COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -3.272   3.828   0.633  1.00  0.00           F  
HETATM    2  C   UNL     1      -4.092   2.714   0.845  1.00  0.00           C  
HETATM    3  F   UNL     1      -3.622   1.992   1.948  1.00  0.00           F  
HETATM    4  F   UNL     1      -5.402   3.138   1.090  1.00  0.00           F  
HETATM    5  C   UNL     1      -4.069   1.819  -0.396  1.00  0.00           C  
HETATM    6  O   UNL     1      -4.906   0.682  -0.179  1.00  0.00           O  
HETATM    7  C   UNL     1      -4.315  -0.430   0.336  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.041  -1.611   0.461  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.433  -2.743   0.988  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.109  -2.694   1.387  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.390  -1.519   1.262  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.988  -0.391   0.733  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.948  -1.471   1.699  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.046  -1.849   0.523  1.00  0.00           C  
HETATM   15  C   UNL     1       1.414  -1.667   0.926  1.00  0.00           C  
HETATM   16  C   UNL     1       2.328  -1.775  -0.292  1.00  0.00           C  
HETATM   17  C   UNL     1       2.372  -3.224  -0.785  1.00  0.00           C  
HETATM   18  S   UNL     1       0.706  -3.711  -1.324  1.00  0.00           S  
HETATM   19  C   UNL     1      -0.303  -3.306   0.132  1.00  0.00           C  
HETATM   20  O   UNL     1       0.305  -2.898  -2.418  1.00  0.00           O  
HETATM   21  N   UNL     1       3.683  -1.344   0.076  1.00  0.00           N  
HETATM   22  C   UNL     1       4.421  -0.867  -1.101  1.00  0.00           C  
HETATM   23  C   UNL     1       5.804  -0.434  -0.686  1.00  0.00           C  
HETATM   24  C   UNL     1       6.031   0.872  -0.295  1.00  0.00           C  
HETATM   25  C   UNL     1       7.299   1.269   0.086  1.00  0.00           C  
HETATM   26  C   UNL     1       8.340   0.360   0.077  1.00  0.00           C  
HETATM   27  C   UNL     1       8.113  -0.947  -0.314  1.00  0.00           C  
HETATM   28  C   UNL     1       6.844  -1.345  -0.690  1.00  0.00           C  
HETATM   29  C   UNL     1       7.547   2.693   0.511  1.00  0.00           C  
HETATM   30  C   UNL     1       7.194   3.638  -0.639  1.00  0.00           C  
HETATM   31  C   UNL     1       6.676   3.022   1.726  1.00  0.00           C  
HETATM   32  C   UNL     1       9.022   2.867   0.879  1.00  0.00           C  
HETATM   33  O   UNL     1       1.581  -0.381   1.526  1.00  0.00           O  
HETATM   34  F   UNL     1      -5.134  -3.892   1.112  1.00  0.00           F  
HETATM   35  N   UNL     1      -6.382  -1.658   0.057  1.00  0.00           N  
HETATM   36  C   UNL     1      -4.582   2.608  -1.602  1.00  0.00           C  
HETATM   37  F   UNL     1      -3.763   3.722  -1.814  1.00  0.00           F  
HETATM   38  F   UNL     1      -4.561   1.791  -2.737  1.00  0.00           F  
HETATM   39  F   UNL     1      -5.893   3.033  -1.357  1.00  0.00           F  
HETATM   40  H   UNL     1      -3.048   1.488  -0.586  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.636  -3.574   1.796  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.423   0.525   0.637  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.704  -0.463   2.035  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.793  -2.174   2.517  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.269  -1.202  -0.326  1.00  0.00           H  
HETATM   46  H   UNL     1       1.686  -2.438   1.648  1.00  0.00           H  
HETATM   47  H   UNL     1       1.949  -1.134  -1.087  1.00  0.00           H  
HETATM   48  H   UNL     1       3.065  -3.304  -1.623  1.00  0.00           H  
HETATM   49  H   UNL     1       2.699  -3.876   0.025  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.028  -3.960   0.960  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.359  -3.440  -0.106  1.00  0.00           H  
HETATM   52  H   UNL     1       4.185  -2.086   0.541  1.00  0.00           H  
HETATM   53  H   UNL     1       4.497  -1.671  -1.833  1.00  0.00           H  
HETATM   54  H   UNL     1       3.893  -0.022  -1.543  1.00  0.00           H  
HETATM   55  H   UNL     1       5.217   1.582  -0.287  1.00  0.00           H  
HETATM   56  H   UNL     1       9.331   0.670   0.373  1.00  0.00           H  
HETATM   57  H   UNL     1       8.926  -1.657  -0.321  1.00  0.00           H  
HETATM   58  H   UNL     1       6.666  -2.367  -0.992  1.00  0.00           H  
HETATM   59  H   UNL     1       6.143   3.514  -0.901  1.00  0.00           H  
HETATM   60  H   UNL     1       7.373   4.668  -0.332  1.00  0.00           H  
HETATM   61  H   UNL     1       7.814   3.404  -1.505  1.00  0.00           H  
HETATM   62  H   UNL     1       6.927   2.349   2.546  1.00  0.00           H  
HETATM   63  H   UNL     1       6.855   4.052   2.034  1.00  0.00           H  
HETATM   64  H   UNL     1       5.625   2.898   1.464  1.00  0.00           H  
HETATM   65  H   UNL     1       9.642   2.633   0.014  1.00  0.00           H  
HETATM   66  H   UNL     1       9.201   3.897   1.187  1.00  0.00           H  
HETATM   67  H   UNL     1       9.273   2.194   1.699  1.00  0.00           H  
HETATM   68  H   UNL     1       2.482  -0.201   1.826  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.806  -0.866  -0.311  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.887  -2.481   0.144  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    5    4    3    1                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5   36    6    2   40                                       
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   41                                       
CONECT   11   13   12   12   10                                       
CONECT   12   11   11    7   42                                       
CONECT   13   14   11   43   44                                       
CONECT   14   15   13   19   45                                       
CONECT   15   33   16   14   46                                       
CONECT   16   21   15   17   47                                       
CONECT   17   16   18   48   49                                       
CONECT   18   17   19   20   20                                       
CONECT   19   14   18   50   51                                       
CONECT   20   18   18                                                 
CONECT   21   22   16   52                                            
CONECT   22   21   23   53   54                                       
CONECT   23   22   24   24   28                                       
CONECT   24   23   23   25   55                                       
CONECT   25   24   29   26   26                                       
CONECT   26   25   25   27   56                                       
CONECT   27   28   28   26   57                                       
CONECT   28   23   27   27   58                                       
CONECT   29   30   32   25   31                                       
CONECT   30   29   59   60   61                                       
CONECT   31   29   62   63   64                                       
CONECT   32   29   65   66   67                                       
CONECT   33   15   68                                                 
CONECT   34    9                                                      
CONECT   35    8   69   70                                            
CONECT   36   38   37   39    5                                       
CONECT   37   36                                                      
CONECT   38   36                                                      
CONECT   39   36                                                      
CONECT   40    5                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   24                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
CONECT   69   35                                                      
CONECT   70   35                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
