COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.406   2.135   0.111  1.00  0.00           C  
HETATM    2  C   UNL     1       2.749  -2.097  -0.426  1.00  0.00           C  
HETATM    3  C   UNL     1       5.932   0.667  -1.633  1.00  0.00           C  
HETATM    4  C   UNL     1       4.922   1.627  -1.004  1.00  0.00           C  
HETATM    5  C   UNL     1       5.806   2.734   1.096  1.00  0.00           C  
HETATM    6  C   UNL     1       4.344   0.772   1.191  1.00  0.00           C  
HETATM    7  C   UNL     1       3.842  -0.404   0.449  1.00  0.00           C  
HETATM    8  C   UNL     1       2.647  -1.045   0.500  1.00  0.00           C  
HETATM    9  C   UNL     1       1.418  -0.777   1.328  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.896  -1.104   0.577  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.341   0.779   0.405  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.603   2.700  -0.280  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.740   1.916  -0.381  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.679   0.563  -0.089  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.482  -0.006   0.304  1.00  0.00           C  
HETATM   16  C   UNL     1       0.628  -3.017   0.451  1.00  0.00           C  
HETATM   17  C   UNL     1       1.637  -3.076  -0.703  1.00  0.00           C  
HETATM   18  C   UNL     1       5.968  -0.642  -0.836  1.00  0.00           C  
HETATM   19  F   UNL     1      -5.911   2.471  -0.765  1.00  0.00           F  
HETATM   20  F   UNL     1       7.202   1.255  -1.621  1.00  0.00           F  
HETATM   21  N   UNL     1       0.335  -1.615   0.777  1.00  0.00           N  
HETATM   22  N   UNL     1      -1.128   0.204   0.802  1.00  0.00           N  
HETATM   23  N   UNL     1       3.937  -2.040  -0.963  1.00  0.00           N  
HETATM   24  N   UNL     1       4.609  -1.054  -0.484  1.00  0.00           N  
HETATM   25  N   UNL     1       5.009   1.691   0.446  1.00  0.00           N  
HETATM   26  O   UNL     1       4.168   0.908   2.387  1.00  0.00           O  
HETATM   27  O   UNL     1      -1.798  -1.824   0.193  1.00  0.00           O  
HETATM   28 BR   UNL     1      -6.233  -0.505  -0.226  1.00  0.00          Br  
HETATM   29  H   UNL     1      -1.520   2.748   0.194  1.00  0.00           H  
HETATM   30  H   UNL     1       5.640   0.457  -2.662  1.00  0.00           H  
HETATM   31  H   UNL     1       5.091   2.625  -1.409  1.00  0.00           H  
HETATM   32  H   UNL     1       3.918   1.306  -1.280  1.00  0.00           H  
HETATM   33  H   UNL     1       5.181   3.608   1.279  1.00  0.00           H  
HETATM   34  H   UNL     1       6.193   2.358   2.044  1.00  0.00           H  
HETATM   35  H   UNL     1       6.639   3.011   0.449  1.00  0.00           H  
HETATM   36  H   UNL     1       1.604  -1.047   2.367  1.00  0.00           H  
HETATM   37  H   UNL     1       1.145   0.276   1.258  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.653   3.754  -0.508  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.434  -1.061   0.531  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.292  -3.521   0.156  1.00  0.00           H  
HETATM   41  H   UNL     1       1.049  -3.513   1.326  1.00  0.00           H  
HETATM   42  H   UNL     1       1.140  -2.811  -1.636  1.00  0.00           H  
HETATM   43  H   UNL     1       2.047  -4.083  -0.779  1.00  0.00           H  
HETATM   44  H   UNL     1       6.437  -1.420  -1.439  1.00  0.00           H  
HETATM   45  H   UNL     1       6.549  -0.495   0.075  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.454   0.748   1.239  1.00  0.00           H  
CONECT    1   12   12   11   29                                       
CONECT    2   23   23    8   17                                       
CONECT    3   20    4   18   30                                       
CONECT    4    3   25   31   32                                       
CONECT    5   25   33   34   35                                       
CONECT    6   25    7   26   26                                       
CONECT    7   24    6    8    8                                       
CONECT    8    7    7    2    9                                       
CONECT    9    8   21   36   37                                       
CONECT   10   21   22   27   27                                       
CONECT   11    1   22   15   15                                       
CONECT   12    1    1   13   38                                       
CONECT   13   12   19   14   14                                       
CONECT   14   13   13   15   28                                       
CONECT   15   11   11   14   39                                       
CONECT   16   17   21   40   41                                       
CONECT   17    2   16   42   43                                       
CONECT   18    3   24   44   45                                       
CONECT   19   13                                                      
CONECT   20    3                                                      
CONECT   21    9   16   10                                            
CONECT   22   10   11   46                                            
CONECT   23   24    2    2                                            
CONECT   24   18   23    7                                            
CONECT   25    4    5    6                                            
CONECT   26    6    6                                                 
CONECT   27   10   10                                                 
CONECT   28   14                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   12                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   22                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
