COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.747  -3.368  -0.100  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.993  -2.048   0.010  1.00  0.00           C  
HETATM    3  O   UNL     1      -5.136  -1.650   0.114  1.00  0.00           O  
HETATM    4  C   UNL     1      -2.873  -1.085   0.006  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.552  -1.513   0.006  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.520  -0.563   0.001  1.00  0.00           C  
HETATM    7  C   UNL     1       0.886  -1.034   0.002  1.00  0.00           C  
HETATM    8  C   UNL     1       1.167  -2.399   0.002  1.00  0.00           C  
HETATM    9  C   UNL     1       2.477  -2.832   0.002  1.00  0.00           C  
HETATM   10  C   UNL     1       3.512  -1.914   0.002  1.00  0.00           C  
HETATM   11  C   UNL     1       3.240  -0.557   0.003  1.00  0.00           C  
HETATM   12 BR   UNL     1       4.661   0.691   0.004  1.00  0.00          Br  
HETATM   13  C   UNL     1       1.932  -0.112  -0.003  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.756   0.732  -0.004  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.992   1.231  -0.005  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.214   2.624  -0.011  1.00  0.00           C  
HETATM   17  F   UNL     1      -1.168   3.478  -0.016  1.00  0.00           F  
HETATM   18  C   UNL     1      -3.490   3.103  -0.012  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.582   2.240  -0.006  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.405   0.887   0.000  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.110   0.359  -0.006  1.00  0.00           C  
HETATM   22  H   UNL     1      -4.512  -3.959  -0.092  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.321  -2.568   0.011  1.00  0.00           H  
HETATM   24  H   UNL     1       0.360  -3.117   0.002  1.00  0.00           H  
HETATM   25  H   UNL     1       2.695  -3.890   0.001  1.00  0.00           H  
HETATM   26  H   UNL     1       4.536  -2.258   0.003  1.00  0.00           H  
HETATM   27  H   UNL     1       1.721   0.947  -0.007  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.657   4.170  -0.016  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.583   2.646  -0.007  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.260   0.228   0.004  1.00  0.00           H  
CONECT    1    2   22                                                 
CONECT    2    3    3    1    4                                       
CONECT    3    2    2                                                 
CONECT    4    2   21   21    5                                       
CONECT    5    4    6    6   23                                       
CONECT    6    5    5   14    7                                       
CONECT    7    6    8    8   13                                       
CONECT    8    7    7    9   24                                       
CONECT    9    8   10   10   25                                       
CONECT   10    9    9   11   26                                       
CONECT   11   13   13   10   12                                       
CONECT   12   11                                                      
CONECT   13    7   11   11   27                                       
CONECT   14   15   15    6                                            
CONECT   15   21   16   14   14                                       
CONECT   16   18   18   15   17                                       
CONECT   17   16                                                      
CONECT   18   19   16   16   28                                       
CONECT   19   20   20   18   29                                       
CONECT   20   19   19   21   30                                       
CONECT   21   20    4    4   15                                       
CONECT   22    1                                                      
CONECT   23    5                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   13                                                      
CONECT   28   18                                                      
CONECT   29   19                                                      
CONECT   30   20                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
