COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.739   0.004  -0.285  1.00  0.00           C  
HETATM    2  O   UNL     1      -5.164  -0.006   0.851  1.00  0.00           O  
HETATM    3  C   UNL     1      -3.253   0.006  -0.534  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.512  -0.006   0.805  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.025  -0.004   0.556  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.344   1.194   0.452  1.00  0.00           C  
HETATM    7  C   UNL     1       1.020   1.196   0.223  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.343  -1.201   0.437  1.00  0.00           C  
HETATM    9  C   UNL     1       1.020  -1.199   0.209  1.00  0.00           C  
HETATM   10  C   UNL     1       1.702  -0.001   0.099  1.00  0.00           C  
HETATM   11 BR   UNL     1       3.567   0.002  -0.214  1.00  0.00          Br  
HETATM   12  N   UNL     1      -5.597   0.007  -1.324  1.00  0.00           N  
HETATM   13  H   UNL     1      -2.980  -0.880  -1.108  1.00  0.00           H  
HETATM   14  H   UNL     1      -2.979   0.900  -1.093  1.00  0.00           H  
HETATM   15  H   UNL     1      -6.553   0.002  -1.164  1.00  0.00           H  
HETATM   16  H   UNL     1      -5.257   0.015  -2.233  1.00  0.00           H  
HETATM   17  H   UNL     1      -2.785   0.879   1.379  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.785  -0.901   1.364  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.876   2.128   0.548  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.875  -2.136   0.523  1.00  0.00           H  
HETATM   21  H   UNL     1       1.552   2.132   0.141  1.00  0.00           H  
HETATM   22  H   UNL     1       1.553  -2.134   0.116  1.00  0.00           H  
CONECT    1    2    2    3   12                                       
CONECT    2    1    1                                                 
CONECT    3    1    4   13   14                                       
CONECT    4    3    5   17   18                                       
CONECT    5    4    6    8    8                                       
CONECT    6    5    7    7   19                                       
CONECT    7    6    6   10   21                                       
CONECT    8    5    5    9   20                                       
CONECT    9    8   10   10   22                                       
CONECT   10    7    9    9   11                                       
CONECT   11   10                                                      
CONECT   12    1   15   16                                            
CONECT   13    3                                                      
CONECT   14    3                                                      
CONECT   15   12                                                      
CONECT   16   12                                                      
CONECT   17    4                                                      
CONECT   18    4                                                      
CONECT   19    6                                                      
CONECT   20    8                                                      
CONECT   21    7                                                      
CONECT   22    9                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
