COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.292   0.995  -0.002  1.00  0.00           C  
HETATM    2  C   UNL     1       3.603  -0.373  -0.001  1.00  0.00           C  
HETATM    3  O   UNL     1       4.773  -0.715   0.000  1.00  0.00           O  
HETATM    4  O   UNL     1       2.648  -1.317   0.000  1.00  0.00           O  
HETATM    5  C   UNL     1       1.335  -0.997   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1       0.364  -1.989   0.002  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.972  -1.645   0.002  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.359  -0.313   0.000  1.00  0.00           C  
HETATM    9 BR   UNL     1      -3.197   0.133   0.000  1.00  0.00          Br  
HETATM   10  C   UNL     1      -0.410   0.687  -0.002  1.00  0.00           C  
HETATM   11  C   UNL     1       0.945   0.352  -0.001  1.00  0.00           C  
HETATM   12  C   UNL     1       1.984   1.393  -0.002  1.00  0.00           C  
HETATM   13  O   UNL     1       1.655   2.705   0.003  1.00  0.00           O  
HETATM   14  H   UNL     1       4.083   1.730   0.002  1.00  0.00           H  
HETATM   15  H   UNL     1       0.654  -3.030   0.002  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.724  -2.421   0.003  1.00  0.00           H  
HETATM   17  H   UNL     1      -0.714   1.724  -0.003  1.00  0.00           H  
HETATM   18  H   UNL     1       2.417   3.301   0.007  1.00  0.00           H  
CONECT    1    2   12   12   14                                       
CONECT    2    3    3    4    1                                       
CONECT    3    2    2                                                 
CONECT    4    2    5                                                 
CONECT    5    4    6    6   11                                       
CONECT    6    5    5    7   15                                       
CONECT    7    6    8    8   16                                       
CONECT    8    7    7   10    9                                       
CONECT    9    8                                                      
CONECT   10   11   11    8   17                                       
CONECT   11    5   12   10   10                                       
CONECT   12    1    1   11   13                                       
CONECT   13   12   18                                                 
CONECT   14    1                                                      
CONECT   15    6                                                      
CONECT   16    7                                                      
CONECT   17   10                                                      
CONECT   18   13                                                      
MASTER        0    0    0    0    0    0    0    0   18    0   18    0
END
