COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.877  -1.066  -1.033  1.00  0.00           C  
HETATM    2  O   UNL     1       0.341  -2.027  -1.832  1.00  0.00           O  
HETATM    3  C   UNL     1       0.048  -0.175  -0.368  1.00  0.00           C  
HETATM    4  C   UNL     1       0.593   0.801   0.444  1.00  0.00           C  
HETATM    5  C   UNL     1       1.968   0.891   0.594  1.00  0.00           C  
HETATM    6  O   UNL     1       2.504   1.852   1.393  1.00  0.00           O  
HETATM    7  C   UNL     1       2.798  -0.001  -0.071  1.00  0.00           C  
HETATM    8 BR   UNL     1       4.674   0.121   0.133  1.00  0.00          Br  
HETATM    9  C   UNL     1       2.253  -0.980  -0.879  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.447  -0.272  -0.530  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.003  -1.299   0.459  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.456  -2.587   0.169  1.00  0.00           O  
HETATM   13  C   UNL     1      -3.528  -1.349   0.329  1.00  0.00           C  
HETATM   14  O   UNL     1      -4.062  -2.251   1.300  1.00  0.00           O  
HETATM   15  C   UNL     1      -4.095   0.054   0.568  1.00  0.00           C  
HETATM   16  O   UNL     1      -5.511   0.036   0.378  1.00  0.00           O  
HETATM   17  C   UNL     1      -3.458   1.029  -0.426  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.038   1.003  -0.274  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.975   2.444  -0.156  1.00  0.00           C  
HETATM   20  O   UNL     1      -3.472   3.334  -1.154  1.00  0.00           O  
HETATM   21  H   UNL     1       0.143  -2.855  -1.373  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.053   1.495   0.962  1.00  0.00           H  
HETATM   23  H   UNL     1       2.620   1.579   2.313  1.00  0.00           H  
HETATM   24  H   UNL     1       2.899  -1.676  -1.394  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.682  -0.584  -1.548  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.732  -1.010   1.475  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.765  -3.288   0.758  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.798  -1.686  -0.671  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.025  -2.332   1.275  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.867   0.371   1.585  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.980  -0.566   0.972  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.720   0.735  -1.443  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.064   2.444  -0.184  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.636   2.772   0.827  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.760   4.250  -1.045  1.00  0.00           H  
CONECT    1    3    3    2    9                                       
CONECT    2    1   21                                                 
CONECT    3    1    1   10    4                                       
CONECT    4    3    5    5   22                                       
CONECT    5    4    4    6    7                                       
CONECT    6    5   23                                                 
CONECT    7    5    9    9    8                                       
CONECT    8    7                                                      
CONECT    9    1    7    7   24                                       
CONECT   10    3   11   18   25                                       
CONECT   11   10   13   12   26                                       
CONECT   12   11   27                                                 
CONECT   13   11   14   15   28                                       
CONECT   14   13   29                                                 
CONECT   15   13   16   17   30                                       
CONECT   16   15   31                                                 
CONECT   17   15   19   18   32                                       
CONECT   18   10   17                                                 
CONECT   19   17   20   33   34                                       
CONECT   20   19   35                                                 
CONECT   21    2                                                      
CONECT   22    4                                                      
CONECT   23    6                                                      
CONECT   24    9                                                      
CONECT   25   10                                                      
CONECT   26   11                                                      
CONECT   27   12                                                      
CONECT   28   13                                                      
CONECT   29   14                                                      
CONECT   30   15                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   19                                                      
CONECT   34   19                                                      
CONECT   35   20                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
