COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       7.481   1.091  -0.319  1.00  0.00           O  
HETATM    2  C   UNL     1       6.693   0.834   0.569  1.00  0.00           C  
HETATM    3  O   UNL     1       7.134   0.644   1.828  1.00  0.00           O  
HETATM    4  C   UNL     1       8.552   0.746   2.123  1.00  0.00           C  
HETATM    5  C   UNL     1       5.250   0.731   0.269  1.00  0.00           C  
HETATM    6  C   UNL     1       4.789   0.927  -1.034  1.00  0.00           C  
HETATM    7  C   UNL     1       3.440   0.828  -1.307  1.00  0.00           C  
HETATM    8  C   UNL     1       4.342   0.431   1.287  1.00  0.00           C  
HETATM    9  C   UNL     1       2.995   0.341   1.000  1.00  0.00           C  
HETATM   10  C   UNL     1       2.545   0.536  -0.293  1.00  0.00           C  
HETATM   11  C   UNL     1       1.074   0.431  -0.599  1.00  0.00           C  
HETATM   12  N   UNL     1       0.576   1.730  -1.058  1.00  0.00           N  
HETATM   13  N   UNL     1      -0.021   2.011  -2.296  1.00  0.00           N  
HETATM   14  N   UNL     1      -0.333   3.258  -2.348  1.00  0.00           N  
HETATM   15  C   UNL     1       0.015   3.875  -1.201  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.100   5.198  -0.754  1.00  0.00           C  
HETATM   17  C   UNL     1       0.595   2.912  -0.357  1.00  0.00           C  
HETATM   18  C   UNL     1       1.055   3.281   0.902  1.00  0.00           C  
HETATM   19  C   UNL     1       0.930   4.587   1.319  1.00  0.00           C  
HETATM   20  C   UNL     1       0.352   5.538   0.487  1.00  0.00           C  
HETATM   21  C   UNL     1       0.319   0.012   0.664  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.161  -0.015   0.379  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.774  -1.200   0.018  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.131  -1.224  -0.244  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.876  -0.064  -0.143  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.355  -0.091  -0.428  1.00  0.00           C  
HETATM   27  F   UNL     1      -5.735   1.112  -1.035  1.00  0.00           F  
HETATM   28  P   UNL     1      -6.272  -0.300   1.133  1.00  0.00           P  
HETATM   29  O   UNL     1      -5.745  -1.618   1.893  1.00  0.00           O  
HETATM   30  O   UNL     1      -7.716  -0.442   0.842  1.00  0.00           O  
HETATM   31  O   UNL     1      -6.037   0.989   2.070  1.00  0.00           O  
HETATM   32  F   UNL     1      -5.645  -1.157  -1.286  1.00  0.00           F  
HETATM   33  C   UNL     1      -3.263   1.121   0.220  1.00  0.00           C  
HETATM   34  C   UNL     1      -1.906   1.145   0.485  1.00  0.00           C  
HETATM   35  C   UNL     1       0.854  -0.615  -1.695  1.00  0.00           C  
HETATM   36  C   UNL     1       1.501  -1.914  -1.286  1.00  0.00           C  
HETATM   37  C   UNL     1       0.771  -3.016  -1.191  1.00  0.00           C  
HETATM   38  C   UNL     1       1.377  -4.260  -0.670  1.00  0.00           C  
HETATM   39  C   UNL     1       2.717  -4.279  -0.283  1.00  0.00           C  
HETATM   40  C   UNL     1       3.274  -5.441   0.208  1.00  0.00           C  
HETATM   41  C   UNL     1       2.510  -6.590   0.306  1.00  0.00           C  
HETATM   42  C   UNL     1       1.182  -6.581  -0.082  1.00  0.00           C  
HETATM   43  C   UNL     1       0.611  -5.423  -0.569  1.00  0.00           C  
HETATM   44  H   UNL     1       8.717   0.563   3.185  1.00  0.00           H  
HETATM   45  H   UNL     1       9.099   0.007   1.537  1.00  0.00           H  
HETATM   46  H   UNL     1       8.906   1.745   1.868  1.00  0.00           H  
HETATM   47  H   UNL     1       5.486   1.156  -1.826  1.00  0.00           H  
HETATM   48  H   UNL     1       3.082   0.980  -2.315  1.00  0.00           H  
HETATM   49  H   UNL     1       4.692   0.278   2.297  1.00  0.00           H  
HETATM   50  H   UNL     1       2.291   0.114   1.787  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.547   5.947  -1.390  1.00  0.00           H  
HETATM   52  H   UNL     1       1.505   2.545   1.552  1.00  0.00           H  
HETATM   53  H   UNL     1       1.283   4.875   2.298  1.00  0.00           H  
HETATM   54  H   UNL     1       0.261   6.560   0.827  1.00  0.00           H  
HETATM   55  H   UNL     1       0.647  -0.981   0.972  1.00  0.00           H  
HETATM   56  H   UNL     1       0.522   0.726   1.462  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.192  -2.106  -0.061  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.610  -2.150  -0.527  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.803  -1.485   2.063  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.538   0.838   2.883  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.844   2.028   0.298  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.428   2.070   0.768  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.215  -0.771  -1.839  1.00  0.00           H  
