COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.766  -0.622  -1.198  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.833  -0.420   0.000  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.142  -0.494   1.201  1.00  0.00           C  
HETATM    4  C   UNL     1       2.608  -0.371   0.000  1.00  0.00           C  
HETATM    5  C   UNL     1       3.204   0.871   0.001  1.00  0.00           C  
HETATM    6  C   UNL     1       2.419   2.021   0.001  1.00  0.00           C  
HETATM    7  C   UNL     1       1.016   1.909   0.000  1.00  0.00           C  
HETATM    8  C   UNL     1       0.498   3.225   0.000  1.00  0.00           C  
HETATM    9  C   UNL     1       0.423   0.633   0.000  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.579  -0.824   0.000  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.079  -0.685   0.000  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.142  -0.489  -1.201  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.767  -0.621   1.198  1.00  0.00           C  
HETATM   14  C   UNL     1       1.224  -0.492  -0.005  1.00  0.00           C  
HETATM   15 BR   UNL     1       3.684  -1.926   0.000  1.00  0.00          Br  
HETATM   16  N   UNL     1       1.493   4.065   0.000  1.00  0.00           N  
HETATM   17  N   UNL     1       2.704   3.363   0.001  1.00  0.00           N  
HETATM   18  N   UNL     1      -0.965   0.506   0.000  1.00  0.00           N  
HETATM   19  O   UNL     1      -7.186  -0.295   0.000  1.00  0.00           O  
HETATM   20  H   UNL     1      -3.227  -0.672  -2.132  1.00  0.00           H  
HETATM   21  H   UNL     1      -5.678  -0.440   2.137  1.00  0.00           H  
HETATM   22  H   UNL     1       4.281   0.952   0.001  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.549   3.490  -0.001  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.264  -1.369   0.890  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.264  -1.369  -0.890  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.678  -0.439  -2.137  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.228  -0.678   2.133  1.00  0.00           H  
HETATM   28  H   UNL     1       0.771  -1.472  -0.006  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.525   1.298   0.000  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.497   0.621   0.007  1.00  0.00           H  
HETATM   31  H   UNL     1       3.590   3.756   0.002  1.00  0.00           H  
CONECT    1   12   11   11   20                                       
CONECT    2   19   12   12    3                                       
CONECT    3    2   13   13   21                                       
CONECT    4   14    5    5   15                                       
CONECT    5    6    4    4   22                                       
CONECT    6    7    7   17    5                                       
CONECT    7    8    9    6    6                                       
CONECT    8    7   16   16   23                                       
CONECT    9   18    7   14   14                                       
CONECT   10   11   18   24   25                                       
CONECT   11    1    1   13   10                                       
CONECT   12    2    2    1   26                                       
CONECT   13    3    3   11   27                                       
CONECT   14    9    9    4   28                                       
CONECT   15    4                                                      
CONECT   16    8    8   17                                            
CONECT   17   16    6   31                                            
CONECT   18   10    9   29                                            
CONECT   19    2   30                                                 
CONECT   20    1                                                      
CONECT   21    3                                                      
CONECT   22    5                                                      
CONECT   23    8                                                      
CONECT   24   10                                                      
CONECT   25   10                                                      
CONECT   26   12                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29   18                                                      
CONECT   30   19                                                      
CONECT   31   17                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
