COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.848   2.419  -1.055  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.829   3.136   0.134  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.110   2.684   1.219  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.612   0.963   2.242  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.945  -0.193   2.094  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.655  -0.495  -0.154  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.241  -2.102   0.854  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.603   4.424   0.239  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.234   5.551  -0.728  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.542   4.780  -0.915  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.821  -4.482   0.715  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.136  -4.486   1.133  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.847  -3.303   1.204  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.257  -0.788   0.064  1.00  0.00           C  
HETATM   15  C   UNL     1       0.211  -3.275  -0.083  1.00  0.00           C  
HETATM   16  N   UNL     1       1.822  -3.711  -1.759  1.00  0.00           N  
HETATM   17  C   UNL     1       2.813  -3.280  -0.957  1.00  0.00           C  
HETATM   18  C   UNL     1       4.340  -1.280   0.797  1.00  0.00           C  
HETATM   19  C   UNL     1       6.168   0.071   1.200  1.00  0.00           C  
HETATM   20  C   UNL     1       5.910   0.823   0.064  1.00  0.00           C  
HETATM   21  C   UNL     1       4.810   0.501  -0.730  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.151   1.234  -1.175  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.415   0.756  -0.087  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.393   1.491   1.121  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.964  -0.905   0.928  1.00  0.00           N  
HETATM   26  O   UNL     1      -4.649  -1.158  -1.176  1.00  0.00           O  
HETATM   27  F   UNL     1      -6.181   0.541  -2.334  1.00  0.00           F  
HETATM   28  C   UNL     1      -1.919  -2.089   0.438  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.203  -3.282   0.367  1.00  0.00           C  
HETATM   30  O   UNL     1      -0.648  -0.213   1.222  1.00  0.00           O  
HETATM   31  C   UNL     1       0.532  -3.712  -1.335  1.00  0.00           C  
HETATM   32  C   UNL     1       2.521  -2.810   0.344  1.00  0.00           C  
HETATM   33  C   UNL     1       1.227  -2.812   0.781  1.00  0.00           C  
HETATM   34  N   UNL     1       3.550  -2.361   1.181  1.00  0.00           N  
HETATM   35  N   UNL     1       5.389  -0.942   1.529  1.00  0.00           N  
HETATM   36  C   UNL     1       4.020  -0.571  -0.357  1.00  0.00           C  
HETATM   37  N   UNL     1       6.741   1.897  -0.278  1.00  0.00           N  
HETATM   38  C   UNL     1       7.827   2.055   0.699  1.00  0.00           C  
HETATM   39  C   UNL     1       8.755   3.185   0.248  1.00  0.00           C  
HETATM   40  N   UNL     1       7.983   4.428   0.117  1.00  0.00           N  
HETATM   41  C   UNL     1       6.897   4.270  -0.860  1.00  0.00           C  
HETATM   42  C   UNL     1       5.968   3.140  -0.409  1.00  0.00           C  
HETATM   43  C   UNL     1       8.855   5.554  -0.242  1.00  0.00           C  
HETATM   44  C   UNL     1       2.139  -4.185  -3.108  1.00  0.00           C  
HETATM   45  O   UNL     1       3.966  -3.287  -1.357  1.00  0.00           O  
HETATM   46  H   UNL     1      -7.418   2.791  -1.893  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.102   3.249   2.139  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.574   1.498   3.179  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.373  -0.573   2.927  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.913   4.706   1.245  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.301   6.574  -0.358  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.431   5.360  -1.440  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.600   4.082  -1.751  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.470   5.296  -0.668  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.270  -5.409   0.657  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.613  -5.417   1.402  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.876  -3.311   1.532  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.495  -0.972  -0.693  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.005  -0.101  -0.332  1.00  0.00           H  
HETATM   60  H   UNL     1       7.018   0.315   1.820  1.00  0.00           H  
HETATM   61  H   UNL     1       4.586   1.069  -1.620  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.202   0.629   1.055  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.248  -4.062  -1.995  1.00  0.00           H  
HETATM   64  H   UNL     1       0.985  -2.464   1.774  1.00  0.00           H  
HETATM   65  H   UNL     1       3.713  -2.803   2.029  1.00  0.00           H  
HETATM   66  H   UNL     1       3.165  -0.853  -0.953  1.00  0.00           H  
HETATM   67  H   UNL     1       7.406   2.299   1.674  1.00  0.00           H  
HETATM   68  H   UNL     1       8.392   1.125   0.769  1.00  0.00           H  
HETATM   69  H   UNL     1       9.545   3.323   0.986  1.00  0.00           H  
HETATM   70  H   UNL     1       9.198   2.929  -0.715  1.00  0.00           H  
HETATM   71  H   UNL     1       6.332   5.199  -0.930  1.00  0.00           H  
HETATM   72  H   UNL     1       7.318   4.026  -1.836  1.00  0.00           H  
HETATM   73  H   UNL     1       5.178   3.002  -1.147  1.00  0.00           H  
HETATM   74  H   UNL     1       5.526   3.396   0.554  1.00  0.00           H  
HETATM   75  H   UNL     1       9.344   5.346  -1.193  1.00  0.00           H  
