COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.617   0.301   0.300  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.829   0.706   0.428  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.959  -0.433   0.106  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.026   2.066  -0.190  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.109  -1.451  -0.078  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.129  -1.861   1.395  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.829  -2.513  -0.913  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.819  -0.106  -0.243  1.00  0.00           C  
HETATM    9  C   UNL     1       1.089  -0.206  -0.896  1.00  0.00           C  
HETATM   10  C   UNL     1       2.417  -0.573  -1.016  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.673  -0.272  -0.264  1.00  0.00           N  
HETATM   12  N   UNL     1      -0.347   3.128   0.287  1.00  0.00           N  
HETATM   13  C   UNL     1       1.472   0.442   1.377  1.00  0.00           C  
HETATM   14 BR   UNL     1       5.089  -0.934  -0.101  1.00  0.00          Br  
HETATM   15  C   UNL     1       3.273  -0.433   0.062  1.00  0.00           C  
HETATM   16  C   UNL     1       2.800   0.076   1.258  1.00  0.00           C  
HETATM   17  O   UNL     1      -3.734  -1.331  -0.530  1.00  0.00           O  
HETATM   18  O   UNL     1      -3.418   0.233   1.013  1.00  0.00           O  
HETATM   19  O   UNL     1      -1.796   2.205  -1.117  1.00  0.00           O  
HETATM   20  O   UNL     1      -0.532   4.406  -0.293  1.00  0.00           O  
HETATM   21  H   UNL     1      -1.104   0.742   1.482  1.00  0.00           H  
HETATM   22  H   UNL     1      -6.161  -1.951   1.734  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.623  -2.819   1.513  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.616  -1.105   1.990  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.815  -2.220  -1.963  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.323  -3.471  -0.795  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.861  -2.603  -0.574  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.806   0.187  -1.293  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.851  -0.196   0.096  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.306   0.651   0.352  1.00  0.00           H  
HETATM   31  H   UNL     1       0.421  -0.316  -1.737  1.00  0.00           H  
HETATM   32  H   UNL     1       2.786  -0.970  -1.950  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.306  -0.803  -0.988  1.00  0.00           H  
HETATM   34  H   UNL     1       0.269   3.016   1.029  1.00  0.00           H  
HETATM   35  H   UNL     1       1.103   0.838   2.312  1.00  0.00           H  
HETATM   36  H   UNL     1       3.468   0.186   2.100  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.002   5.104   0.116  1.00  0.00           H  
CONECT    1    2   13   13    9                                       
CONECT    2    4   11    1   21                                       
CONECT    3   17   18   18   11                                       
CONECT    4   12   19   19    2                                       
CONECT    5    7    6    8   17                                       
CONECT    6    5   22   23   24                                       
CONECT    7    5   25   26   27                                       
CONECT    8    5   28   29   30                                       
CONECT    9    1   10   10   31                                       
CONECT   10    9    9   15   32                                       
CONECT   11    3    2   33                                            
CONECT   12   20    4   34                                            
CONECT   13    1    1   16   35                                       
CONECT   14   15                                                      
CONECT   15   16   16   10   14                                       
CONECT   16   13   15   15   36                                       
CONECT   17    5    3                                                 
CONECT   18    3    3                                                 
CONECT   19    4    4                                                 
CONECT   20   12   37                                                 
CONECT   21    2                                                      
CONECT   22    6                                                      
CONECT   23    6                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   16                                                      
CONECT   37   20                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
