COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.087  -0.646  -0.314  1.00  0.00           C  
HETATM    2  C   UNL     1       3.944   0.322  -0.001  1.00  0.00           C  
HETATM    3  O   UNL     1       2.672  -0.346  -0.215  1.00  0.00           O  
HETATM    4  C   UNL     1       1.561   0.371   0.017  1.00  0.00           C  
HETATM    5  O   UNL     1       1.648   1.518   0.387  1.00  0.00           O  
HETATM    6  C   UNL     1       0.206  -0.255  -0.184  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.883   0.768   0.147  1.00  0.00           C  
HETATM    8  C   UNL     1       0.062  -1.468   0.738  1.00  0.00           C  
HETATM    9  H   UNL     1       5.018  -1.514   0.342  1.00  0.00           H  
HETATM   10  H   UNL     1       5.016  -0.968  -1.353  1.00  0.00           H  
HETATM   11  H   UNL     1       6.042  -0.145  -0.153  1.00  0.00           H  
HETATM   12  H   UNL     1       4.015   0.644   1.038  1.00  0.00           H  
HETATM   13  H   UNL     1       4.014   1.190  -0.656  1.00  0.00           H  
HETATM   14  H   UNL     1       0.102  -0.573  -1.221  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.779   1.086   1.185  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.781   1.632  -0.509  1.00  0.00           H  
HETATM   17  H   UNL     1      -0.919  -1.921   0.593  1.00  0.00           H  
HETATM   18  H   UNL     1       0.838  -2.197   0.502  1.00  0.00           H  
HETATM   19  H   UNL     1       0.166  -1.150   1.776  1.00  0.00           H  
HETATM   20 BR   UNL     1      -2.652  -0.049  -0.115  1.00  0.00          Br  
CONECT    1    2    9   10   11                                       
CONECT    2    3    1   12   13                                       
CONECT    3    4    2                                                 
CONECT    4    6    5    5    3                                       
CONECT    5    4    4                                                 
CONECT    6    7    8    4   14                                       
CONECT    7    6   15   16   20                                       
CONECT    8    6   17   18   19                                       
CONECT    9    1                                                      
CONECT   10    1                                                      
CONECT   11    1                                                      
CONECT   12    2                                                      
CONECT   13    2                                                      
CONECT   14    6                                                      
CONECT   15    7                                                      
CONECT   16    7                                                      
CONECT   17    8                                                      
CONECT   18    8                                                      
CONECT   19    8                                                      
CONECT   20    7                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
