COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.740   4.758  -0.216  1.00  0.00           N  
HETATM    2  N   UNL     1      -2.790   0.397  -0.702  1.00  0.00           N  
HETATM    3  C   UNL     1       4.210   1.086   0.026  1.00  0.00           C  
HETATM    4  C   UNL     1       3.555   2.321  -0.013  1.00  0.00           C  
HETATM    5  C   UNL     1       4.354   3.559  -0.175  1.00  0.00           C  
HETATM    6  C   UNL     1       1.473   1.331   0.238  1.00  0.00           C  
HETATM    7  C   UNL     1       0.075   1.450   0.352  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.182   0.468   0.633  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.972  -0.285   0.172  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.214   0.759  -0.652  1.00  0.00           C  
HETATM   11  C   UNL     1       1.245  -1.085   0.457  1.00  0.00           C  
HETATM   12  N   UNL     1       5.402  -3.114  -0.280  1.00  0.00           N  
HETATM   13  C   UNL     1       6.368  -3.987  -0.952  1.00  0.00           C  
HETATM   14  O   UNL     1       5.564   3.493  -0.272  1.00  0.00           O  
HETATM   15  C   UNL     1       5.049  -1.876  -0.675  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.612  -0.937  -1.293  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.386  -1.964  -0.462  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.467   0.041   0.161  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.105  -0.931   0.564  1.00  0.00           C  
HETATM   20  C   UNL     1       2.061   0.042   0.292  1.00  0.00           C  
HETATM   21  C   UNL     1       3.924  -2.408   1.186  1.00  0.00           C  
HETATM   22  C   UNL     1       4.128  -1.404   0.217  1.00  0.00           C  
HETATM   23  C   UNL     1       3.469  -0.078   0.177  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.686   0.334   0.512  1.00  0.00           C  
HETATM   25  F   UNL     1      -6.671   1.308   0.719  1.00  0.00           F  
HETATM   26  F   UNL     1      -6.936   0.031  -1.157  1.00  0.00           F  
HETATM   27  F   UNL     1      -7.159  -0.916   0.910  1.00  0.00           F  
HETATM   28  N   UNL     1       2.242   2.411   0.090  1.00  0.00           N  
HETATM   29  N   UNL     1       4.682  -3.426   0.880  1.00  0.00           N  
HETATM   30  O   UNL     1      -4.762  -1.580  -0.399  1.00  0.00           O  
HETATM   31  H   UNL     1       4.263   5.568  -0.322  1.00  0.00           H  
HETATM   32  H   UNL     1       2.774   4.810  -0.142  1.00  0.00           H  
HETATM   33  H   UNL     1       5.286   1.038  -0.065  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.391   2.423   0.313  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.425   1.426   1.093  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.570  -0.341   1.252  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.605  -0.276   1.198  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.325   1.739  -0.189  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.618   0.787  -1.664  1.00  0.00           H  
HETATM   40  H   UNL     1       1.684  -2.071   0.500  1.00  0.00           H  
HETATM   41  H   UNL     1       7.364  -3.806  -0.547  1.00  0.00           H  
HETATM   42  H   UNL     1       6.092  -5.029  -0.786  1.00  0.00           H  
HETATM   43  H   UNL     1       6.366  -3.776  -2.021  1.00  0.00           H  
HETATM   44  H   UNL     1       5.427  -1.351  -1.540  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.990  -0.937  -2.315  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.553  -1.195  -1.296  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.303  -2.946  -0.928  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.972  -2.004   0.546  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.732  -1.801   0.691  1.00  0.00           H  
HETATM   50  H   UNL     1       3.253  -2.348   2.030  1.00  0.00           H  
CONECT    1    5   31   32                                            
CONECT    2    8   10   16                                            
CONECT    3    4   23   23   33                                       
CONECT    4    5   28   28    3                                       
CONECT    5    1   14   14    4                                       
CONECT    6   28    7    7   20                                       
CONECT    7    6    6   24   34                                       
CONECT    8   24    2   35   36                                       
CONECT    9   10   18   30   37                                       
CONECT   10    2    9   38   39                                       
CONECT   11   20   20   19   40                                       
CONECT   12   15   29   13                                            
CONECT   13   12   41   42   43                                       
CONECT   14    5    5                                                 
CONECT   15   22   22   12   44                                       
CONECT   16    2   17   45   46                                       
CONECT   17   16   30   47   48                                       
CONECT   18    9   25   26   27                                       
CONECT   19   24   24   11   49                                       
CONECT   20    6   23   11   11                                       
CONECT   21   22   29   29   50                                       
CONECT   22   23   21   15   15                                       
CONECT   23    3    3   20   22                                       
CONECT   24    7    8   19   19                                       
CONECT   25   18                                                      
CONECT   26   18                                                      
CONECT   27   18                                                      
CONECT   28    4    4    6                                            
CONECT   29   21   21   12                                            
CONECT   30    9   17                                                 
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   19                                                      
CONECT   50   21                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
