COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -1.281   0.333   2.637  1.00  0.00           O  
HETATM    2  O   UNL     1       0.262  -0.788  -6.236  1.00  0.00           O  
HETATM    3  O   UNL     1       0.993   1.148  -4.793  1.00  0.00           O  
HETATM    4  O   UNL     1      -1.464   0.576  -4.798  1.00  0.00           O  
HETATM    5  P   UNL     1       0.043   0.016  -4.859  1.00  0.00           P  
HETATM    6  O   UNL     1       0.298  -0.972  -3.614  1.00  0.00           O  
HETATM    7  O   UNL     1      -1.444   0.456  -2.260  1.00  0.00           O  
HETATM    8  O   UNL     1       1.014   1.028  -2.250  1.00  0.00           O  
HETATM    9  P   UNL     1       0.064  -0.106  -2.277  1.00  0.00           P  
HETATM   10  C   UNL     1       0.270  -0.994   3.928  1.00  0.00           C  
HETATM   11  C   UNL     1       1.039   1.007   2.646  1.00  0.00           C  
HETATM   12  C   UNL     1       0.082  -0.216   0.162  1.00  0.00           C  
HETATM   13  C   UNL     1       0.295  -1.044   1.431  1.00  0.00           C  
HETATM   14  C   UNL     1       0.057  -0.165   2.660  1.00  0.00           C  
HETATM   15  O   UNL     1       0.304  -1.037  -0.985  1.00  0.00           O  
HETATM   16 BR   UNL     1      -0.035   0.135   5.508  1.00  0.00          Br  
HETATM   17  H   UNL     1      -1.866  -0.435   2.646  1.00  0.00           H  
HETATM   18  H   UNL     1       0.099  -0.161  -6.954  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.050  -0.191  -4.844  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.029  -0.313  -2.277  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.429  -1.829   3.938  1.00  0.00           H  
HETATM   22  H   UNL     1       1.291  -1.375   3.946  1.00  0.00           H  
HETATM   23  H   UNL     1       2.060   0.626   2.664  1.00  0.00           H  
HETATM   24  H   UNL     1       0.887   1.597   1.742  1.00  0.00           H  
HETATM   25  H   UNL     1       0.870   1.633   3.522  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.939   0.164   0.144  1.00  0.00           H  
HETATM   27  H   UNL     1       0.781   0.619   0.152  1.00  0.00           H  
HETATM   28  H   UNL     1       1.316  -1.425   1.448  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.404  -1.880   1.441  1.00  0.00           H  
CONECT    1   14   17                                                 
CONECT    2    5   18                                                 
CONECT    3    5    5                                                 
CONECT    4    5   19                                                 
CONECT    5    2    3    3    4                                       
CONECT    5    6                                                      
CONECT    6    5    9                                                 
CONECT    7    9   20                                                 
CONECT    8    9    9                                                 
CONECT    9    6    7    8    8                                       
CONECT    9   15                                                      
CONECT   10   14   16   21   22                                       
CONECT   11   14   23   24   25                                       
CONECT   12   13   15   26   27                                       
CONECT   13   12   14   28   29                                       
CONECT   14    1   10   11   13                                       
CONECT   15    9   12                                                 
CONECT   16   10                                                      
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    4                                                      
CONECT   20    7                                                      
CONECT   21   10                                                      
CONECT   22   10                                                      
CONECT   23   11                                                      
CONECT   24   11                                                      
CONECT   25   11                                                      
CONECT   26   12                                                      
CONECT   27   12                                                      
CONECT   28   13                                                      
CONECT   29   13                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
