COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.961   0.186   0.331  1.00  0.00           C  
HETATM    2  C   UNL     1       6.175   1.109   0.190  1.00  0.00           C  
HETATM    3  C   UNL     1       5.440  -0.187   0.616  1.00  0.00           C  
HETATM    4  C   UNL     1       5.659   3.471   0.867  1.00  0.00           C  
HETATM    5  C   UNL     1     -11.974  -0.630   0.907  1.00  0.00           C  
HETATM    6  C   UNL     1       3.010   2.427  -0.303  1.00  0.00           C  
HETATM    7  C   UNL     1     -11.137  -1.685   0.182  1.00  0.00           C  
HETATM    8  C   UNL     1       3.908   1.686   0.690  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.713   1.921  -0.862  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.664   0.566  -0.458  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.317   1.033  -0.592  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.989   1.941  -1.605  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.702   2.379  -1.738  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.329   0.584   0.292  1.00  0.00           C  
HETATM   15  C   UNL     1       0.677   2.396  -1.005  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.042   1.019   0.154  1.00  0.00           C  
HETATM   17  O   UNL     1       0.962   3.185  -1.886  1.00  0.00           O  
HETATM   18  N   UNL     1       1.630   1.956  -0.161  1.00  0.00           N  
HETATM   19  N   UNL     1       5.281   2.204   0.607  1.00  0.00           N  
HETATM   20  O   UNL     1       4.824   4.315   1.116  1.00  0.00           O  
HETATM   21  C   UNL     1       7.120   3.840   0.849  1.00  0.00           C  
HETATM   22  C   UNL     1       7.603   4.759  -0.276  1.00  0.00           C  
HETATM   23  C   UNL     1       7.485   5.295   1.152  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.768   0.182  -0.349  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.115  -0.286  -0.216  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.446  -1.192   0.796  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.746  -1.639   0.918  1.00  0.00           C  
HETATM   28  C   UNL     1      -9.720  -1.192   0.042  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.399  -0.295  -0.962  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.105   0.165  -1.092  1.00  0.00           C  
HETATM   31  N   UNL     1       5.863  -1.324  -0.205  1.00  0.00           N  
HETATM   32  C   UNL     1       6.953  -2.037   0.141  1.00  0.00           C  
HETATM   33  O   UNL     1       7.584  -1.737   1.132  1.00  0.00           O  
HETATM   34  C   UNL     1       7.388  -3.207  -0.704  1.00  0.00           C  
HETATM   35  N   UNL     1       8.777  -3.605  -0.361  1.00  0.00           N  
HETATM   36  C   UNL     1       8.877  -5.014  -0.822  1.00  0.00           C  
HETATM   37  C   UNL     1       7.514  -5.641  -0.457  1.00  0.00           C  
HETATM   38  C   UNL     1       6.535  -4.452  -0.379  1.00  0.00           C  
HETATM   39  F   UNL     1       7.593  -6.287   0.781  1.00  0.00           F  
HETATM   40  O   UNL     1     -13.287  -1.144   1.143  1.00  0.00           O  
HETATM   41  C   UNL     1     -14.155  -0.232   1.820  1.00  0.00           C  
HETATM   42  O   UNL     1     -11.689  -1.923  -1.115  1.00  0.00           O  
HETATM   43  H   UNL     1       3.721   0.032  -0.721  1.00  0.00           H  
HETATM   44  H   UNL     1       3.287  -0.387   0.967  1.00  0.00           H  
HETATM   45  H   UNL     1       7.134   1.187   0.702  1.00  0.00           H  
HETATM   46  H   UNL     1       6.320   1.127  -0.890  1.00  0.00           H  
HETATM   47  H   UNL     1       5.594  -0.393   1.675  1.00  0.00           H  
HETATM   48  H   UNL     1     -11.504  -0.384   1.859  1.00  0.00           H  
HETATM   49  H   UNL     1     -12.041   0.267   0.292  1.00  0.00           H  
HETATM   50  H   UNL     1       3.052   3.497  -0.102  1.00  0.00           H  
HETATM   51  H   UNL     1       3.357   2.235  -1.319  1.00  0.00           H  
HETATM   52  H   UNL     1     -11.144  -2.612   0.755  1.00  0.00           H  
HETATM   53  H   UNL     1       3.522   1.811   1.702  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.750   2.288  -2.287  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.448   3.079  -2.520  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.582  -0.116   1.074  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.278   0.666   0.831  1.00  0.00           H  
HETATM   58  H   UNL     1       1.403   1.327   0.542  1.00  0.00           H  
HETATM   59  H   UNL     1       7.805   3.066   1.196  1.00  0.00           H  
HETATM   60  H   UNL     1       8.605   4.589  -0.669  1.00  0.00           H  
HETATM   61  H   UNL     1       6.864   5.095  -1.003  1.00  0.00           H  
HETATM   62  H   UNL     1       6.669   5.985   1.365  1.00  0.00           H  
HETATM   63  H   UNL     1       8.411   5.478   1.699  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.687  -1.542   1.479  1.00  0.00           H  
HETATM   65  H   UNL     1      -9.003  -2.339   1.699  1.00  0.00           H  
HETATM   66  H   UNL     1     -10.164   0.048  -1.642  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.857   0.868  -1.873  1.00  0.00           H  
HETATM   68  H   UNL     1       5.358  -1.564  -0.998  1.00  0.00           H  
HETATM   69  H   UNL     1       7.312  -2.960  -1.762  1.00  0.00           H  
HETATM   70  H   UNL     1       8.938  -3.538   0.633  1.00  0.00           H  
