COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.560  -4.435   0.942  1.00  0.00           C  
HETATM    2  C   UNL     1       8.098  -2.567   0.777  1.00  0.00           C  
HETATM    3  C   UNL     1       8.620  -0.886  -0.852  1.00  0.00           C  
HETATM    4  C   UNL     1       7.500  -0.167  -0.466  1.00  0.00           C  
HETATM    5  C   UNL     1       6.675  -0.652   0.531  1.00  0.00           C  
HETATM    6  CA  UNL     1       5.458   0.132   0.948  1.00  0.00           C  
HETATM    7  C   UNL     1       5.877   1.258   1.895  1.00  0.00           C  
HETATM    8  C   UNL     1       3.501   1.000  -0.215  1.00  0.00           C  
HETATM    9  C   UNL     1       2.840   1.589  -1.434  1.00  0.00           C  
HETATM   10  N   UNL     1       1.420   1.817  -1.158  1.00  0.00           N  
HETATM   11  C   UNL     1       0.738   3.116  -1.208  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.808   3.664  -0.731  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.032   3.125  -0.380  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.151   1.755  -0.146  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.039   0.928  -0.266  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.806   1.475  -0.621  1.00  0.00           C  
HETATM   17  C   UNL     1       0.526   0.872  -0.821  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.465   1.179   0.231  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.895  -4.532   0.282  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.521  -3.928  -0.018  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.569   1.323   1.358  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.353   1.902   1.032  1.00  0.00           C  
HETATM   23  O   UNL     1       8.391  -3.745   1.388  1.00  0.00           O  
HETATM   24  C   UNL     1       8.920  -2.085  -0.232  1.00  0.00           C  
HETATM   25  F   UNL     1       9.419  -0.416  -1.835  1.00  0.00           F  
HETATM   26  C   UNL     1       6.975  -1.847   1.157  1.00  0.00           C  
HETATM   27  O   UNL     1       6.883   2.057   1.269  1.00  0.00           O  
HETATM   28  N   UNL     1       4.816   0.704  -0.237  1.00  0.00           N  
HETATM   29  O   UNL     1       2.850   0.792   0.787  1.00  0.00           O  
HETATM   30  C   UNL     1       2.981   0.619  -2.609  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.704   2.850  -0.851  1.00  0.00           C  
HETATM   32  O   UNL     1       0.778  -0.311  -0.698  1.00  0.00           O  
HETATM   33  N   UNL     1      -4.819  -0.032  -0.193  1.00  0.00           N  
HETATM   34  C   UNL     1      -5.991  -0.548   0.142  1.00  0.00           C  
HETATM   35  N   UNL     1      -6.327  -1.811  -0.316  1.00  0.00           N  
HETATM   36  C   UNL     1      -7.619  -2.400   0.043  1.00  0.00           C  
HETATM   37  C   UNL     1      -8.690  -1.929  -0.945  1.00  0.00           C  
HETATM   38  C   UNL     1     -10.019  -2.611  -0.610  1.00  0.00           C  
HETATM   39  O   UNL     1      -9.850  -4.029  -0.654  1.00  0.00           O  
HETATM   40  N   UNL     1      -6.850   0.112   0.904  1.00  0.00           N  
HETATM   41 CL   UNL     1      -4.943   3.489   1.605  1.00  0.00          Cl  
HETATM   42  H   UNL     1       9.677  -5.357   1.511  1.00  0.00           H  
HETATM   43  H   UNL     1       9.460  -4.672  -0.117  1.00  0.00           H  
HETATM   44  H   UNL     1      10.434  -3.802   1.092  1.00  0.00           H  
HETATM   45  H   UNL     1       7.267   0.769  -0.951  1.00  0.00           H  
HETATM   46  HA  UNL     1       4.757  -0.529   1.458  1.00  0.00           H  
HETATM   47  H1  UNL     1       5.012   1.879   2.127  1.00  0.00           H  
HETATM   48  H2  UNL     1       6.274   0.830   2.816  1.00  0.00           H  
HETATM   49  H   UNL     1       3.318   2.535  -1.685  1.00  0.00           H  
HETATM   50  H   UNL     1       1.182   3.800  -0.486  1.00  0.00           H  
HETATM   51  H   UNL     1       0.805   3.535  -2.212  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.718   4.725  -0.912  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.897   3.766  -0.287  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.129  -0.132  -0.084  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.840  -5.618   0.198  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.199  -4.261   1.293  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.800  -4.276   0.722  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.198  -4.232  -1.014  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.278   1.854   1.974  1.00  0.00           H  
HETATM   60  H   UNL     1       9.793  -2.646  -0.532  1.00  0.00           H  
HETATM   61  H   UNL     1       6.334  -2.221   1.942  1.00  0.00           H  
HETATM   62  H   UNL     1       7.196   2.792   1.814  1.00  0.00           H  
HETATM   63  H   UNL     1       5.337   0.871  -1.038  1.00  0.00           H  
HETATM   64  H   UNL     1       2.503  -0.328  -2.358  1.00  0.00           H  
HETATM   65  H   UNL     1       2.503   1.045  -3.491  1.00  0.00           H  
HETATM   66  H   UNL     1       4.038   0.449  -2.815  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.707  -2.305  -0.875  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.892  -2.093   1.053  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.806  -0.848  -0.869  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.391  -2.192  -1.960  1.00  0.00           H  
HETATM   71  H   UNL     1     -10.338  -2.314   0.390  1.00  0.00           H  
HETATM   72  H   UNL     1     -10.775  -2.311  -1.336  1.00  0.00           H  
CONECT    1   23   42   43   44                                       
CONECT    2   23   26   26   24                                       
CONECT    3   24   24    4   25                                       
CONECT    4    5    5    3   45                                       
CONECT    5   26    6    4    4                                       
CONECT    6   28    7    5   46                                       
CONECT    7   27    6   47   48                                       
CONECT    8    9   28   29   29                                       
CONECT    9   30   10    8   49                                       
CONECT   10   17    9   11                                            
CONECT   11   10   31   50   51                                       
CONECT   12   13   13   31   52                                       
CONECT   13   14   12   12   53                                       
CONECT   14   18   15   15   13                                       
CONECT   15   14   14   16   54                                       
CONECT   16   15   17   31   31                                       
CONECT   17   16   32   32   10                                       
CONECT   18   33   14   22   22                                       
CONECT   19   39   20   55   56                                       
CONECT   20   19   36   57   58                                       
CONECT   21   40   40   22   59                                       
CONECT   22   18   18   21   41                                       
CONECT   23    1    2                                                 
CONECT   24    2    3    3   60                                       
CONECT   25    3                                                      
CONECT   26    2    2    5   61                                       
CONECT   27    7   62                                                 
CONECT   28    8    6   63                                            
CONECT   29    8    8                                                 
CONECT   30    9   64   65   66                                       
CONECT   31   16   16   12   11                                       
CONECT   32   17   17                                                 
CONECT   33   34   34   18                                            
CONECT   34   35   33   33   40                                       
CONECT   35   36   34   67                                            
CONECT   36   20   37   35   68                                       
CONECT   37   38   36   69   70                                       
CONECT   38   39   37   71   72                                       
CONECT   39   19   38                                                 
CONECT   40   34   21   21                                            
CONECT   41   22                                                      
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    1                                                      
CONECT   45    4                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    9                                                      
CONECT   50   11                                                      
CONECT   51   11                                                      
CONECT   52   12                                                      
CONECT   53   13                                                      
CONECT   54   15                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   24                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   30                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   37                                                      
CONECT   70   37                                                      
CONECT   71   38                                                      
CONECT   72   38                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
