COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.405   3.560  -0.290  1.00  0.00           C  
HETATM    2  C   UNL     1       4.424   3.934   0.566  1.00  0.00           C  
HETATM    3  C   UNL     1       5.498   3.089   0.772  1.00  0.00           C  
HETATM    4  C   UNL     1       5.553   1.870   0.124  1.00  0.00           C  
HETATM    5  N   UNL     1       3.859  -1.169  -0.581  1.00  0.00           N  
HETATM    6  F   UNL     1      -6.748   1.057  -2.208  1.00  0.00           F  
HETATM    7  C   UNL     1      -5.802   0.037  -2.052  1.00  0.00           C  
HETATM    8  F   UNL     1      -6.458  -1.192  -1.930  1.00  0.00           F  
HETATM    9  F   UNL     1      -4.960   0.007  -3.168  1.00  0.00           F  
HETATM   10  C   UNL     1      -4.985   0.296  -0.812  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.978  -0.581  -0.454  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.240   1.413  -0.039  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.491   1.653   1.098  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.484   0.772   1.462  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.747   1.005   2.580  1.00  0.00           O  
HETATM   16  C   UNL     1      -3.063   2.178   3.332  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.135   2.271   4.545  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.227  -0.346   0.681  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.130  -1.303   1.071  1.00  0.00           C  
HETATM   20  S   UNL     1      -0.572  -0.783   0.301  1.00  0.00           S  
HETATM   21  C   UNL     1       0.573  -1.999   0.862  1.00  0.00           C  
HETATM   22  C   UNL     1       0.226  -3.050   1.692  1.00  0.00           C  
HETATM   23  C   UNL     1       1.227  -3.872   2.012  1.00  0.00           C  
HETATM   24  S   UNL     1       2.689  -3.379   1.285  1.00  0.00           S  
HETATM   25  C   UNL     1       1.904  -2.007   0.516  1.00  0.00           C  
HETATM   26  C   UNL     1       2.541  -1.059  -0.319  1.00  0.00           C  
HETATM   27  O   UNL     1       1.898  -0.144  -0.803  1.00  0.00           O  
HETATM   28  S   UNL     1       4.604  -0.059  -1.558  1.00  0.00           S  
HETATM   29  O   UNL     1       5.976  -0.426  -1.608  1.00  0.00           O  
HETATM   30  O   UNL     1       3.790   0.065  -2.717  1.00  0.00           O  
HETATM   31  C   UNL     1       4.534   1.495  -0.732  1.00  0.00           C  
HETATM   32  C   UNL     1       3.460   2.341  -0.939  1.00  0.00           C  
HETATM   33  H   UNL     1       2.563   4.218  -0.448  1.00  0.00           H  
HETATM   34  H   UNL     1       4.380   4.887   1.072  1.00  0.00           H  
HETATM   35  H   UNL     1       6.294   3.382   1.441  1.00  0.00           H  
HETATM   36  H   UNL     1       6.392   1.210   0.285  1.00  0.00           H  
HETATM   37  H   UNL     1       4.370  -1.897  -0.196  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.779  -1.451  -1.062  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.024   2.099  -0.323  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.690   2.526   1.702  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.931   3.059   2.705  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.098   2.124   3.670  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.267   1.390   5.173  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.100   2.325   4.207  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.377   3.166   5.119  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.017  -1.303   2.155  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.386  -2.306   0.732  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.781  -3.194   2.054  1.00  0.00           H  
HETATM   49  H   UNL     1       1.125  -4.737   2.650  1.00  0.00           H  
HETATM   50  H   UNL     1       2.664   2.048  -1.608  1.00  0.00           H  
CONECT    1   32   32    2   33                                       
CONECT    2    1    3    3   34                                       
CONECT    3    2    2    4   35                                       
CONECT    4   31   31    3   36                                       
CONECT    5   26   28   37                                            
CONECT    6    7                                                      
CONECT    7    8    9   10    6                                       
CONECT    8    7                                                      
CONECT    9    7                                                      
CONECT   10   11    7   12   12                                       
CONECT   11   18   18   10   38                                       
CONECT   12   10   10   13   39                                       
CONECT   13   14   14   12   40                                       
CONECT   14   18   15   13   13                                       
CONECT   15   14   16                                                 
CONECT   16   15   17   41   42                                       
CONECT   17   16   43   44   45                                       
CONECT   18   19   11   11   14                                       
CONECT   19   20   18   46   47                                       
CONECT   20   21   19                                                 
CONECT   21   22   25   25   20                                       
CONECT   22   23   23   21   48                                       
CONECT   23   24   22   22   49                                       
CONECT   24   23   25                                                 
CONECT   25   24   21   21   26                                       
CONECT   26   25    5   27   27                                       
CONECT   27   26   26                                                 
CONECT   28   31    5   29   29                                       
CONECT   28   30   30                                                 
CONECT   29   28   28                                                 
CONECT   30   28   28                                                 
CONECT   31   32    4    4   28                                       
CONECT   32    1    1   31   50                                       
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   32                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