HETATM   64  H   UNL     1       1.299  -0.265  -2.626  1.00  0.00           H  
HETATM   65  H   UNL     1       2.559  -1.946  -1.071  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.265  -3.006  -1.494  1.00  0.00           H  
HETATM   67  H   UNL     1       3.314  -3.382  -0.359  1.00  0.00           H  
HETATM   68  H   UNL     1       4.310  -5.455   0.513  1.00  0.00           H  
HETATM   69  H   UNL     1       2.952  -7.499   0.687  1.00  0.00           H  
HETATM   70  H   UNL     1       0.591  -7.481  -0.003  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.426  -5.416  -0.871  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    5                                       
CONECT    3    2    4                                                 
CONECT    4    3   44   45   46                                       
CONECT    5    2    6    6    8                                       
CONECT    6    5    5    7   47                                       
CONECT    7    6   10   10   48                                       
CONECT    8    5    9    9   49                                       
CONECT    9    8    8   10   50                                       
CONECT   10    7    7    9   11                                       
CONECT   11   10   12   21   35                                       
CONECT   12   11   13   17                                            
CONECT   13   12   14   14                                            
CONECT   14   13   13   15                                            
CONECT   15   14   16   17   17                                       
CONECT   16   15   20   20   51                                       
CONECT   17   12   15   15   18                                       
CONECT   18   17   19   19   52                                       
CONECT   19   18   18   20   53                                       
CONECT   20   16   16   19   54                                       
CONECT   21   11   22   55   56                                       
CONECT   22   21   23   23   34                                       
CONECT   23   22   22   24   57                                       
CONECT   24   23   25   25   58                                       
CONECT   25   24   24   26   33                                       
CONECT   26   25   27   28   32                                       
CONECT   27   26                                                      
CONECT   28   26   29   30   30                                       
CONECT   28   31                                                      
CONECT   29   28   59                                                 
CONECT   30   28   28                                                 
CONECT   31   28   60                                                 
CONECT   32   26                                                      
CONECT   33   25   34   34   61                                       
CONECT   34   22   33   33   62                                       
CONECT   35   11   36   63   64                                       
CONECT   36   35   37   37   65                                       
CONECT   37   36   36   38   66                                       
CONECT   38   37   39   43   43                                       
CONECT   39   38   40   40   67                                       
CONECT   40   39   39   41   68                                       
CONECT   41   40   42   42   69                                       
CONECT   42   41   41   43   70                                       
CONECT   43   38   38   42   71                                       
CONECT   44    4                                                      
CONECT   45    4                                                      
CONECT   46    4                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   16                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   29                                                      
CONECT   60   31                                                      
CONECT   61   33                                                      
CONECT   62   34                                                      
CONECT   63   35                                                      
CONECT   64   35                                                      
CONECT   65   36                                                      
CONECT   66   37                                                      
CONECT   67   39                                                      
CONECT   68   40                                                      
CONECT   69   41                                                      
CONECT   70   42                                                      
CONECT   71   43                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
