COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.569   3.328  -0.522  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.498   2.215  -0.110  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.765   2.507   0.350  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.620   1.487   0.729  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.213   0.167   0.649  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.949  -0.143   0.190  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.080   0.883  -0.199  1.00  0.00           C  
HETATM    8  C   UNL     1       0.269   0.563  -0.689  1.00  0.00           C  
HETATM    9  C   UNL     1       1.441   0.588   0.258  1.00  0.00           C  
HETATM   10  C   UNL     1       2.693   0.091  -0.466  1.00  0.00           C  
HETATM   11  C   UNL     1       3.888   0.230   0.442  1.00  0.00           C  
HETATM   12  O   UNL     1       0.439   0.280  -1.856  1.00  0.00           O  
HETATM   13  O   UNL     1       2.524  -1.283  -0.823  1.00  0.00           O  
HETATM   14  O   UNL     1       4.474  -0.754   0.825  1.00  0.00           O  
HETATM   15  O   UNL     1       4.300   1.449   0.826  1.00  0.00           O  
HETATM   16 BR   UNL     1      -1.394  -1.947   0.082  1.00  0.00          Br  
HETATM   17  H   UNL     1       0.088   3.579   0.310  1.00  0.00           H  
HETATM   18  H   UNL     1       0.030   3.005  -1.374  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.154   4.205  -0.800  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.091   3.534   0.415  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.611   1.722   1.089  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.887  -0.624   0.947  1.00  0.00           H  
HETATM   23  H   UNL     1       1.604   1.607   0.609  1.00  0.00           H  
HETATM   24  H   UNL     1       1.233  -0.060   1.110  1.00  0.00           H  
HETATM   25  H   UNL     1       2.851   0.683  -1.367  1.00  0.00           H  
HETATM   26  H   UNL     1       2.379  -1.870  -0.068  1.00  0.00           H  
HETATM   27  H   UNL     1       5.071   1.488   1.409  1.00  0.00           H  
CONECT    1    2   17   18   19                                       
CONECT    2    7    7    3    1                                       
CONECT    3    4    4    2   20                                       
CONECT    4    5    3    3   21                                       
CONECT    5    6    6    4   22                                       
CONECT    6   16    5    5    7                                       
CONECT    7    6    8    2    2                                       
CONECT    8   12   12    7    9                                       
CONECT    9    8   10   23   24                                       
CONECT   10   13    9   11   25                                       
CONECT   11   10   14   14   15                                       
CONECT   12    8    8                                                 
CONECT   13   10   26                                                 
CONECT   14   11   11                                                 
CONECT   15   11   27                                                 
CONECT   16    6                                                      
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    9                                                      
CONECT   24    9                                                      
CONECT   25   10                                                      
CONECT   26   13                                                      
CONECT   27   15                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
