COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.096   0.101  -0.799  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.490  -0.518   0.463  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.982  -1.959   0.611  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.508  -1.967   0.721  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.790   1.441   0.215  1.00  0.00           C  
HETATM    6  C   UNL     1       2.105  -0.675  -0.014  1.00  0.00           C  
HETATM    7  C   UNL     1       4.074   0.716  -0.144  1.00  0.00           C  
HETATM    8  C   UNL     1       1.912   1.741   0.022  1.00  0.00           C  
HETATM    9  C   UNL     1       6.373  -2.810  -0.342  1.00  0.00           C  
HETATM   10  C   UNL     1       7.886  -2.810  -0.568  1.00  0.00           C  
HETATM   11  O   UNL     1      -8.539  -1.357  -0.438  1.00  0.00           O  
HETATM   12  C   UNL     1      -7.114  -1.349  -0.540  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.622   0.092  -0.689  1.00  0.00           C  
HETATM   14  S   UNL     1      -2.681  -0.507   0.333  1.00  0.00           S  
HETATM   15  C   UNL     1      -2.283   1.263   0.320  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.046   0.380   0.151  1.00  0.00           N  
HETATM   17  C   UNL     1       1.306   0.464   0.054  1.00  0.00           C  
HETATM   18  C   UNL     1       3.479  -0.544  -0.113  1.00  0.00           C  
HETATM   19  C   UNL     1       3.300   1.856  -0.078  1.00  0.00           C  
HETATM   20  C   UNL     1       1.040   2.920   0.090  1.00  0.00           C  
HETATM   21  O   UNL     1       1.499   4.047   0.067  1.00  0.00           O  
HETATM   22  N   UNL     1      -0.293   2.705   0.185  1.00  0.00           N  
HETATM   23  F   UNL     1       3.882   3.075  -0.108  1.00  0.00           F  
HETATM   24  O   UNL     1       4.256  -1.655  -0.179  1.00  0.00           O  
HETATM   25  C   UNL     1       5.668  -1.454  -0.279  1.00  0.00           C  
HETATM   26  C   UNL     1       7.317  -3.170   0.807  1.00  0.00           C  
HETATM   27  H   UNL     1      -4.745   1.128  -0.904  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.791  -0.479  -1.670  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.795   0.062   1.334  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.677  -2.538  -0.260  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.551  -2.399   1.510  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.859  -2.994   0.827  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.813  -1.388   1.592  1.00  0.00           H  
HETATM   34  H   UNL     1       1.654  -1.656   0.010  1.00  0.00           H  
HETATM   35  H   UNL     1       5.148   0.800  -0.222  1.00  0.00           H  
HETATM   36  H   UNL     1       5.797  -3.619  -0.792  1.00  0.00           H  
HETATM   37  H   UNL     1       8.306  -3.619  -1.166  1.00  0.00           H  
HETATM   38  H   UNL     1       8.379  -1.844  -0.671  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.991  -0.979  -1.205  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.809  -1.929  -1.412  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.927   0.672   0.183  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.053   0.533  -1.587  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.639   1.722   1.243  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.767   1.738  -0.533  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.899   3.461   0.232  1.00  0.00           H  
HETATM   46  H   UNL     1       6.019  -0.902   0.593  1.00  0.00           H  
HETATM   47  H   UNL     1       5.891  -0.886  -1.182  1.00  0.00           H  
HETATM   48  H   UNL     1       7.436  -2.440   1.608  1.00  0.00           H  
HETATM   49  H   UNL     1       7.362  -4.215   1.113  1.00  0.00           H  
CONECT    1    2   13   27   28                                       
CONECT    2   14    3    1   29                                       
CONECT    3    2    4   30   31                                       
CONECT    4    3   12   32   33                                       
CONECT    5   16   16   22   15                                       
CONECT    6   18   17   17   34                                       
CONECT    7   18   18   19   35                                       
CONECT    8   19   19   17   20                                       
CONECT    9   10   26   25   36                                       
CONECT   10   26    9   37   38                                       
CONECT   11   12   39                                                 
CONECT   12    4   13   11   40                                       
CONECT   13    1   12   41   42                                       
CONECT   14   15    2                                                 
CONECT   15    5   14   43   44                                       
CONECT   16   17    5    5                                            
CONECT   17    6    6    8   16                                       
CONECT   18   24    7    7    6                                       
CONECT   19    7   23    8    8                                       
CONECT   20    8   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20    5   45                                            
CONECT   23   19                                                      
CONECT   24   25   18                                                 
CONECT   25    9   24   46   47                                       
CONECT   26   10    9   48   49                                       
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   22                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
