COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.805  -0.443  -0.128  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.727   3.195   0.083  1.00  0.00           N  
HETATM    3  C   UNL     1      -1.807  -2.039   1.116  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.415  -0.895   0.239  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.268  -0.317  -0.151  1.00  0.00           C  
HETATM    6  C   UNL     1       0.132  -0.819   0.238  1.00  0.00           C  
HETATM    7  C   UNL     1       0.692   0.457   0.185  1.00  0.00           C  
HETATM    8  C   UNL     1       2.078   0.595   0.038  1.00  0.00           C  
HETATM    9  C   UNL     1       2.882  -0.520  -0.057  1.00  0.00           C  
HETATM   10  N   UNL     1       0.227   2.798   0.893  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.123   1.685   0.274  1.00  0.00           C  
HETATM   12  C   UNL     1       0.959  -1.935   0.140  1.00  0.00           C  
HETATM   13  C   UNL     1       2.322  -1.786  -0.006  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.240  -1.036   0.391  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.740   3.704   0.776  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.105  -1.946   1.013  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.117   0.907  -1.024  1.00  0.00           C  
HETATM   18  F   UNL     1      -4.781   0.167  -1.387  1.00  0.00           F  
HETATM   19  F   UNL     1      -5.661  -1.549  -0.161  1.00  0.00           F  
HETATM   20  N   UNL     1      -1.350   1.891  -0.251  1.00  0.00           N  
HETATM   21 BR   UNL     1       4.752  -0.322  -0.256  1.00  0.00          Br  
HETATM   22  H   UNL     1      -5.163   0.271   0.614  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.271  -2.787   1.683  1.00  0.00           H  
HETATM   24  H   UNL     1       2.518   1.580  -0.002  1.00  0.00           H  
HETATM   25  H   UNL     1       0.530  -2.925   0.178  1.00  0.00           H  
HETATM   26  H   UNL     1       2.954  -2.658  -0.082  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.715   4.703   1.188  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.580   0.649  -1.936  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.099   1.311  -1.271  1.00  0.00           H  
CONECT    1   18    4   19   22                                       
CONECT    2   20   15   15                                            
CONECT    3   16   16   14   23                                       
CONECT    4   16    1    5    5                                       
CONECT    5    4    4   14   17                                       
CONECT    6   12   14    7    7                                       
CONECT    7    6    6    8   11                                       
CONECT    8    9    9    7   24                                       
CONECT    9   13   21    8    8                                       
CONECT   10   11   11   15                                            
CONECT   11    7   20   10   10                                       
CONECT   12   13   13    6   25                                       
CONECT   13   12   12    9   26                                       
CONECT   14    3    6    5                                            
CONECT   15    2    2   10   27                                       
CONECT   16    3    3    4                                            
CONECT   17    5   20   28   29                                       
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20   17   11    2                                            
CONECT   21    9                                                      
CONECT   22    1                                                      
CONECT   23    3                                                      
CONECT   24    8                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
CONECT   27   15                                                      
CONECT   28   17                                                      
CONECT   29   17                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
