COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.912  -0.804   1.532  1.00  0.00           O  
HETATM    2  C   UNL     1       2.168  -0.326   0.213  1.00  0.00           C  
HETATM    3  C   UNL     1       0.961   0.440  -0.285  1.00  0.00           C  
HETATM    4  O   UNL     1       1.026   0.515  -1.704  1.00  0.00           O  
HETATM    5  C   UNL     1       1.180   1.804   0.351  1.00  0.00           C  
HETATM    6  O   UNL     1       2.597   2.020   0.362  1.00  0.00           O  
HETATM    7  C   UNL     1       3.261   0.741   0.292  1.00  0.00           C  
HETATM    8  C   UNL     1       4.178   0.759  -0.923  1.00  0.00           C  
HETATM    9  O   UNL     1       5.140   1.786  -0.752  1.00  0.00           O  
HETATM   10  P   UNL     1       6.242   2.013  -1.916  1.00  0.00           P  
HETATM   11  O   UNL     1       7.221   3.120  -1.655  1.00  0.00           O  
HETATM   12  O   UNL     1       5.354   2.178  -3.258  1.00  0.00           O  
HETATM   13  O   UNL     1       6.899   0.545  -2.084  1.00  0.00           O  
HETATM   14  N   UNL     1       0.531   2.882  -0.332  1.00  0.00           N  
HETATM   15  C   UNL     1       1.154   3.517  -1.398  1.00  0.00           C  
HETATM   16  C   UNL     1       0.600   4.526  -2.073  1.00  0.00           C  
HETATM   17 BR   UNL     1       1.429   5.378  -3.500  1.00  0.00          Br  
HETATM   18  C   UNL     1      -0.758   4.954  -1.614  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.355   4.362  -0.610  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.757   3.318   0.071  1.00  0.00           C  
HETATM   21  O   UNL     1      -1.341   2.777   1.012  1.00  0.00           O  
HETATM   22  N   UNL     1      -1.404   5.989  -2.252  1.00  0.00           N  
HETATM   23  H   UNL     1       1.393  -0.117   1.978  1.00  0.00           H  
HETATM   24  H   UNL     1       2.451  -1.179  -0.411  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.001   0.003  -0.002  1.00  0.00           H  
HETATM   26  H   UNL     1       1.762  -0.054  -1.980  1.00  0.00           H  
HETATM   27  H   UNL     1       0.838   1.814   1.392  1.00  0.00           H  
HETATM   28  H   UNL     1       3.870   0.634   1.195  1.00  0.00           H  
HETATM   29  H   UNL     1       3.600   0.957  -1.828  1.00  0.00           H  
HETATM   30  H   UNL     1       4.691  -0.199  -1.021  1.00  0.00           H  
HETATM   31  H   UNL     1       5.805   2.397  -4.101  1.00  0.00           H  
HETATM   32  H   UNL     1       7.671   0.436  -2.678  1.00  0.00           H  
HETATM   33  H   UNL     1       2.137   3.132  -1.651  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.074   6.506  -1.736  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.170   6.170  -3.197  1.00  0.00           H  
CONECT    1    2   23                                                 
CONECT    2    1    3    7   24                                       
CONECT    3    2    4    5   25                                       
CONECT    4    3   26                                                 
CONECT    5    3    6   14   27                                       
CONECT    6    5    7                                                 
CONECT    7    2    6    8   28                                       
CONECT    8    7    9   29   30                                       
CONECT    9    8   10                                                 
CONECT   10    9   11   11   12                                       
CONECT   10   13                                                      
CONECT   11   10   10                                                 
CONECT   12   10   31                                                 
CONECT   13   10   32                                                 
CONECT   14    5   15   20                                            
CONECT   15   14   16   16   33                                       
CONECT   16   15   15   17   18                                       
CONECT   17   16                                                      
CONECT   18   16   19   19   22                                       
CONECT   19   18   18   20                                            
CONECT   20   14   19   21   21                                       
CONECT   21   20   20                                                 
CONECT   22   18   34   35                                            
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   15                                                      
CONECT   34   22                                                      
CONECT   35   22                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