HETATM   76  H   UNL     1       8.258   6.462  -0.332  1.00  0.00           H  
HETATM   77  H   UNL     1       9.609   5.691   0.533  1.00  0.00           H  
HETATM   78  H   UNL     1       2.098  -3.349  -3.806  1.00  0.00           H  
HETATM   79  H   UNL     1       3.140  -4.616  -3.116  1.00  0.00           H  
HETATM   80  H   UNL     1       1.415  -4.944  -3.406  1.00  0.00           H  
CONECT    1   22   22    2   46                                       
CONECT    2    3    3    1    8                                       
CONECT    3   24    2    2   47                                       
CONECT    4    5    5   24   48                                       
CONECT    5   25    4    4   49                                       
CONECT    6   25   26   26   23                                       
CONECT    7   28   28   13   25                                       
CONECT    8    2    9   10   50                                       
CONECT    9    8   10   51   52                                       
CONECT   10    8    9   53   54                                       
CONECT   11   29   29   12   55                                       
CONECT   12   11   13   13   56                                       
CONECT   13   12   12    7   57                                       
CONECT   14   28   30   58   59                                       
CONECT   15   33   31   31   29                                       
CONECT   16   17   44   31                                            
CONECT   17   32   45   45   16                                       
CONECT   18   35   35   36   34                                       
CONECT   19   20   20   35   60                                       
CONECT   20   37   19   19   21                                       
CONECT   21   20   36   36   61                                       
CONECT   22   23   27    1    1                                       
CONECT   23    6   24   24   22                                       
CONECT   24    4   23   23    3                                       
CONECT   25    7    5    6                                            
CONECT   26    6    6                                                 
CONECT   27   22                                                      
CONECT   28   29   14    7    7                                       
CONECT   29   15   11   11   28                                       
CONECT   30   14   62                                                 
CONECT   31   16   15   15   63                                       
CONECT   32   34   17   33   33                                       
CONECT   33   32   32   15   64                                       
CONECT   34   18   32   65                                            
CONECT   35   19   18   18                                            
CONECT   36   21   21   18   66                                       
CONECT   37   42   38   20                                            
CONECT   38   39   37   67   68                                       
CONECT   39   40   38   69   70                                       
CONECT   40   43   41   39                                            
CONECT   41   40   42   71   72                                       
CONECT   42   41   37   73   74                                       
CONECT   43   40   75   76   77                                       
CONECT   44   16   78   79   80                                       
CONECT   45   17   17                                                 
CONECT   46    1                                                      
CONECT   47    3                                                      
CONECT   48    4                                                      
CONECT   49    5                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53   10                                                      
CONECT   54   10                                                      
CONECT   55   11                                                      
CONECT   56   12                                                      
CONECT   57   13                                                      
CONECT   58   14                                                      
CONECT   59   14                                                      
CONECT   60   19                                                      
CONECT   61   21                                                      
CONECT   62   30                                                      
CONECT   63   31                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
CONECT   66   36                                                      
CONECT   67   38                                                      
CONECT   68   38                                                      
CONECT   69   39                                                      
CONECT   70   39                                                      
CONECT   71   41                                                      
CONECT   72   41                                                      
CONECT   73   42                                                      
CONECT   74   42                                                      
CONECT   75   43                                                      
CONECT   76   43                                                      
CONECT   77   43                                                      
CONECT   78   44                                                      
CONECT   79   44                                                      
CONECT   80   44                                                      
MASTER        0    0    0    0    0    0    0    0   80    0   80    0
END
