COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -4.592   2.378  -1.996  1.00  0.00           F  
HETATM    2  C   UNL     1      -3.578   2.255  -1.040  1.00  0.00           C  
HETATM    3  F   UNL     1      -2.852   1.084  -1.279  1.00  0.00           F  
HETATM    4  F   UNL     1      -2.723   3.359  -1.122  1.00  0.00           F  
HETATM    5  C   UNL     1      -4.199   2.194   0.357  1.00  0.00           C  
HETATM    6  O   UNL     1      -5.073   1.066   0.441  1.00  0.00           O  
HETATM    7  C   UNL     1      -4.510  -0.128   0.767  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.280  -1.288   0.761  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.699  -2.504   1.095  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.359  -2.560   1.434  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.596  -1.407   1.440  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.166  -0.194   1.102  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.136  -1.474   1.810  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.301  -1.715   0.551  1.00  0.00           C  
HETATM   15  C   UNL     1       1.181  -1.646   0.905  1.00  0.00           C  
HETATM   16  C   UNL     1       2.037  -1.614  -0.357  1.00  0.00           C  
HETATM   17  C   UNL     1       1.998  -2.980  -1.050  1.00  0.00           C  
HETATM   18  S   UNL     1       0.292  -3.324  -1.571  1.00  0.00           S  
HETATM   19  C   UNL     1      -0.637  -3.092  -0.026  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.119  -2.351  -2.521  1.00  0.00           O  
HETATM   21  N   UNL     1       3.424  -1.289   0.002  1.00  0.00           N  
HETATM   22  C   UNL     1       4.132  -0.678  -1.131  1.00  0.00           C  
HETATM   23  C   UNL     1       5.548  -0.359  -0.726  1.00  0.00           C  
HETATM   24  C   UNL     1       5.847   0.869  -0.168  1.00  0.00           C  
HETATM   25  C   UNL     1       7.146   1.161   0.204  1.00  0.00           C  
HETATM   26  C   UNL     1       8.146   0.225   0.018  1.00  0.00           C  
HETATM   27  C   UNL     1       7.846  -1.004  -0.539  1.00  0.00           C  
HETATM   28  C   UNL     1       6.547  -1.298  -0.907  1.00  0.00           C  
HETATM   29  C   UNL     1       7.473   2.501   0.811  1.00  0.00           C  
HETATM   30  C   UNL     1       7.113   3.611  -0.178  1.00  0.00           C  
HETATM   31  C   UNL     1       6.669   2.687   2.100  1.00  0.00           C  
HETATM   32  C   UNL     1       8.968   2.567   1.129  1.00  0.00           C  
HETATM   33  O   UNL     1       1.428  -0.465   1.670  1.00  0.00           O  
HETATM   34  F   UNL     1      -5.443  -3.632   1.091  1.00  0.00           F  
HETATM   35  N   UNL     1      -6.637  -1.227   0.418  1.00  0.00           N  
HETATM   36  C   UNL     1      -4.994   3.475   0.619  1.00  0.00           C  
HETATM   37  O   UNL     1      -5.953   3.662  -0.424  1.00  0.00           O  
HETATM   38  C   UNL     1      -6.753   4.837  -0.274  1.00  0.00           C  
HETATM   39  H   UNL     1      -3.409   2.098   1.102  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.908  -3.507   1.693  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.567   0.704   1.108  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.835  -0.533   2.271  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.977  -2.291   2.513  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.531  -0.947  -0.188  1.00  0.00           H  
HETATM   45  H   UNL     1       1.449  -2.520   1.499  1.00  0.00           H  
HETATM   46  H   UNL     1       1.653  -0.853  -1.036  1.00  0.00           H  
HETATM   47  H   UNL     1       2.651  -2.965  -1.922  1.00  0.00           H  
HETATM   48  H   UNL     1       2.330  -3.751  -0.355  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.356  -3.866   0.688  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.706  -3.152  -0.230  1.00  0.00           H  
HETATM   51  H   UNL     1       3.913  -2.107   0.335  1.00  0.00           H  
HETATM   52  H   UNL     1       4.142  -1.373  -1.971  1.00  0.00           H  
HETATM   53  H   UNL     1       3.623   0.240  -1.425  1.00  0.00           H  
HETATM   54  H   UNL     1       5.066   1.601  -0.023  1.00  0.00           H  
HETATM   55  H   UNL     1       9.161   0.454   0.308  1.00  0.00           H  
HETATM   56  H   UNL     1       8.627  -1.736  -0.685  1.00  0.00           H  
HETATM   57  H   UNL     1       6.312  -2.260  -1.339  1.00  0.00           H  
HETATM   58  H   UNL     1       6.048   3.565  -0.405  1.00  0.00           H  
HETATM   59  H   UNL     1       7.349   4.581   0.261  1.00  0.00           H  
HETATM   60  H   UNL     1       7.685   3.479  -1.096  1.00  0.00           H  
HETATM   61  H   UNL     1       6.925   1.896   2.805  1.00  0.00           H  
HETATM   62  H   UNL     1       6.905   3.656   2.539  1.00  0.00           H  
HETATM   63  H   UNL     1       5.604   2.640   1.873  1.00  0.00           H  
HETATM   64  H   UNL     1       9.541   2.435   0.211  1.00  0.00           H  
HETATM   65  H   UNL     1       9.204   3.536   1.568  1.00  0.00           H  
HETATM   66  H   UNL     1       9.224   1.776   1.834  1.00  0.00           H  
HETATM   67  H   UNL     1       2.348  -0.361   1.949  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.042  -0.377   0.185  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.173  -2.036   0.414  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.508   3.394   1.576  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.313   4.326   0.643  1.00  0.00           H  
HETATM   72  H   UNL     1      -7.304   4.784   0.665  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.109   5.716  -0.269  1.00  0.00           H  
HETATM   74  H   UNL     1      -7.455   4.906  -1.104  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    4    5                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    2    6   36   39                                       
CONECT    6    5    7                                                 
CONECT    7   12    6    8    8                                       
CONECT    8    7    7    9   35                                       
CONECT    9   10   10    8   34                                       
CONECT   10   11    9    9   40                                       
CONECT   11   13   12   12   10                                       
CONECT   12   11   11    7   41                                       
CONECT   13   14   11   42   43                                       
CONECT   14   15   13   19   44                                       
CONECT   15   33   16   14   45                                       
CONECT   16   21   15   17   46                                       
CONECT   17   16   18   47   48                                       
CONECT   18   17   19   20   20                                       
CONECT   19   14   18   49   50                                       
CONECT   20   18   18                                                 
CONECT   21   22   16   51                                            
CONECT   22   21   23   52   53                                       
CONECT   23   22   24   24   28                                       
CONECT   24   23   23   25   54                                       
CONECT   25   24   29   26   26                                       
CONECT   26   25   25   27   55                                       
CONECT   27   28   28   26   56                                       
CONECT   28   23   27   27   57                                       
CONECT   29   30   32   25   31                                       
CONECT   30   29   58   59   60                                       
CONECT   31   29   61   62   63                                       
CONECT   32   29   64   65   66                                       
CONECT   33   15   67                                                 
CONECT   34    9                                                      
CONECT   35    8   68   69                                            
CONECT   36    5   37   70   71                                       
CONECT   37   36   38                                                 
CONECT   38   37   72   73   74                                       
CONECT   39    5                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   24                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   35                                                      
CONECT   69   35                                                      
CONECT   70   36                                                      
CONECT   71   36                                                      
CONECT   72   38                                                      
CONECT   73   38                                                      
CONECT   74   38                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
