COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.988   1.224  -0.397  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.345   1.238  -0.149  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.043   0.034  -0.040  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.362  -1.176  -0.182  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.005  -1.176  -0.429  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.319   0.021  -0.536  1.00  0.00           C  
HETATM    7  C   UNL     1       1.163   0.014  -0.812  1.00  0.00           C  
HETATM    8  C   UNL     1       1.928  -0.006   0.512  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.497   0.041   0.225  1.00  0.00           C  
HETATM   10  O   UNL     1      -5.168  -1.122   0.329  1.00  0.00           O  
HETATM   11  O   UNL     1      -5.087   1.096   0.348  1.00  0.00           O  
HETATM   12 BR   UNL     1       3.861  -0.015   0.152  1.00  0.00          Br  
HETATM   13  H   UNL     1      -0.447   2.155  -0.486  1.00  0.00           H  
HETATM   14  H   UNL     1      -2.865   2.178  -0.040  1.00  0.00           H  
HETATM   15  H   UNL     1      -2.897  -2.111  -0.099  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.477  -2.111  -0.539  1.00  0.00           H  
HETATM   17  H   UNL     1       1.420  -0.871  -1.394  1.00  0.00           H  
HETATM   18  H   UNL     1       1.432   0.909  -1.374  1.00  0.00           H  
HETATM   19  H   UNL     1       1.671   0.879   1.094  1.00  0.00           H  
HETATM   20  H   UNL     1       1.659  -0.901   1.074  1.00  0.00           H  
HETATM   21  H   UNL     1      -6.118  -1.067   0.503  1.00  0.00           H  
CONECT    1    2    6    6   13                                       
CONECT    2    3    3    1   14                                       
CONECT    3    9    2    2    4                                       
CONECT    4    3    5    5   15                                       
CONECT    5    4    4    6   16                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6    8   17   18                                       
CONECT    8   12    7   19   20                                       
CONECT    9   11   11   10    3                                       
CONECT   10    9   21                                                 
CONECT   11    9    9                                                 
CONECT   12    8                                                      
CONECT   13    1                                                      
CONECT   14    2                                                      
CONECT   15    4                                                      
CONECT   16    5                                                      
CONECT   17    7                                                      
CONECT   18    7                                                      
CONECT   19    8                                                      
CONECT   20    8                                                      
CONECT   21   10                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
