COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       7.935   5.612   0.389  1.00  0.00           F  
HETATM    2  C   UNL     1       6.709   4.947   0.280  1.00  0.00           C  
HETATM    3  F   UNL     1       5.881   5.317   1.345  1.00  0.00           F  
HETATM    4  F   UNL     1       6.096   5.295  -0.929  1.00  0.00           F  
HETATM    5  C   UNL     1       6.944   3.436   0.316  1.00  0.00           C  
HETATM    6  N   UNL     1       5.656   2.738   0.201  1.00  0.00           N  
HETATM    7  C   UNL     1       5.843   1.281   0.233  1.00  0.00           C  
HETATM    8  C   UNL     1       4.535   0.616   0.116  1.00  0.00           C  
HETATM    9  C   UNL     1       3.491   0.086   0.023  1.00  0.00           C  
HETATM   10  C   UNL     1       2.219  -0.561  -0.091  1.00  0.00           C  
HETATM   11  N   UNL     1       1.089   0.116  -0.210  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.007  -0.575  -0.306  1.00  0.00           C  
HETATM   13  S   UNL     1       0.377  -2.293  -0.245  1.00  0.00           S  
HETATM   14  C   UNL     1       2.089  -1.905  -0.091  1.00  0.00           C  
HETATM   15  C   UNL     1       3.214  -2.902   0.025  1.00  0.00           C  
HETATM   16  C   UNL     1       4.163  -2.740  -1.164  1.00  0.00           C  
HETATM   17  C   UNL     1       5.305  -3.751  -1.046  1.00  0.00           C  
HETATM   18  C   UNL     1       6.071  -3.507   0.255  1.00  0.00           C  
HETATM   19  C   UNL     1       5.122  -3.669   1.444  1.00  0.00           C  
HETATM   20  C   UNL     1       3.980  -2.657   1.327  1.00  0.00           C  
HETATM   21  N   UNL     1       2.663  -4.264   0.030  1.00  0.00           N  
HETATM   22  C   UNL     1       1.872  -4.520  -1.193  1.00  0.00           C  
HETATM   23  C   UNL     1       0.712  -5.451  -0.794  1.00  0.00           C  
HETATM   24  C   UNL     1       0.879  -5.676   0.726  1.00  0.00           C  
HETATM   25  C   UNL     1       1.725  -4.455   1.166  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.365  -0.008  -0.446  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.542   1.370  -0.483  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.828   1.892  -0.614  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.933   1.025  -0.709  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.733  -0.352  -0.670  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.472  -0.860  -0.546  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.372   3.251  -0.687  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.703   3.134  -0.814  1.00  0.00           C  
HETATM   34  N   UNL     1      -5.056   1.812  -0.828  1.00  0.00           N  
HETATM   35  C   UNL     1      -6.426   1.309  -0.953  1.00  0.00           C  
HETATM   36  C   UNL     1      -6.998   1.037   0.439  1.00  0.00           C  
HETATM   37  C   UNL     1      -8.430   0.511   0.309  1.00  0.00           C  
HETATM   38  C   UNL     1      -9.324   1.605  -0.282  1.00  0.00           C  
HETATM   39  C   UNL     1     -10.765   1.095  -0.354  1.00  0.00           C  
HETATM   40  N   UNL     1     -11.226   0.735   0.994  1.00  0.00           N  
HETATM   41  C   UNL     1     -10.411  -0.346   1.562  1.00  0.00           C  
HETATM   42  C   UNL     1      -8.959   0.121   1.691  1.00  0.00           C  
HETATM   43  H   UNL     1       7.588   3.148  -0.514  1.00  0.00           H  
HETATM   44  H   UNL     1       7.421   3.165   1.258  1.00  0.00           H  
HETATM   45  H   UNL     1       5.017   3.036   0.923  1.00  0.00           H  
HETATM   46  H   UNL     1       6.480   0.978  -0.598  1.00  0.00           H  
HETATM   47  H   UNL     1       6.313   0.995   1.174  1.00  0.00           H  
HETATM   48  H   UNL     1       3.617  -2.914  -2.091  1.00  0.00           H  
HETATM   49  H   UNL     1       4.572  -1.729  -1.168  1.00  0.00           H  
HETATM   50  H   UNL     1       4.896  -4.762  -1.043  1.00  0.00           H  
HETATM   51  H   UNL     1       5.981  -3.636  -1.893  1.00  0.00           H  
HETATM   52  H   UNL     1       6.885  -4.227   0.339  1.00  0.00           H  
HETATM   53  H   UNL     1       6.480  -2.496   0.251  1.00  0.00           H  
HETATM   54  H   UNL     1       4.713  -4.679   1.448  1.00  0.00           H  
HETATM   55  H   UNL     1       5.668  -3.494   2.371  1.00  0.00           H  
HETATM   56  H   UNL     1       4.389  -1.646   1.323  1.00  0.00           H  
HETATM   57  H   UNL     1       3.304  -2.772   2.174  1.00  0.00           H  
HETATM   58  H   UNL     1       1.478  -3.582  -1.584  1.00  0.00           H  
HETATM   59  H   UNL     1       2.497  -5.002  -1.945  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.245  -4.973  -1.003  1.00  0.00           H  
HETATM   61  H   UNL     1       0.786  -6.398  -1.329  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.090  -5.674   1.225  1.00  0.00           H  
HETATM   63  H   UNL     1       1.411  -6.607   0.922  1.00  0.00           H  
HETATM   64  H   UNL     1       2.272  -4.675   2.083  1.00  0.00           H  
HETATM   65  H   UNL     1       1.094  -3.576   1.295  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.691   2.031  -0.410  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.578  -1.021  -0.741  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.328  -1.930  -0.517  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.809   4.172  -0.646  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.393   3.961  -0.892  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.042   2.053  -1.460  1.00  0.00           H  
