COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.926   0.359  -1.068  1.00  0.00           C  
HETATM    2  C   UNL     1       1.865  -0.262  -0.447  1.00  0.00           C  
HETATM    3  C   UNL     1       0.967   0.466   0.340  1.00  0.00           C  
HETATM    4  C   UNL     1       1.153   1.830   0.494  1.00  0.00           C  
HETATM    5  C   UNL     1       2.234   2.449  -0.141  1.00  0.00           C  
HETATM    6  C   UNL     1       3.112   1.721  -0.914  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.070  -0.261   0.921  1.00  0.00           N  
HETATM    8  C   UNL     1      -1.341   0.134   1.008  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.710   1.504   0.604  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.004   2.604   1.286  1.00  0.00           C  
HETATM   11  N   UNL     1       0.328   2.659   1.250  1.00  0.00           N  
HETATM   12  C   UNL     1      -2.664   1.743  -0.362  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.289   0.708  -0.965  1.00  0.00           N  
HETATM   14  C   UNL     1      -4.303   0.962  -1.991  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.849  -0.370  -2.509  1.00  0.00           C  
HETATM   16  O   UNL     1      -5.539  -1.044  -1.454  1.00  0.00           O  
HETATM   17  C   UNL     1      -6.091  -2.306  -1.834  1.00  0.00           C  
HETATM   18  C   UNL     1       0.249  -1.512   1.459  1.00  0.00           C  
HETATM   19  C   UNL     1       0.779  -1.605   2.740  1.00  0.00           C  
HETATM   20  C   UNL     1       1.092  -2.842   3.268  1.00  0.00           C  
HETATM   21  C   UNL     1       0.879  -3.987   2.523  1.00  0.00           C  
HETATM   22  C   UNL     1       0.352  -3.899   1.248  1.00  0.00           C  
HETATM   23  C   UNL     1       0.031  -2.665   0.716  1.00  0.00           C  
HETATM   24  C   UNL     1       0.979   3.678   2.077  1.00  0.00           C  
HETATM   25  C   UNL     1       3.885  -0.444  -1.908  1.00  0.00           C  
HETATM   26  F   UNL     1       3.433  -0.476  -3.231  1.00  0.00           F  
HETATM   27  F   UNL     1       5.153   0.147  -1.862  1.00  0.00           F  
HETATM   28  F   UNL     1       3.961  -1.749  -1.410  1.00  0.00           F  
HETATM   29  O   UNL     1      -2.192  -0.632   1.419  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.634   3.459   1.880  1.00  0.00           O  
HETATM   31  H   UNL     1       1.724  -1.325  -0.571  1.00  0.00           H  
HETATM   32  H   UNL     1       2.382   3.512  -0.024  1.00  0.00           H  
HETATM   33  H   UNL     1       3.942   2.213  -1.399  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.913   2.757  -0.637  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.116   1.546  -1.561  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.854   1.515  -2.816  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.538  -0.185  -3.333  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.024  -0.991  -2.858  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.806  -2.161  -2.644  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.292  -2.967  -2.169  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.598  -2.753  -0.979  1.00  0.00           H  
HETATM   42  H   UNL     1       0.946  -0.711   3.322  1.00  0.00           H  
HETATM   43  H   UNL     1       1.504  -2.914   4.264  1.00  0.00           H  
HETATM   44  H   UNL     1       1.126  -4.953   2.938  1.00  0.00           H  
HETATM   45  H   UNL     1       0.188  -4.795   0.669  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.380  -2.597  -0.280  1.00  0.00           H  
HETATM   47  H   UNL     1       1.093   4.595   1.500  1.00  0.00           H  
HETATM   48  H   UNL     1       0.369   3.875   2.958  1.00  0.00           H  
HETATM   49  H   UNL     1       1.961   3.320   2.388  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.066  -0.203  -0.719  1.00  0.00           H  
CONECT    1   25    2    2    6                                       
CONECT    2    1    1    3   31                                       
CONECT    3    2    7    4    4                                       
CONECT    4    3    3    5   11                                       
CONECT    5    6    6    4   32                                       
CONECT    6    1    5    5   33                                       
CONECT    7    8    3   18                                            
CONECT    8   29   29    9    7                                       
CONECT    9   12   12    8   10                                       
CONECT   10    9   11   30   30                                       
CONECT   11    4   10   24                                            
CONECT   12   13    9    9   34                                       
CONECT   13   14   12   50                                            
CONECT   14   15   13   35   36                                       
CONECT   15   16   14   37   38                                       
CONECT   16   17   15                                                 
CONECT   17   16   39   40   41                                       
CONECT   18   23    7   19   19                                       
CONECT   19   18   18   20   42                                       
CONECT   20   21   21   19   43                                       
CONECT   21   22   20   20   44                                       
CONECT   22   23   23   21   45                                       
CONECT   23   22   22   18   46                                       
CONECT   24   11   47   48   49                                       
CONECT   25   28   26   27    1                                       
CONECT   26   25                                                      
CONECT   27   25                                                      
CONECT   28   25                                                      
CONECT   29    8    8                                                 
CONECT   30   10   10                                                 
CONECT   31    2                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34   12                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   13                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
