COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.617   1.657  -3.060  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.854   0.769  -2.075  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.411   1.264  -1.954  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.671   0.386  -1.037  1.00  0.00           N  
HETATM    5  C   UNL     1      -1.299   0.872  -0.835  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.320   2.071   0.078  1.00  0.00           C  
HETATM    7  C   UNL     1       1.455   3.979   1.604  1.00  0.00           C  
HETATM    8  C   UNL     1       1.787   5.410   1.174  1.00  0.00           C  
HETATM    9  C   UNL     1       1.912   3.737   3.044  1.00  0.00           C  
HETATM   10  C   UNL     1       2.107   2.983   0.669  1.00  0.00           C  
HETATM   11  C   UNL     1       3.758   1.838  -0.464  1.00  0.00           C  
HETATM   12  C   UNL     1       2.824   1.049  -1.108  1.00  0.00           C  
HETATM   13  C   UNL     1       3.266  -0.011  -2.084  1.00  0.00           C  
HETATM   14  C   UNL     1       3.662  -1.254  -1.331  1.00  0.00           C  
HETATM   15  C   UNL     1       2.759  -2.290  -1.185  1.00  0.00           C  
HETATM   16  C   UNL     1       3.121  -3.432  -0.494  1.00  0.00           C  
HETATM   17  C   UNL     1       4.389  -3.537   0.052  1.00  0.00           C  
HETATM   18  C   UNL     1       5.293  -2.498  -0.095  1.00  0.00           C  
HETATM   19  C   UNL     1       4.930  -1.360  -0.790  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.671  -1.001  -1.524  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.280  -0.662   1.517  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.041  -3.063   2.856  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.260  -3.081   1.540  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.632  -4.332   0.741  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.115  -1.495  -1.645  1.00  0.00           C  
HETATM   26  O   UNL     1      -2.379   2.540   0.438  1.00  0.00           O  
HETATM   27  N   UNL     1      -0.163   2.621   0.495  1.00  0.00           N  
HETATM   28  C   UNL     1      -0.052   3.714   1.466  1.00  0.00           C  
HETATM   29  N   UNL     1       3.379   2.766   0.392  1.00  0.00           N  
HETATM   30  C   UNL     1       1.479   1.242  -0.847  1.00  0.00           C  
HETATM   31  C   UNL     1       1.109   2.234   0.065  1.00  0.00           C  
HETATM   32  O   UNL     1       4.385   0.469  -2.833  1.00  0.00           O  
HETATM   33  F   UNL     1       4.744  -4.652   0.727  1.00  0.00           F  
HETATM   34  C   UNL     1      -1.909  -1.888  -0.539  1.00  0.00           C  
HETATM   35  N   UNL     1      -2.596  -1.882   0.760  1.00  0.00           N  
HETATM   36  C   UNL     1      -0.780  -0.618   1.814  1.00  0.00           C  
HETATM   37  C   UNL     1      -3.062  -0.668   2.833  1.00  0.00           C  
HETATM   38  O   UNL     1      -2.746  -1.856   3.564  1.00  0.00           O  
HETATM   39  N   UNL     1      -4.855  -0.617  -2.562  1.00  0.00           N  
HETATM   40  H   UNL     1      -5.135   1.613  -4.037  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.645   1.305  -3.146  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.614   2.686  -2.700  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.337   0.812  -1.098  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.937   1.247  -2.935  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.407   2.282  -1.565  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.696   0.083  -0.385  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.869   1.155  -1.796  1.00  0.00           H  
HETATM   48  H   UNL     1       1.442   5.571   0.153  1.00  0.00           H  
HETATM   49  H   UNL     1       1.290   6.114   1.841  1.00  0.00           H  
HETATM   50  H   UNL     1       2.865   5.563   1.222  1.00  0.00           H  
HETATM   51  H   UNL     1       2.992   3.873   3.111  1.00  0.00           H  
HETATM   52  H   UNL     1       1.415   4.445   3.707  1.00  0.00           H  
HETATM   53  H   UNL     1       1.655   2.720   3.341  1.00  0.00           H  
HETATM   54  H   UNL     1       4.809   1.693  -0.663  1.00  0.00           H  
HETATM   55  H   UNL     1       2.447  -0.243  -2.764  1.00  0.00           H  
HETATM   56  H   UNL     1       1.770  -2.208  -1.610  1.00  0.00           H  
HETATM   57  H   UNL     1       2.415  -4.241  -0.380  1.00  0.00           H  
HETATM   58  H   UNL     1       6.282  -2.579   0.330  1.00  0.00           H  
HETATM   59  H   UNL     1       5.635  -0.550  -0.905  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.189  -1.043  -2.500  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.561   0.213   0.931  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.110  -3.109   2.646  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.753  -3.922   3.463  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.190  -3.090   1.752  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.671  -4.260   0.417  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.984  -4.413  -0.131  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.509  -5.214   1.369  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.119  -2.513  -2.034  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.588  -1.479  -0.664  1.00  0.00           H  
HETATM   70  H   UNL     1      -0.473   3.411   2.425  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.560   4.603   1.093  1.00  0.00           H  
