COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.054   2.458  -1.024  1.00  0.00           C  
HETATM    2  C   UNL     1       3.563   3.358  -2.154  1.00  0.00           C  
HETATM    3  O   UNL     1       4.985   3.476  -2.058  1.00  0.00           O  
HETATM    4  C   UNL     1       5.674   2.224  -2.130  1.00  0.00           C  
HETATM    5  C   UNL     1       5.186   1.314  -1.001  1.00  0.00           C  
HETATM    6  N   UNL     1       3.728   1.154  -1.102  1.00  0.00           N  
HETATM    7  C   UNL     1       3.250   0.285  -0.119  1.00  0.00           C  
HETATM    8  C   UNL     1       1.896   0.001  -0.045  1.00  0.00           C  
HETATM    9  C   UNL     1       1.413  -0.867   0.936  1.00  0.00           C  
HETATM   10  C   UNL     1       4.134  -0.299   0.781  1.00  0.00           C  
HETATM   11  C   UNL     1       3.657  -1.159   1.751  1.00  0.00           C  
HETATM   12  C   UNL     1       2.306  -1.438   1.830  1.00  0.00           C  
HETATM   13  C   UNL     1       1.533  -2.328   2.778  1.00  0.00           C  
HETATM   14  C   UNL     1       2.007  -3.778   2.655  1.00  0.00           C  
HETATM   15  C   UNL     1       1.688  -1.837   4.218  1.00  0.00           C  
HETATM   16  C   UNL     1       0.071  -2.202   2.320  1.00  0.00           C  
HETATM   17  N   UNL     1       0.102  -1.281   1.181  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.008  -0.878   0.453  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.729   0.245   0.817  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.316   1.055   2.019  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.434  -1.602  -0.688  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.750  -2.746  -1.119  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.186  -3.419  -2.220  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.307  -2.982  -2.927  1.00  0.00           C  
HETATM   25  F   UNL     1      -2.717  -3.669  -4.015  1.00  0.00           F  
HETATM   26  C   UNL     1      -2.994  -1.872  -2.534  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.572  -1.154  -1.402  1.00  0.00           C  
HETATM   28  N   UNL     1      -3.230  -0.063  -0.997  1.00  0.00           N  
HETATM   29  C   UNL     1      -2.843   0.626   0.062  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.613   1.828   0.463  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.953   3.005   0.829  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.716   4.100   1.195  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.096   3.995   1.188  1.00  0.00           C  
HETATM   34  N   UNL     1      -5.691   2.871   0.838  1.00  0.00           N  
HETATM   35  C   UNL     1      -5.006   1.805   0.477  1.00  0.00           C  
HETATM   36  H   UNL     1       3.271   2.924  -0.063  1.00  0.00           H  
HETATM   37  H   UNL     1       1.978   2.319  -1.127  1.00  0.00           H  
HETATM   38  H   UNL     1       3.299   2.919  -3.116  1.00  0.00           H  
HETATM   39  H   UNL     1       3.109   4.345  -2.066  1.00  0.00           H  
HETATM   40  H   UNL     1       5.470   1.753  -3.092  1.00  0.00           H  
HETATM   41  H   UNL     1       6.746   2.392  -2.026  1.00  0.00           H  
HETATM   42  H   UNL     1       5.666   0.339  -1.086  1.00  0.00           H  
HETATM   43  H   UNL     1       5.438   1.760  -0.039  1.00  0.00           H  
HETATM   44  H   UNL     1       1.212   0.453  -0.748  1.00  0.00           H  
HETATM   45  H   UNL     1       5.190  -0.082   0.721  1.00  0.00           H  
HETATM   46  H   UNL     1       4.343  -1.614   2.451  1.00  0.00           H  
HETATM   47  H   UNL     1       3.061  -3.839   2.925  1.00  0.00           H  
HETATM   48  H   UNL     1       1.423  -4.409   3.325  1.00  0.00           H  
HETATM   49  H   UNL     1       1.875  -4.118   1.628  1.00  0.00           H  
HETATM   50  H   UNL     1       2.735  -1.905   4.514  1.00  0.00           H  
HETATM   51  H   UNL     1       1.358  -0.800   4.286  1.00  0.00           H  
HETATM   52  H   UNL     1       1.082  -2.455   4.880  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.314  -3.174   2.010  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.543  -1.791   3.122  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.686   1.885   1.699  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.203   1.444   2.518  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.758   0.421   2.709  1.00  0.00           H  
HETATM   58  H   UNL     1       0.119  -3.094  -0.580  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.658  -4.301  -2.551  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.860  -1.545  -3.090  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.874   3.059   0.825  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.241   5.025   1.483  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.695   4.847   1.474  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.530   0.904   0.193  1.00  0.00           H  
CONECT    1    6    2   36   37                                       
CONECT    2    1    3   38   39                                       
CONECT    3    4    2                                                 
CONECT    4    5    3   40   41                                       
CONECT    5    6    4   42   43                                       
CONECT    6    7    5    1                                            
CONECT    7    8    8   10    6                                       
CONECT    8    9    7    7   44                                       
CONECT    9   17   12   12    8                                       
CONECT   10   11   11    7   45                                       
CONECT   11   12   10   10   46                                       
CONECT   12   13    9    9   11                                       
CONECT   13   15   16   14   12                                       
CONECT   14   13   47   48   49                                       
CONECT   15   13   50   51   52                                       
CONECT   16   13   17   53   54                                       
CONECT   17   16   18    9                                            
CONECT   18   21   17   19   19                                       
CONECT   19   18   18   29   20                                       
CONECT   20   19   55   56   57                                       
CONECT   21   22   22   27   18                                       
CONECT   22   23   21   21   58                                       
CONECT   23   24   24   22   59                                       
CONECT   24   25   23   23   26                                       
CONECT   25   24                                                      
CONECT   26   24   27   27   60                                       
CONECT   27   26   26   21   28                                       
CONECT   28   27   29   29                                            
CONECT   29   28   28   19   30                                       
CONECT   30   29   35   35   31                                       
CONECT   31   30   32   32   61                                       
CONECT   32   31   31   33   62                                       
CONECT   33   34   34   32   63                                       
CONECT   34   35   33   33                                            
CONECT   35   30   30   34   64                                       
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    8                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   26                                                      
CONECT   61   31                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   35                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
