COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       5.233   1.416   1.616  1.00  0.00           F  
HETATM    2  C   UNL     1       5.680   0.825   0.430  1.00  0.00           C  
HETATM    3  C   UNL     1       5.359   1.744  -0.752  1.00  0.00           C  
HETATM    4  O   UNL     1       5.970   3.019  -0.545  1.00  0.00           O  
HETATM    5  C   UNL     1       3.841   1.914  -0.859  1.00  0.00           C  
HETATM    6  C   UNL     1       3.189   0.539  -1.020  1.00  0.00           C  
HETATM    7  C   UNL     1       4.974  -0.519   0.232  1.00  0.00           C  
HETATM    8  N   UNL     1       3.525  -0.302   0.136  1.00  0.00           N  
HETATM    9  C   UNL     1       2.846  -1.507   0.087  1.00  0.00           C  
HETATM   10  N   UNL     1       1.524  -1.500  -0.006  1.00  0.00           N  
HETATM   11  N   UNL     1       3.533  -2.638   0.129  1.00  0.00           N  
HETATM   12  C   UNL     1       2.919  -3.812   0.084  1.00  0.00           C  
HETATM   13  C   UNL     1       1.541  -3.849  -0.008  1.00  0.00           C  
HETATM   14  C   UNL     1       0.843  -2.640  -0.056  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.540  -2.630  -0.154  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.234  -1.425  -0.090  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.616  -1.441  -0.079  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.550  -0.284  -0.034  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.133   0.892   0.029  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.527   0.979   0.040  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.229   2.201   0.106  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.548   3.404   0.164  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.292   4.665   0.233  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.293  -0.218  -0.014  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.694  -0.105   0.003  1.00  0.00           C  
HETATM   26  N   UNL     1      -5.234   1.091   0.067  1.00  0.00           N  
HETATM   27  N   UNL     1      -4.552   2.174   0.110  1.00  0.00           N  
HETATM   28  C   UNL     1      -5.563  -1.335  -0.051  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.436  -1.399   1.204  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.456  -1.275  -1.291  1.00  0.00           C  
HETATM   31  H   UNL     1       6.757   0.666   0.486  1.00  0.00           H  
HETATM   32  H   UNL     1       5.742   1.301  -1.672  1.00  0.00           H  
HETATM   33  H   UNL     1       5.808   3.652  -1.257  1.00  0.00           H  
HETATM   34  H   UNL     1       3.464   2.392   0.045  1.00  0.00           H  
HETATM   35  H   UNL     1       3.604   2.533  -1.724  1.00  0.00           H  
HETATM   36  H   UNL     1       2.107   0.655  -1.082  1.00  0.00           H  
HETATM   37  H   UNL     1       3.556   0.067  -1.931  1.00  0.00           H  
HETATM   38  H   UNL     1       5.333  -0.985  -0.686  1.00  0.00           H  
HETATM   39  H   UNL     1       5.189  -1.170   1.079  1.00  0.00           H  
HETATM   40  H   UNL     1       3.489  -4.728   0.118  1.00  0.00           H  
HETATM   41  H   UNL     1       1.016  -4.792  -0.047  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.025  -3.463  -0.267  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.159  -2.374  -0.121  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.534   1.790   0.073  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.578   3.413   0.160  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.591   5.498   0.272  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.923   4.762  -0.650  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.914   4.671   1.127  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.932  -2.223  -0.100  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.799  -1.442   2.088  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.066  -0.511   1.253  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.064  -2.289   1.165  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.834  -1.230  -2.185  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.084  -2.165  -1.331  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.087  -0.387  -1.242  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    7   31                                       
CONECT    3    4    2    5   32                                       
CONECT    4    3   33                                                 
CONECT    5    3    6   34   35                                       
CONECT    6    8    5   36   37                                       
CONECT    7    2    8   38   39                                       
CONECT    8    9    7    6                                            
CONECT    9   10    8   11   11                                       
CONECT   10   14   14    9                                            
CONECT   11   12    9    9                                            
CONECT   12   13   13   11   40                                       
CONECT   13   14   12   12   41                                       
CONECT   14   15   10   10   13                                       
CONECT   15   16   14   42                                            
CONECT   16   18   15   17   17                                       
CONECT   17   16   16   24   43                                       
CONECT   18   19   19   16                                            
CONECT   19   18   18   20   44                                       
CONECT   20   19   21   21   24                                       
CONECT   21   22   20   20   27                                       
CONECT   22   21   23   45                                            
CONECT   23   22   46   47   48                                       
CONECT   24   20   17   25   25                                       
CONECT   25   24   24   26   28                                       
CONECT   26   27   27   25                                            
CONECT   27   21   26   26                                            
CONECT   28   30   25   29   49                                       
CONECT   29   28   50   51   52                                       
CONECT   30   28   53   54   55                                       
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
