COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       3.116  -2.528   0.226  1.00  0.00           C  
HETATM    2  C   UNL     1       3.584  -1.217   0.096  1.00  0.00           C  
HETATM    3  C   UNL     1       2.690  -0.146   0.186  1.00  0.00           C  
HETATM    4  C   UNL     1       1.351  -0.383   0.402  1.00  0.00           C  
HETATM    5  C   UNL     1       0.885  -1.687   0.532  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.413  -0.991   0.340  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.215   0.822  -0.451  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.244   2.266  -2.207  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.397   0.341   1.695  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.382  -1.276  -1.744  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.814  -1.347  -1.566  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.610  -0.308   0.274  1.00  0.00           C  
HETATM   13  C   UNL     1       2.278  -5.084   0.457  1.00  0.00           C  
HETATM   14  O   UNL     1       1.314  -4.035   0.564  1.00  0.00           O  
HETATM   15  C   UNL     1       1.772  -2.760   0.438  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.472  -1.923   0.752  1.00  0.00           N  
HETATM   17  N   UNL     1      -1.014   0.057  -0.365  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.880   0.976  -0.773  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.172   1.776  -0.828  1.00  0.00           N  
HETATM   20  C   UNL     1      -5.025   2.232   0.115  1.00  0.00           C  
HETATM   21  O   UNL     1      -5.908   3.009  -0.182  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.871   1.765   1.538  1.00  0.00           C  
HETATM   23  F   UNL     1      -3.516   1.798   1.885  1.00  0.00           F  
HETATM   24  F   UNL     1      -5.588   2.618   2.384  1.00  0.00           F  
HETATM   25  N   UNL     1      -4.946  -0.504   0.572  1.00  0.00           N  
HETATM   26  C   UNL     1      -5.790  -0.300  -0.613  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.669  -1.363  -2.601  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.255  -0.671  -0.303  1.00  0.00           C  
HETATM   29  N   UNL     1      -2.686  -1.179   0.659  1.00  0.00           N  
HETATM   30  C   UNL     1       5.019  -0.963  -0.136  1.00  0.00           C  
HETATM   31  O   UNL     1       5.796  -1.895  -0.213  1.00  0.00           O  
HETATM   32  N   UNL     1       5.468   0.301  -0.261  1.00  0.00           N  
HETATM   33  C   UNL     1       6.893   0.553  -0.491  1.00  0.00           C  
HETATM   34  C   UNL     1       7.068   1.902  -1.193  1.00  0.00           C  
HETATM   35  C   UNL     1       8.560   2.187  -1.375  1.00  0.00           C  
HETATM   36  N   UNL     1       9.220   2.208  -0.064  1.00  0.00           N  
HETATM   37  C   UNL     1      10.626   2.615  -0.188  1.00  0.00           C  
HETATM   38  C   UNL     1       9.106   0.908   0.609  1.00  0.00           C  
HETATM   39  C   UNL     1       7.630   0.583   0.851  1.00  0.00           C  
HETATM   40  H   UNL     1       3.805  -3.357   0.156  1.00  0.00           H  
HETATM   41  H   UNL     1       3.049   0.867   0.086  1.00  0.00           H  
HETATM   42  H   UNL     1       0.661   0.445   0.472  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.921   1.634  -2.782  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.613   3.291  -2.210  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.251   2.236  -2.656  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.027  -0.077   2.631  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.486   0.361   1.715  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.557  -0.868  -2.327  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.120  -2.252  -1.335  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.658  -0.776  -1.953  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.125  -2.366  -1.338  1.00  0.00           H  
HETATM   52  H   UNL     1       3.033  -4.965   1.235  1.00  0.00           H  
HETATM   53  H   UNL     1       1.781  -6.047   0.576  1.00  0.00           H  
HETATM   54  H   UNL     1       2.755  -5.040  -0.522  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.757  -2.738   1.192  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.547   1.828  -1.347  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.720   0.732  -0.956  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.744  -0.503  -3.266  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.685  -2.292  -3.172  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.828   0.228  -0.076  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.295  -1.362   0.539  1.00  0.00           H  
HETATM   62  H   UNL     1       4.848   1.044  -0.199  1.00  0.00           H  
HETATM   63  H   UNL     1       7.306  -0.239  -1.116  1.00  0.00           H  
HETATM   64  H   UNL     1       6.581   1.871  -2.168  1.00  0.00           H  
HETATM   65  H   UNL     1       6.618   2.688  -0.586  1.00  0.00           H  
HETATM   66  H   UNL     1       9.006   1.408  -1.993  1.00  0.00           H  
HETATM   67  H   UNL     1       8.688   3.154  -1.862  1.00  0.00           H  
HETATM   68  H   UNL     1      10.678   3.614  -0.621  1.00  0.00           H  
HETATM   69  H   UNL     1      11.091   2.622   0.798  1.00  0.00           H  
HETATM   70  H   UNL     1      11.152   1.912  -0.833  1.00  0.00           H  
HETATM   71  H   UNL     1       9.549   0.134  -0.019  1.00  0.00           H  
HETATM   72  H   UNL     1       9.631   0.945   1.564  1.00  0.00           H  
HETATM   73  H   UNL     1       7.189   1.348   1.490  1.00  0.00           H  
HETATM   74  H   UNL     1       7.547  -0.390   1.336  1.00  0.00           H  
CONECT    1    2    2   15   40                                       
CONECT    2    3   30    1    1                                       
CONECT    3    4    4    2   41                                       
CONECT    4    3    3    5   42                                       
CONECT    5    4   16   15   15                                       
CONECT    6   29   29   17   16                                       
CONECT    7   19   12   12   18                                       
CONECT    8   19   43   44   45                                       
CONECT    9   22   25   46   47                                       
CONECT   10   27   26   48   49                                       
CONECT   11   27   28   50   51                                       
CONECT   12   25    7    7   29                                       
CONECT   13   14   52   53   54                                       
CONECT   14   15   13                                                 
CONECT   15    5    5    1   14                                       
CONECT   16    6    5   55                                            
CONECT   17   18   18    6                                            
CONECT   18    7   17   17   56                                       
CONECT   19   20    8    7                                            
CONECT   20   22   21   21   19                                       
CONECT   21   20   20                                                 
CONECT   22   23   24    9   20                                       
CONECT   23   22                                                      
CONECT   24   22                                                      
CONECT   25    9   26   12                                            
CONECT   26   10   28   25   57                                       
CONECT   27   11   10   58   59                                       
CONECT   28   11   26   60   61                                       
CONECT   29   12    6    6                                            
CONECT   30   32    2   31   31                                       
CONECT   31   30   30                                                 
CONECT   32   33   30   62                                            
CONECT   33   34   39   32   63                                       
CONECT   34   35   33   64   65                                       
CONECT   35   36   34   66   67                                       
CONECT   36   37   35   38                                            
CONECT   37   36   68   69   70                                       
CONECT   38   36   39   71   72                                       
CONECT   39   38   33   73   74                                       
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   11                                                      
CONECT   51   11                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   13                                                      
CONECT   55   16                                                      
CONECT   56   18                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
CONECT   66   35                                                      
CONECT   67   35                                                      
CONECT   68   37                                                      
CONECT   69   37                                                      
CONECT   70   37                                                      
CONECT   71   38                                                      
CONECT   72   38                                                      
CONECT   73   39                                                      
CONECT   74   39                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
