COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.369   1.031   0.961  1.00  0.00           C  
HETATM    2  F   UNL     1       7.354  -5.702  -0.736  1.00  0.00           F  
HETATM    3  C   UNL     1      -1.208  -1.127  -0.479  1.00  0.00           C  
HETATM    4  O   UNL     1      -7.943   3.250  -0.867  1.00  0.00           O  
HETATM    5  C   UNL     1      -3.210   2.030  -0.930  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.195  -0.013  -0.121  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.594   1.391  -1.063  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.849   1.631  -1.287  1.00  0.00           C  
HETATM    9  O   UNL     1       7.342   2.390   0.937  1.00  0.00           O  
HETATM   10  N   UNL     1      -5.625   2.404  -0.823  1.00  0.00           N  
HETATM   11  C   UNL     1       4.657  -0.788  -0.673  1.00  0.00           C  
HETATM   12  C   UNL     1       3.595  -1.598  -0.374  1.00  0.00           C  
HETATM   13  C   UNL     1       1.177  -1.632  -1.033  1.00  0.00           C  
HETATM   14  C   UNL     1       0.197  -0.534  -0.615  1.00  0.00           C  
HETATM   15  C   UNL     1       0.177   0.566  -1.680  1.00  0.00           C  
HETATM   16  C   UNL     1       6.045  -0.924  -0.180  1.00  0.00           C  
HETATM   17  C   UNL     1       8.038   4.618   1.565  1.00  0.00           C  
HETATM   18  C   UNL     1       6.886   3.737   1.076  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.177   1.014  -1.171  1.00  0.00           N  
HETATM   20  C   UNL     1       6.442   1.479   0.511  1.00  0.00           C  
HETATM   21  C   UNL     1       6.839   0.081   0.345  1.00  0.00           C  
HETATM   22  C   UNL     1       7.585   6.079   1.595  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.768   0.773  -0.257  1.00  0.00           C  
HETATM   24  C   UNL     1       6.849  -2.151  -0.147  1.00  0.00           C  
HETATM   25  C   UNL     1       9.076  -2.775   0.554  1.00  0.00           C  
HETATM   26  C   UNL     1       8.096  -1.797   0.400  1.00  0.00           C  
HETATM   27  C   UNL     1       8.450   4.182   2.973  1.00  0.00           C  
HETATM   28  C   UNL     1       8.820  -4.073   0.174  1.00  0.00           C  
HETATM   29  O   UNL     1       5.301   1.821   0.265  1.00  0.00           O  
HETATM   30  N   UNL     1       2.539  -1.092  -1.047  1.00  0.00           N  
HETATM   31  C   UNL     1       6.604  -3.472  -0.529  1.00  0.00           C  
HETATM   32  C   UNL     1       7.588  -4.423  -0.367  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.820  -0.015   1.745  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.669  -1.318   1.311  1.00  0.00           C  
HETATM   35  C   UNL     1      -9.159  -2.458   2.165  1.00  0.00           C  
HETATM   36  C   UNL     1     -10.612  -2.777   1.806  1.00  0.00           C  
HETATM   37  C   UNL     1     -11.070  -4.013   2.583  1.00  0.00           C  
HETATM   38  C   UNL     1     -11.501  -1.586   2.171  1.00  0.00           C  
HETATM   39  C   UNL     1      -8.069  -1.576   0.092  1.00  0.00           C  
HETATM   40  C   UNL     1      -7.618  -0.530  -0.691  1.00  0.00           C  
HETATM   41  N   UNL     1       2.929  -0.056  -1.702  1.00  0.00           N  
HETATM   42  N   UNL     1       4.183   0.154  -1.511  1.00  0.00           N  
HETATM   43  N   UNL     1       8.068  -0.452   0.689  1.00  0.00           N  
HETATM   44  O   UNL     1      -7.158   1.620  -2.591  1.00  0.00           O  
HETATM   45  S   UNL     1      -7.195   2.106  -1.257  1.00  0.00           S  
HETATM   46  H   UNL     1      -8.483   2.050   1.302  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.210  -1.881   0.308  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.503  -1.585  -1.423  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.109   2.832  -1.662  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.093   2.438   0.074  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.198  -0.430  -0.038  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.907   0.435   0.830  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.712   0.983  -2.067  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.696   0.589  -0.331  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.567   2.071  -0.331  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.875   2.409  -2.050  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.387   3.249  -0.410  1.00  0.00           H  
HETATM   58  H   UNL     1       3.601  -2.466   0.269  1.00  0.00           H  
HETATM   59  H   UNL     1       1.121  -2.458  -0.323  1.00  0.00           H  
HETATM   60  H   UNL     1       0.918  -1.991  -2.029  1.00  0.00           H  
HETATM   61  H   UNL     1       0.509  -0.112   0.340  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.096   0.135  -2.644  1.00  0.00           H  
HETATM   63  H   UNL     1       1.165   1.021  -1.751  1.00  0.00           H  
HETATM   64  H   UNL     1       8.887   4.514   0.889  1.00  0.00           H  
HETATM   65  H   UNL     1       6.533   4.103   0.112  1.00  0.00           H  
HETATM   66  H   UNL     1       6.070   3.772   1.798  1.00  0.00           H  
HETATM   67  H   UNL     1       6.736   6.182   2.271  1.00  0.00           H  
HETATM   68  H   UNL     1       8.406   6.706   1.943  1.00  0.00           H  
HETATM   69  H   UNL     1       7.291   6.389   0.592  1.00  0.00           H  
HETATM   70  H   UNL     1      10.037  -2.515   0.973  1.00  0.00           H  
HETATM   71  H   UNL     1       7.601   4.286   3.648  1.00  0.00           H  
HETATM   72  H   UNL     1       8.773   3.141   2.951  1.00  0.00           H  
HETATM   73  H   UNL     1       9.271   4.810   3.321  1.00  0.00           H  
HETATM   74  H   UNL     1       9.583  -4.827   0.296  1.00  0.00           H  
HETATM   75  H   UNL     1       5.648  -3.747  -0.949  1.00  0.00           H  
HETATM   76  H   UNL     1      -9.289   0.187   2.696  1.00  0.00           H  
HETATM   77  H   UNL     1      -8.540  -3.338   1.988  1.00  0.00           H  
HETATM   78  H   UNL     1      -9.099  -2.177   3.216  1.00  0.00           H  
HETATM   79  H   UNL     1     -10.687  -2.972   0.736  1.00  0.00           H  
HETATM   80  H   UNL     1     -10.995  -3.818   3.653  1.00  0.00           H  
HETATM   81  H   UNL     1     -12.105  -4.240   2.327  1.00  0.00           H  
HETATM   82  H   UNL     1     -10.437  -4.861   2.323  1.00  0.00           H  
HETATM   83  H   UNL     1     -11.425  -1.391   3.240  1.00  0.00           H  
HETATM   84  H   UNL     1     -11.174  -0.706   1.617  1.00  0.00           H  