HETATM   71  H   UNL     1       9.036  -5.051  -1.900  1.00  0.00           H  
HETATM   72  H   UNL     1       9.684  -5.529  -0.301  1.00  0.00           H  
HETATM   73  H   UNL     1       7.201  -6.342  -1.230  1.00  0.00           H  
HETATM   74  H   UNL     1       6.115  -4.372   0.624  1.00  0.00           H  
HETATM   75  H   UNL     1       5.739  -4.568  -1.115  1.00  0.00           H  
HETATM   76  H   UNL     1     -15.131  -0.697   1.961  1.00  0.00           H  
HETATM   77  H   UNL     1     -13.730   0.022   2.790  1.00  0.00           H  
HETATM   78  H   UNL     1     -14.266   0.674   1.223  1.00  0.00           H  
HETATM   79  H   UNL     1     -11.714  -1.139  -1.681  1.00  0.00           H  
CONECT    1    3    8   43   44                                       
CONECT    2    3   19   45   46                                       
CONECT    3   31    2    1   47                                       
CONECT    4   19   20   20   21                                       
CONECT    5   40    7   48   49                                       
CONECT    6    8   18   50   51                                       
CONECT    7   28   42    5   52                                       
CONECT    8    1   19    6   53                                       
CONECT    9   15   16   16   13                                       
CONECT   10   11   24   24   24                                       
CONECT   11   14   14   12   10                                       
CONECT   12   13   13   11   54                                       
CONECT   13    9   12   12   55                                       
CONECT   14   16   11   11   56                                       
CONECT   15   18   17   17    9                                       
CONECT   16    9    9   14   57                                       
CONECT   17   15   15                                                 
CONECT   18    6   15   58                                            
CONECT   19    2    8    4                                            
CONECT   20    4    4                                                 
CONECT   21    4   23   22   59                                       
CONECT   22   21   23   60   61                                       
CONECT   23   21   22   62   63                                       
CONECT   24   10   10   10   25                                       
CONECT   25   24   26   26   30                                       
CONECT   26   25   25   27   64                                       
CONECT   27   26   28   28   65                                       
CONECT   28   27   27   29    7                                       
CONECT   29   30   30   28   66                                       
CONECT   30   25   29   29   67                                       
CONECT   31   32    3   68                                            
CONECT   32   34   33   33   31                                       
CONECT   33   32   32                                                 
CONECT   34   35   32   38   69                                       
CONECT   35   36   34   70                                            
CONECT   36   35   37   71   72                                       
CONECT   37   36   38   39   73                                       
CONECT   38   34   37   74   75                                       
CONECT   39   37                                                      
CONECT   40   41    5                                                 
CONECT   41   40   76   77   78                                       
CONECT   42    7   79                                                 
CONECT   43    1                                                      
CONECT   44    1                                                      
CONECT   45    2                                                      
CONECT   46    2                                                      
CONECT   47    3                                                      
CONECT   48    5                                                      
CONECT   49    5                                                      
CONECT   50    6                                                      
CONECT   51    6                                                      
CONECT   52    7                                                      
CONECT   53    8                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   14                                                      
CONECT   57   16                                                      
CONECT   58   18                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   34                                                      
CONECT   70   35                                                      
CONECT   71   36                                                      
CONECT   72   36                                                      
CONECT   73   37                                                      
CONECT   74   38                                                      
CONECT   75   38                                                      
CONECT   76   41                                                      
CONECT   77   41                                                      
CONECT   78   41                                                      
CONECT   79   42                                                      
MASTER        0    0    0    0    0    0    0    0   79    0   79    0
END