HETATM   72  H   UNL     1      -6.423   0.385  -1.532  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.383   0.293   0.946  1.00  0.00           H  
HETATM   74  H   UNL     1      -7.002   1.961   1.018  1.00  0.00           H  
HETATM   75  H   UNL     1      -8.439  -0.361  -0.345  1.00  0.00           H  
HETATM   76  H   UNL     1      -9.283   2.491   0.352  1.00  0.00           H  
HETATM   77  H   UNL     1      -8.977   1.857  -1.284  1.00  0.00           H  
HETATM   78  H   UNL     1     -11.407   1.876  -0.760  1.00  0.00           H  
HETATM   79  H   UNL     1     -10.808   0.217  -0.998  1.00  0.00           H  
HETATM   80  H   UNL     1     -11.232   1.541   1.601  1.00  0.00           H  
HETATM   81  H   UNL     1     -10.796  -0.611   2.547  1.00  0.00           H  
HETATM   82  H   UNL     1     -10.456  -1.217   0.909  1.00  0.00           H  
HETATM   83  H   UNL     1      -8.352  -0.687   2.099  1.00  0.00           H  
HETATM   84  H   UNL     1      -8.912   0.983   2.356  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    4    5    3    1                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    2    6   43   44                                       
CONECT    6    5    7   45                                            
CONECT    7    6    8   46   47                                       
CONECT    8    7    9    9    9                                       
CONECT    9    8    8    8   10                                       
CONECT   10   11    9   14   14                                       
CONECT   11   12   12   10                                            
CONECT   12   26   11   11   13                                       
CONECT   13   12   14                                                 
CONECT   14   10   10   13   15                                       
CONECT   15   14   20   16   21                                       
CONECT   16   15   17   48   49                                       
CONECT   17   16   18   50   51                                       
CONECT   18   19   17   52   53                                       
CONECT   19   20   18   54   55                                       
CONECT   20   15   19   56   57                                       
CONECT   21   15   25   22                                            
CONECT   22   21   23   58   59                                       
CONECT   23   24   22   60   61                                       
CONECT   24   25   23   62   63                                       
CONECT   25   21   24   64   65                                       
CONECT   26   31   31   27   12                                       
CONECT   27   28   28   26   66                                       
CONECT   28   29   32   27   27                                       
CONECT   29   30   30   34   28                                       
CONECT   30   29   29   31   67                                       
CONECT   31   30   26   26   68                                       
CONECT   32   33   33   28   69                                       
CONECT   33   34   32   32   70                                       
CONECT   34   35   29   33                                            
CONECT   35   36   34   71   72                                       
CONECT   36   37   35   73   74                                       
CONECT   37   38   42   36   75                                       
CONECT   38   39   37   76   77                                       
CONECT   39   38   40   78   79                                       
CONECT   40   39   41   80                                            
CONECT   41   40   42   81   82                                       
CONECT   42   37   41   83   84                                       
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    7                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
CONECT   62   24                                                      
CONECT   63   24                                                      
CONECT   64   25                                                      
CONECT   65   25                                                      
CONECT   66   27                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   32                                                      
CONECT   70   33                                                      
CONECT   71   35                                                      
CONECT   72   35                                                      
CONECT   73   36                                                      
CONECT   74   36                                                      
CONECT   75   37                                                      
CONECT   76   38                                                      
CONECT   77   38                                                      
CONECT   78   39                                                      
CONECT   79   39                                                      
CONECT   80   40                                                      
CONECT   81   41                                                      
CONECT   82   41                                                      
CONECT   83   42                                                      
CONECT   84   42                                                      
MASTER        0    0    0    0    0    0    0    0   84    0   84    0
END