HETATM   85  H   UNL     1     -12.535  -1.813   1.915  1.00  0.00           H  
HETATM   86  H   UNL     1      -7.951  -2.595  -0.247  1.00  0.00           H  
HETATM   87  H   UNL     1      -7.149  -0.732  -1.643  1.00  0.00           H  
HETATM   88  H   UNL     1       8.801   0.049   1.078  1.00  0.00           H  
CONECT    1   33   33   23   46                                       
CONECT    2   32                                                      
CONECT    3   14    6   47   48                                       
CONECT    4   45   45                                                 
CONECT    5   19    7   49   50                                       
CONECT    6   19    3   51   52                                       
CONECT    7    5   10   53   54                                       
CONECT    8   15   19   55   56                                       
CONECT    9   18   20                                                 
CONECT   10    7   45   57                                            
CONECT   11   42   12   12   16                                       
CONECT   12   30   11   11   58                                       
CONECT   13   14   30   59   60                                       
CONECT   14   15   13    3   61                                       
CONECT   15    8   14   62   63                                       
CONECT   16   11   24   21   21                                       
CONECT   17   27   22   18   64                                       
CONECT   18   17    9   65   66                                       
CONECT   19    8    5    6                                            
CONECT   20    9   21   29   29                                       
CONECT   21   16   16   20   43                                       
CONECT   22   17   67   68   69                                       
CONECT   23    1   45   40   40                                       
CONECT   24   16   31   31   26                                       
CONECT   25   26   26   28   70                                       
CONECT   26   24   43   25   25                                       
CONECT   27   17   71   72   73                                       
CONECT   28   32   32   25   74                                       
CONECT   29   20   20                                                 
CONECT   30   13   41   12                                            
CONECT   31   24   24   32   75                                       
CONECT   32   31    2   28   28                                       
CONECT   33    1    1   34   76                                       
CONECT   34   33   35   39   39                                       
CONECT   35   34   36   77   78                                       
CONECT   36   35   37   38   79                                       
CONECT   37   36   80   81   82                                       
CONECT   38   36   83   84   85                                       
CONECT   39   34   34   40   86                                       
CONECT   40   23   23   39   87                                       
CONECT   41   30   42   42                                            
CONECT   42   41   41   11                                            
CONECT   43   21   26   88                                            
CONECT   44   45   45                                                 
CONECT   45   44   44   23   10                                       
CONECT   45    4    4                                                 
CONECT   46    1                                                      
CONECT   47    3                                                      
CONECT   48    3                                                      
CONECT   49    5                                                      
CONECT   50    5                                                      
CONECT   51    6                                                      
CONECT   52    6                                                      
CONECT   53    7                                                      
CONECT   54    7                                                      
CONECT   55    8                                                      
CONECT   56    8                                                      
CONECT   57   10                                                      
CONECT   58   12                                                      
CONECT   59   13                                                      
CONECT   60   13                                                      
CONECT   61   14                                                      
CONECT   62   15                                                      
CONECT   63   15                                                      
CONECT   64   17                                                      
CONECT   65   18                                                      
CONECT   66   18                                                      
CONECT   67   22                                                      
CONECT   68   22                                                      
CONECT   69   22                                                      
CONECT   70   25                                                      
CONECT   71   27                                                      
CONECT   72   27                                                      
CONECT   73   27                                                      
CONECT   74   28                                                      
CONECT   75   31                                                      
CONECT   76   33                                                      
CONECT   77   35                                                      
CONECT   78   35                                                      
CONECT   79   36                                                      
CONECT   80   37                                                      
CONECT   81   37                                                      
CONECT   82   37                                                      
CONECT   83   38                                                      
CONECT   84   38                                                      
CONECT   85   38                                                      
CONECT   86   39                                                      
CONECT   87   40                                                      
CONECT   88   43                                                      
MASTER        0    0    0    0    0    0    0    0   88    0   88    0
END
