COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.865   0.028  -0.064  1.00  0.00           C  
HETATM    2  C   UNL     1       5.310   0.157  -0.455  1.00  0.00           C  
HETATM    3  C   UNL     1       7.677   0.304  -0.810  1.00  0.00           C  
HETATM    4  C   UNL     1       5.365   1.272   0.371  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.088   0.015  -1.206  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.285   0.878  -0.144  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.312   1.009   0.831  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.143   0.277   0.742  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.946  -0.586  -0.320  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.674  -1.388  -0.412  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.764  -2.580   0.505  1.00  0.00           C  
HETATM   12  C   UNL     1       1.698  -0.833  -0.472  1.00  0.00           C  
HETATM   13  C   UNL     1       6.471  -0.326  -1.045  1.00  0.00           C  
HETATM   14  C   UNL     1       7.732   1.414   0.012  1.00  0.00           C  
HETATM   15  C   UNL     1       6.576   1.898   0.603  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.921  -0.721  -1.291  1.00  0.00           C  
HETATM   17  F   UNL     1       6.632   2.983   1.406  1.00  0.00           F  
HETATM   18  N   UNL     1      -1.739  -3.494   0.329  1.00  0.00           N  
HETATM   19  N   UNL     1       0.461  -0.551  -0.016  1.00  0.00           N  
HETATM   20  N   UNL     1       4.089  -0.482  -0.687  1.00  0.00           N  
HETATM   21  O   UNL     1      -1.824  -4.614   1.191  1.00  0.00           O  
HETATM   22  O   UNL     1       0.041  -2.717   1.402  1.00  0.00           O  
HETATM   23  O   UNL     1       1.871  -1.779  -1.210  1.00  0.00           O  
HETATM   24 BR   UNL     1      -5.885   1.880  -0.024  1.00  0.00          Br  
HETATM   25  H   UNL     1       2.692   1.054  -0.390  1.00  0.00           H  
HETATM   26  H   UNL     1       2.973   0.004   1.020  1.00  0.00           H  
HETATM   27  H   UNL     1       8.580  -0.072  -1.269  1.00  0.00           H  
HETATM   28  H   UNL     1       4.464   1.649   0.831  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.847  -0.088  -1.967  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.466   1.683   1.660  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.383   0.379   1.503  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.533  -1.729  -1.438  1.00  0.00           H  
HETATM   33  H   UNL     1       6.431  -1.193  -1.688  1.00  0.00           H  
HETATM   34  H   UNL     1       8.677   1.904   0.195  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.766  -1.395  -2.121  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.383  -3.384  -0.388  1.00  0.00           H  
HETATM   37  H   UNL     1       0.323   0.206   0.575  1.00  0.00           H  
HETATM   38  H   UNL     1       4.052  -1.263  -1.261  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.555  -5.213   0.987  1.00  0.00           H  
CONECT    1   20   12   25   26                                       
CONECT    2   20    4    4   13                                       
CONECT    3   13   13   14   27                                       
CONECT    4    2    2   15   28                                       
CONECT    5   16    6    6   29                                       
CONECT    6    5    5    7   24                                       
CONECT    7    8    8    6   30                                       
CONECT    8    9    7    7   31                                       
CONECT    9   10   16   16    8                                       
CONECT   10   11   19    9   32                                       
CONECT   11   18   22   22   10                                       
CONECT   12    1   23   23   19                                       
CONECT   13    2    3    3   33                                       
CONECT   14   15   15    3   34                                       
CONECT   15    4   17   14   14                                       
CONECT   16    9    9    5   35                                       
CONECT   17   15                                                      
CONECT   18   21   11   36                                            
CONECT   19   12   10   37                                            
CONECT   20    1    2   38                                            
CONECT   21   18   39                                                 
CONECT   22   11   11                                                 
CONECT   23   12   12                                                 
CONECT   24    6                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32   10                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   16                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
