COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.016  -0.003  -0.023  1.00  0.00           C  
HETATM    2  C   UNL     1       2.991  -1.156   0.744  1.00  0.00           C  
HETATM    3  C   UNL     1       1.817  -1.864   0.891  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.862  -1.632  -0.142  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.397  -2.173  -1.316  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.226  -0.628  -1.194  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.852   2.362   0.201  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.943   2.379  -0.595  1.00  0.00           O  
HETATM    9  O   UNL     1      -4.343   3.514   0.684  1.00  0.00           O  
HETATM   10  C   UNL     1      -4.436   1.047   0.650  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.713  -0.084  -0.035  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.570  -1.670  -1.832  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.530  -0.577   0.502  1.00  0.00           C  
HETATM   14  N   UNL     1      -2.011  -0.031   1.668  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.610  -2.170   0.419  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.615  -3.233   1.008  1.00  0.00           O  
HETATM   17  C   UNL     1       0.652  -1.416   0.265  1.00  0.00           C  
HETATM   18 BR   UNL     1       4.631   0.961  -0.219  1.00  0.00          Br  
HETATM   19  C   UNL     1       1.866   0.443  -0.651  1.00  0.00           C  
HETATM   20  C   UNL     1       0.684  -0.253  -0.507  1.00  0.00           C  
HETATM   21  H   UNL     1       3.893  -1.502   1.228  1.00  0.00           H  
HETATM   22  H   UNL     1       1.798  -2.763   1.489  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.889  -2.984  -1.818  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.146  -0.241  -1.607  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.937   4.332   0.366  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.322   0.950   1.730  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.494   1.012   0.391  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.981  -2.089  -2.738  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.162  -0.346   2.015  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.498   0.665   2.135  1.00  0.00           H  
HETATM   31  H   UNL     1       1.892   1.343  -1.248  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.213   0.096  -0.998  1.00  0.00           H  
CONECT    1   19   18    2    2                                       
CONECT    2    1    1    3   21                                       
CONECT    3   17   17    2   22                                       
CONECT    4   15   13   13    5                                       
CONECT    5    4   12   12   23                                       
CONECT    6   11   11   12   24                                       
CONECT    7   10    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   25                                                 
CONECT   10   11    7   26   27                                       
CONECT   11   13   10    6    6                                       
CONECT   12    5    5    6   28                                       
CONECT   13   14    4    4   11                                       
CONECT   14   13   29   30                                            
CONECT   15   16   16   17    4                                       
CONECT   16   15   15                                                 
CONECT   17   20   15    3    3                                       
CONECT   18    1                                                      
CONECT   19   20   20    1   31                                       
CONECT   20   19   19   17   32                                       
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    5                                                      
CONECT   24    6                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   10                                                      
CONECT   28   12                                                      
CONECT   29   14                                                      
CONECT   30   14                                                      
CONECT   31   19                                                      
CONECT   32   20                                                      
MASTER        0    0    0    0    0    0    0    0   32    0   32    0
END