HETATM   72  H   UNL     1       0.730   0.638  -1.339  1.00  0.00           H  
HETATM   73  H   UNL     1       5.153   0.696  -2.291  1.00  0.00           H  
HETATM   74  H   UNL     1      -1.869  -2.908  -0.924  1.00  0.00           H  
HETATM   75  H   UNL     1      -0.895  -1.507  -0.415  1.00  0.00           H  
HETATM   76  H   UNL     1      -0.520  -1.430   2.493  1.00  0.00           H  
HETATM   77  H   UNL     1      -0.222  -0.730   0.884  1.00  0.00           H  
HETATM   78  H   UNL     1      -0.529   0.337   2.275  1.00  0.00           H  
HETATM   79  H   UNL     1      -2.788   0.206   3.424  1.00  0.00           H  
HETATM   80  H   UNL     1      -4.131  -0.645   2.622  1.00  0.00           H  
HETATM   81  H   UNL     1      -4.480  -0.672  -3.497  1.00  0.00           H  
CONECT    1    2   40   41   42                                       
CONECT    2   39    1    3   43                                       
CONECT    3    2    4   44   45                                       
CONECT    4   20    3    5                                            
CONECT    5    4    6   46   47                                       
CONECT    6    5   26   26   27                                       
CONECT    7   28   10    8    9                                       
CONECT    8    7   48   49   50                                       
CONECT    9    7   51   52   53                                       
CONECT   10   31    7   29   29                                       
CONECT   11   12   12   29   54                                       
CONECT   12   30   13   11   11                                       
CONECT   13   32   12   14   55                                       
CONECT   14   19   13   15   15                                       
CONECT   15   14   14   16   56                                       
CONECT   16   17   17   15   57                                       
CONECT   17   18   33   16   16                                       
CONECT   18   19   19   17   58                                       
CONECT   19   18   18   14   59                                       
CONECT   20   25   34    4   60                                       
CONECT   21   36   35   37   61                                       
CONECT   22   23   38   62   63                                       
CONECT   23   35   24   22   64                                       
CONECT   24   23   65   66   67                                       
CONECT   25   39   20   68   69                                       
CONECT   26    6    6                                                 
CONECT   27    6   28   31                                            
CONECT   28   27    7   70   71                                       
CONECT   29   10   10   11                                            
CONECT   30   31   31   12   72                                       
CONECT   31   27   30   30   10                                       
CONECT   32   13   73                                                 
CONECT   33   17                                                      
CONECT   34   20   35   74   75                                       
CONECT   35   34   21   23                                            
CONECT   36   21   76   77   78                                       
CONECT   37   21   38   79   80                                       
CONECT   38   37   22                                                 
CONECT   39   25    2   81                                            
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    3                                                      
CONECT   45    3                                                      
CONECT   46    5                                                      
CONECT   47    5                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53    9                                                      
CONECT   54   11                                                      
CONECT   55   13                                                      
CONECT   56   15                                                      
CONECT   57   16                                                      
CONECT   58   18                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   22                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   24                                                      
CONECT   67   24                                                      
CONECT   68   25                                                      
CONECT   69   25                                                      
CONECT   70   28                                                      
CONECT   71   28                                                      
CONECT   72   30                                                      
CONECT   73   32                                                      
CONECT   74   34                                                      
CONECT   75   34                                                      
CONECT   76   36                                                      
CONECT   77   36                                                      
CONECT   78   36                                                      
CONECT   79   37                                                      
CONECT   80   37                                                      
CONECT   81   39                                                      
MASTER        0    0    0    0    0    0    0    0   81    0   81    0
END
