COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.651  -0.913  -0.023  1.00  0.00           C  
HETATM    2  C   UNL     1       6.212  -1.306   0.197  1.00  0.00           C  
HETATM    3  C   UNL     1       5.921  -2.310   1.062  1.00  0.00           C  
HETATM    4  C   UNL     1       4.595  -2.686   1.278  1.00  0.00           C  
HETATM    5  C   UNL     1       3.584  -2.016   0.593  1.00  0.00           C  
HETATM    6  C   UNL     1       2.174  -2.383   0.793  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.187  -2.155   0.234  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.018  -1.091  -0.436  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.122  -0.048  -0.822  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.660   0.680  -1.913  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.402   1.724  -2.426  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.624   2.060  -1.854  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.608   3.010  -1.339  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.397   1.914  -0.384  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.233   1.522   0.642  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.711   0.822   1.750  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.426   0.118   2.704  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.335  -0.049   3.223  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.090   1.326  -0.755  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.341   0.271  -0.244  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.587  -3.510  -0.291  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.437  -4.314   0.445  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.803  -5.557  -0.036  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.320  -5.996  -1.255  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.470  -5.192  -1.991  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.108  -3.947  -1.512  1.00  0.00           C  
HETATM   27  C   UNL     1       3.939  -0.972  -0.301  1.00  0.00           C  
HETATM   28  C   UNL     1       5.592   0.436  -1.389  1.00  0.00           C  
HETATM   29  C   UNL     1       5.635   1.741  -0.637  1.00  0.00           C  
HETATM   30  C   UNL     1       6.848   2.257  -0.219  1.00  0.00           C  
HETATM   31  C   UNL     1       6.891   3.454   0.471  1.00  0.00           C  
HETATM   32  C   UNL     1       5.718   4.138   0.744  1.00  0.00           C  
HETATM   33  C   UNL     1       4.502   3.620   0.325  1.00  0.00           C  
HETATM   34  C   UNL     1       4.464   2.424  -0.370  1.00  0.00           C  
HETATM   35  F   UNL     1       5.758   5.305   1.424  1.00  0.00           F  
HETATM   36  F   UNL     1       3.357   4.285   0.591  1.00  0.00           F  
HETATM   37  N   UNL     1       1.231  -1.920  -0.051  1.00  0.00           N  
HETATM   38  N   UNL     1      -2.359  -1.106  -0.311  1.00  0.00           N  
HETATM   39  N   UNL     1      -5.552   3.048  -2.169  1.00  0.00           N  
HETATM   40  N   UNL     1      -6.550  -0.389   3.570  1.00  0.00           N  
HETATM   41  N   UNL     1      -5.379   0.694   2.102  1.00  0.00           N  
HETATM   42  N   UNL     1       5.234  -0.646  -0.468  1.00  0.00           N  
HETATM   43  O   UNL     1       1.859  -3.104   1.721  1.00  0.00           O  
HETATM   44  O   UNL     1      -0.479  -0.222  -1.087  1.00  0.00           O  
HETATM   45  O   UNL     1      -7.574   3.752  -1.375  1.00  0.00           O  
HETATM   46  O   UNL     1       3.073  -0.370  -0.912  1.00  0.00           O  
HETATM   47  H   UNL     1       7.903  -0.079   0.632  1.00  0.00           H  
HETATM   48  H   UNL     1       8.297  -1.761   0.203  1.00  0.00           H  
HETATM   49  H   UNL     1       7.791  -0.615  -1.062  1.00  0.00           H  
HETATM   50  H   UNL     1       6.717  -2.820   1.584  1.00  0.00           H  
HETATM   51  H   UNL     1       4.356  -3.485   1.964  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.352  -2.120   1.311  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.712   0.425  -2.363  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.032   2.282  -3.273  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.288   1.750   0.595  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.499   0.001   2.739  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.435  -0.327   3.752  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.708  -0.297   0.598  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.814  -3.971   1.397  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.467  -6.185   0.539  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.605  -6.967  -1.631  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.096  -5.533  -2.945  1.00  0.00           H  
HETATM   63  H   UNL     1       0.556  -3.319  -2.088  1.00  0.00           H  
HETATM   64  H   UNL     1       4.848   0.499  -2.182  1.00  0.00           H  
HETATM   65  H   UNL     1       6.571   0.235  -1.823  1.00  0.00           H  
HETATM   66  H   UNL     1       7.763   1.725  -0.431  1.00  0.00           H  
HETATM   67  H   UNL     1       7.838   3.856   0.798  1.00  0.00           H  
HETATM   68  H   UNL     1       3.517   2.020  -0.698  1.00  0.00           H  
HETATM   69  H   UNL     1       1.490  -1.431  -0.848  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.797  -1.849   0.133  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.448   3.684  -2.894  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.620   1.075   1.632  1.00  0.00           H  
CONECT    1    2   47   48   49                                       
CONECT    2    1    3    3   42                                       
CONECT    3    2    2    4   50                                       
CONECT    4    3    5    5   51                                       
CONECT    5    4    4   27    6                                       
CONECT    6    5   43   43   37                                       
CONECT    7   37   21    8   52                                       
CONECT    8   44   44    7   38                                       
CONECT    9   20   38   10   10                                       
CONECT   10    9    9   11   53                                       
CONECT   11   12   12   10   54                                       
CONECT   12   19   39   11   11                                       
CONECT   13   14   45   45   39                                       
CONECT   14   15   15   13   19                                       
CONECT   15   16   14   14   55                                       
CONECT   16   41   17   17   15                                       
CONECT   17   40   16   16   56                                       
CONECT   18   40   40   41   57                                       
CONECT   19   14   20   20   12                                       
CONECT   20   19   19    9   58                                       
CONECT   21   26    7   22   22                                       
CONECT   22   21   21   23   59                                       
CONECT   23   24   24   22   60                                       
CONECT   24   25   23   23   61                                       
CONECT   25   26   26   24   62                                       
CONECT   26   25   25   21   63                                       
CONECT   27   42    5   46   46                                       
CONECT   28   29   42   64   65                                       
CONECT   29   34   34   30   28                                       
CONECT   30   31   31   29   66                                       
CONECT   31   32   30   30   67                                       
CONECT   32   35   33   33   31                                       
CONECT   33   36   32   32   34                                       
CONECT   34   33   29   29   68                                       
CONECT   35   32                                                      
CONECT   36   33                                                      
CONECT   37    6    7   69                                            
CONECT   38    8    9   70                                            
CONECT   39   13   12   71                                            
CONECT   40   18   18   17                                            
CONECT   41   18   16   72                                            
CONECT   42    2   28   27                                            
CONECT   43    6    6                                                 
CONECT   44    8    8                                                 
CONECT   45   13   13                                                 
CONECT   46   27   27                                                 
CONECT   47    1                                                      
CONECT   48    1                                                      
CONECT   49    1                                                      
CONECT   50    3                                                      
CONECT   51    4                                                      
CONECT   52    7                                                      
CONECT   53   10                                                      
CONECT   54   11                                                      
CONECT   55   15                                                      
CONECT   56   17                                                      
CONECT   57   18                                                      
CONECT   58   20                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   34                                                      
CONECT   69   37                                                      
CONECT   70   38                                                      
CONECT   71   39                                                      
CONECT   72   41                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
