.00          Br  
HETATM    2  N   UNL     1      -1.832  -0.815  -0.003  1.00  0.00           N  
HETATM    3  N   UNL     1       0.332   0.027   0.269  1.00  0.00           N  
HETATM    4  N   UNL     1      -1.487   1.415   0.609  1.00  0.00           N  
HETATM    5  N   UNL     1       2.547   0.793   0.521  1.00  0.00           N  
HETATM    6  C   UNL     1      -5.037   0.850  -0.641  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.934  -0.147  -0.247  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.450  -1.370   0.230  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.094  -1.587   0.309  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.204  -0.592  -0.085  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.682   0.624  -0.565  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.387   0.089  -0.332  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.976   0.233   0.299  1.00  0.00           C  
HETATM   14  C   UNL     1       1.178   1.011   0.553  1.00  0.00           C  
HETATM   15  C   UNL     1       0.669   2.269   0.884  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.702   2.441   0.903  1.00  0.00           C  
HETATM   17  C   UNL     1       3.044  -0.498   0.323  1.00  0.00           C  
HETATM   18  C   UNL     1       2.234  -1.601   0.562  1.00  0.00           C  
HETATM   19  C   UNL     1       2.729  -2.875   0.364  1.00  0.00           C  
HETATM   20  C   UNL     1       4.029  -3.055  -0.071  1.00  0.00           C  
HETATM   21  C   UNL     1       4.839  -1.959  -0.310  1.00  0.00           C  
HETATM   22  C   UNL     1       4.349  -0.682  -0.120  1.00  0.00           C  
HETATM   23  O   UNL     1      -8.250  -0.873   0.049  1.00  0.00           O  
HETATM   24  O   UNL     1      -7.806   1.152  -0.746  1.00  0.00           O  
HETATM   25  H   UNL     1      -1.475  -1.704  -0.153  1.00  0.00           H  
HETATM   26  H   UNL     1       3.159   1.536   0.637  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.408   1.795  -1.010  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.140  -2.142   0.536  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.719  -2.531   0.678  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.989   1.393  -0.873  1.00  0.00           H  
HETATM   31  H   UNL     1       1.331   3.089   1.120  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.128   3.400   1.154  1.00  0.00           H  
HETATM   33  H   UNL     1       1.219  -1.462   0.902  1.00  0.00           H  
HETATM   34  H   UNL     1       2.099  -3.733   0.550  1.00  0.00           H  
HETATM   35  H   UNL     1       4.413  -4.052  -0.225  1.00  0.00           H  
HETATM   36  H   UNL     1       5.854  -2.103  -0.650  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.193  -0.672  -0.026  1.00  0.00           H  
CONECT    1   22                                                      
CONECT    2   10   13   25                                            
CONECT    3   13   14   14                                            
CONECT    4   13   13   16                                            
CONECT    5   14   17   26                                            
CONECT    6    7    7   11   27                                       
CONECT    7    8   12    6    6                                       
CONECT    8    9    9    7   28                                       
CONECT    9    8    8   10   29                                       
CONECT   10    9    2   11   11                                       
CONECT   11   10   10    6   30                                       
CONECT   12   24   24    7   23                                       
CONECT   13    2    4    4    3                                       
CONECT   14    3    3   15    5                                       
CONECT   15   16   16   14   31                                       
CONECT   16    4   15   15   32                                       
CONECT   17   22    5   18   18                                       
CONECT   18   17   17   19   33                                       
CONECT   19   20   20   18   34                                       
CONECT   20   21   19   19   35                                       
CONECT   21   22   22   20   36                                       
CONECT   22    1   21   21   17                                       
CONECT   23   12   37                                                 
CONECT   24   12   12                                                 
CONECT   25    2                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30   11                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
CONECT   35   20                                                      
CONECT   36   21                                                      
CONECT   37   23                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
