COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.630   1.905  -1.324  1.00  0.00           C  
HETATM    2  C   UNL     1       2.176   0.640  -1.442  1.00  0.00           C  
HETATM    3  C   UNL     1       1.954  -0.268  -0.259  1.00  0.00           C  
HETATM    4  C   UNL     1       2.597   0.367   0.948  1.00  0.00           C  
HETATM    5  C   UNL     1       3.052   1.704   0.943  1.00  0.00           C  
HETATM    6  C   UNL     1       2.846  -0.154   2.159  1.00  0.00           C  
HETATM    7  C   UNL     1       2.526  -1.557   2.607  1.00  0.00           C  
HETATM    8  C   UNL     1       2.593  -1.632  -0.527  1.00  0.00           C  
HETATM    9  C   UNL     1       1.960  -2.256  -1.772  1.00  0.00           C  
HETATM   10  C   UNL     1       0.475  -0.438  -0.018  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.063  -1.706   0.104  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.419  -1.869   0.325  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.705   0.514   0.304  1.00  0.00           C  
HETATM   14  N   UNL     1      -4.403  -0.115  -1.949  1.00  0.00           N  
HETATM   15  C   UNL     1      -4.118   0.728  -1.242  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.759   1.790  -0.351  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.576   2.915  -0.234  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.225   3.935   0.626  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.065   3.850   1.377  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.244   2.745   1.275  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.583   1.703   0.417  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.242  -0.767   0.425  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.998  -3.255   0.456  1.00  0.00           C  
HETATM   24  F   UNL     1      -1.242  -4.150  -0.308  1.00  0.00           F  
HETATM   25  F   UNL     1      -1.969  -3.647   1.798  1.00  0.00           F  
HETATM   26  F   UNL     1      -3.320  -3.253  -0.001  1.00  0.00           F  
HETATM   27  C   UNL     1      -0.337   0.673   0.086  1.00  0.00           C  
HETATM   28  C   UNL     1       4.096  -1.455  -0.753  1.00  0.00           C  
HETATM   29  C   UNL     1       1.891   0.136  -2.752  1.00  0.00           C  
HETATM   30  N   UNL     1       1.665  -0.264  -3.791  1.00  0.00           N  
HETATM   31  N   UNL     1       2.788   2.637  -2.474  1.00  0.00           N  
HETATM   32  N   UNL     1       3.437   0.808   2.905  1.00  0.00           N  
HETATM   33  N   UNL     1       3.553   1.963   2.116  1.00  0.00           N  
HETATM   34  O   UNL     1       2.935   2.501  -0.154  1.00  0.00           O  
HETATM   35  H   UNL     1       3.331  -2.227   2.304  1.00  0.00           H  
HETATM   36  H   UNL     1       2.425  -1.577   3.692  1.00  0.00           H  
HETATM   37  H   UNL     1       1.592  -1.880   2.148  1.00  0.00           H  
HETATM   38  H   UNL     1       2.428  -2.285   0.330  1.00  0.00           H  
HETATM   39  H   UNL     1       2.444  -1.859  -2.664  1.00  0.00           H  
HETATM   40  H   UNL     1       2.087  -3.338  -1.741  1.00  0.00           H  
HETATM   41  H   UNL     1       0.897  -2.016  -1.799  1.00  0.00           H  
HETATM   42  H   UNL     1       0.577  -2.572   0.026  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.482   2.987  -0.817  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.859   4.804   0.714  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.800   4.655   2.047  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.340   2.687   1.864  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.301  -0.896   0.594  1.00  0.00           H  
HETATM   48  H   UNL     1       0.084   1.663  -0.008  1.00  0.00           H  
HETATM   49  H   UNL     1       4.260  -0.849  -1.643  1.00  0.00           H  
HETATM   50  H   UNL     1       4.537  -0.959   0.112  1.00  0.00           H  
HETATM   51  H   UNL     1       4.560  -2.432  -0.887  1.00  0.00           H  
HETATM   52  H   UNL     1       2.575   2.241  -3.334  1.00  0.00           H  
HETATM   53  H   UNL     1       3.112   3.549  -2.428  1.00  0.00           H  
HETATM   54  H   UNL     1       3.729   0.716   3.825  1.00  0.00           H  
CONECT    1   34    2    2   31                                       
CONECT    2    3    1    1   29                                       
CONECT    3    4   10    8    2                                       
CONECT    4    6    6    5    3                                       
CONECT    5   33   33    4   34                                       
CONECT    6   32    7    4    4                                       
CONECT    7    6   35   36   37                                       
CONECT    8    3    9   28   38                                       
CONECT    9    8   39   40   41                                       
CONECT   10   27    3   11   11                                       
CONECT   11   10   10   12   42                                       
CONECT   12   22   22   11   23                                       
CONECT   13   21   27   27   22                                       
CONECT   14   15   15   15                                            
CONECT   15   16   14   14   14                                       
CONECT   16   17   17   21   15                                       
CONECT   17   18   16   16   43                                       
CONECT   18   19   19   17   44                                       
CONECT   19   18   18   20   45                                       
CONECT   20   19   21   21   46                                       
CONECT   21   20   20   16   13                                       
CONECT   22   13   12   12   47                                       
CONECT   23   12   24   25   26                                       
CONECT   24   23                                                      
CONECT   25   23                                                      
CONECT   26   23                                                      
CONECT   27   13   13   10   48                                       
CONECT   28    8   49   50   51                                       
CONECT   29    2   30   30   30                                       
CONECT   30   29   29   29                                            
CONECT   31    1   52   53                                            
CONECT   32   33    6   54                                            
CONECT   33   32    5    5                                            
CONECT   34    5    1                                                 
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   22                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   31                                                      
CONECT   53   31                                                      
CONECT   54   32                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
