COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.979  -1.169  -0.883  1.00  0.00           C  
HETATM    2  C   UNL     1       5.850  -2.163  -0.478  1.00  0.00           C  
HETATM    3  C   UNL     1       6.440  -2.097   0.773  1.00  0.00           C  
HETATM    4  F   UNL     1       7.292  -3.068   1.171  1.00  0.00           F  
HETATM    5  C   UNL     1       6.157  -1.036   1.617  1.00  0.00           C  
HETATM    6  C   UNL     1       5.289  -0.041   1.207  1.00  0.00           C  
HETATM    7  C   UNL     1       4.697  -0.111  -0.040  1.00  0.00           C  
HETATM    8  S   UNL     1       3.586   1.155  -0.558  1.00  0.00           S  
HETATM    9  O   UNL     1       4.014   2.279   0.198  1.00  0.00           O  
HETATM   10  O   UNL     1       3.696   1.111  -1.974  1.00  0.00           O  
HETATM   11  C   UNL     1       1.973   0.545   0.006  1.00  0.00           C  
HETATM   12  C   UNL     1       0.885   1.551  -0.377  1.00  0.00           C  
HETATM   13  O   UNL     1       1.096   2.773   0.333  1.00  0.00           O  
HETATM   14  C   UNL     1       0.944   1.819  -1.882  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.467   0.990  -0.019  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.625  -0.211   0.055  1.00  0.00           O  
HETATM   17  N   UNL     1      -1.500   1.821   0.220  1.00  0.00           N  
HETATM   18  C   UNL     1      -2.777   1.302   0.438  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.180   0.148  -0.225  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.647   1.945   1.314  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.907   1.436   1.532  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.313   0.273   0.871  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.624  -0.259   1.095  1.00  0.00           C  
HETATM   24  N   UNL     1      -7.664  -0.681   1.272  1.00  0.00           N  
HETATM   25  C   UNL     1      -4.437  -0.370  -0.008  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.870  -1.624  -0.722  1.00  0.00           C  
HETATM   27  F   UNL     1      -3.830  -2.078  -1.540  1.00  0.00           F  
HETATM   28  F   UNL     1      -5.188  -2.610   0.218  1.00  0.00           F  
HETATM   29  F   UNL     1      -5.995  -1.349  -1.507  1.00  0.00           F  
HETATM   30  H   UNL     1       4.519  -1.220  -1.859  1.00  0.00           H  
HETATM   31  H   UNL     1       6.070  -2.990  -1.136  1.00  0.00           H  
HETATM   32  H   UNL     1       6.616  -0.985   2.593  1.00  0.00           H  
HETATM   33  H   UNL     1       5.068   0.786   1.865  1.00  0.00           H  
HETATM   34  H   UNL     1       1.989   0.421   1.088  1.00  0.00           H  
HETATM   35  H   UNL     1       1.762  -0.415  -0.467  1.00  0.00           H  
HETATM   36  H   UNL     1       1.051   2.561   1.276  1.00  0.00           H  
HETATM   37  H   UNL     1       1.922   2.225  -2.141  1.00  0.00           H  
HETATM   38  H   UNL     1       0.783   0.887  -2.423  1.00  0.00           H  
HETATM   39  H   UNL     1       0.169   2.536  -2.154  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.357   2.780   0.239  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.502  -0.348  -0.904  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.332   2.843   1.824  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.581   1.935   2.212  1.00  0.00           H  
CONECT    1    2    2    7   30                                       
CONECT    2    1    1    3   31                                       
CONECT    3    2    4    5    5                                       
CONECT    4    3                                                      
CONECT    5    3    3    6   32                                       
CONECT    6    5    7    7   33                                       
CONECT    7    1    6    6    8                                       
CONECT    8    7    9    9   10                                       
CONECT    8   10   11                                                 
CONECT    9    8    8                                                 
CONECT   10    8    8                                                 
CONECT   11    8   12   34   35                                       
CONECT   12   11   13   14   15                                       
CONECT   13   12   36                                                 
CONECT   14   12   37   38   39                                       
CONECT   15   12   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   40                                            
CONECT   18   17   19   19   20                                       
CONECT   19   18   18   25   41                                       
CONECT   20   18   21   21   42                                       
CONECT   21   20   20   22   43                                       
CONECT   22   21   23   25   25                                       
CONECT   23   22   24   24   24                                       
CONECT   24   23   23   23                                            
CONECT   25   19   22   22   26                                       
CONECT   26   25   27   28   29                                       
CONECT   27   26                                                      
CONECT   28   26                                                      
CONECT   29   26                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   17                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
