COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.367  -0.830  -1.835  1.00  0.00           C  
HETATM    2  C   UNL     1       2.601  -0.426  -1.069  1.00  0.00           C  
HETATM    3  C   UNL     1       3.254  -1.349  -0.274  1.00  0.00           C  
HETATM    4  C   UNL     1       3.079   0.868  -1.161  1.00  0.00           C  
HETATM    5  C   UNL     1       4.385  -0.979   0.429  1.00  0.00           C  
HETATM    6  C   UNL     1       4.208   1.239  -0.456  1.00  0.00           C  
HETATM    7  C   UNL     1       4.864   0.314   0.335  1.00  0.00           C  
HETATM    8  C   UNL     1       6.098   0.718   1.101  1.00  0.00           C  
HETATM    9  F   UNL     1       6.248  -0.114   2.215  1.00  0.00           F  
HETATM   10  F   UNL     1       5.971   2.046   1.523  1.00  0.00           F  
HETATM   11  P   UNL     1       7.560   0.560   0.023  1.00  0.00           P  
HETATM   12  O   UNL     1       7.331   1.416  -1.321  1.00  0.00           O  
HETATM   13  O   UNL     1       7.782  -0.988  -0.357  1.00  0.00           O  
HETATM   14  O   UNL     1       8.754   1.070   0.734  1.00  0.00           O  
HETATM   15  C   UNL     1       0.122  -0.482  -1.016  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.130  -0.883  -1.798  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.356  -0.406  -1.062  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.682   0.938  -1.061  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.158  -1.312  -0.394  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.806   1.375  -0.386  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.279  -0.874   0.285  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.605   0.470   0.287  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.830   0.947   1.024  1.00  0.00           C  
HETATM   24  F   UNL     1      -6.008   0.178   2.179  1.00  0.00           F  
HETATM   25  F   UNL     1      -5.667   2.290   1.378  1.00  0.00           F  
HETATM   26  P   UNL     1      -7.291   0.775  -0.052  1.00  0.00           P  
HETATM   27  O   UNL     1      -7.032   1.554  -1.437  1.00  0.00           O  
HETATM   28  O   UNL     1      -7.555  -0.784  -0.354  1.00  0.00           O  
HETATM   29  O   UNL     1      -8.473   1.353   0.625  1.00  0.00           O  
HETATM   30  C   UNL     1       0.095   1.001  -0.750  1.00  0.00           C  
HETATM   31  C   UNL     1       0.003   1.891  -1.803  1.00  0.00           C  
HETATM   32  C   UNL     1       0.156   1.471   0.549  1.00  0.00           C  
HETATM   33  C   UNL     1       0.044   3.722  -0.260  1.00  0.00           C  
HETATM   34  C   UNL     1      -0.023   3.252  -1.559  1.00  0.00           C  
HETATM   35  C   UNL     1       0.135   2.831   0.793  1.00  0.00           C  
HETATM   36  N   UNL     1       0.156  -1.208   0.260  1.00  0.00           N  
HETATM   37  N   UNL     1      -0.900  -0.831   1.042  1.00  0.00           N  
HETATM   38  N   UNL     1      -1.630  -1.793   1.298  1.00  0.00           N  
HETATM   39  C   UNL     1      -1.156  -2.936   0.719  1.00  0.00           C  
HETATM   40  C   UNL     1       0.014  -2.581   0.034  1.00  0.00           C  
HETATM   41  C   UNL     1      -1.590  -4.259   0.695  1.00  0.00           C  
HETATM   42  C   UNL     1       0.726  -3.528  -0.656  1.00  0.00           C  
HETATM   43  C   UNL     1      -0.864  -5.204  -0.002  1.00  0.00           C  
HETATM   44  C   UNL     1       0.289  -4.843  -0.676  1.00  0.00           C  
HETATM   45  H   UNL     1       1.338  -0.296  -2.785  1.00  0.00           H  
HETATM   46  H   UNL     1       1.391  -1.903  -2.022  1.00  0.00           H  
HETATM   47  H   UNL     1       2.880  -2.360  -0.201  1.00  0.00           H  
HETATM   48  H   UNL     1       2.569   1.589  -1.782  1.00  0.00           H  
HETATM   49  H   UNL     1       4.895  -1.700   1.050  1.00  0.00           H  
HETATM   50  H   UNL     1       4.582   2.250  -0.528  1.00  0.00           H  
HETATM   51  H   UNL     1       8.125   1.305  -1.862  1.00  0.00           H  
HETATM   52  H   UNL     1       6.984  -1.280  -0.817  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.101  -0.428  -2.789  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.165  -1.968  -1.897  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.058   1.646  -1.586  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.903  -2.362  -0.396  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.060   2.425  -0.383  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.903  -1.582   0.810  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.256   1.147  -1.846  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.334  -0.830  -0.925  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.049   1.524  -2.818  1.00  0.00           H  
HETATM   62  H   UNL     1       0.227   0.776   1.372  1.00  0.00           H  
HETATM   63  H   UNL     1       0.025   4.784  -0.069  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.094   3.947  -2.382  1.00  0.00           H  
HETATM   65  H   UNL     1       0.187   3.199   1.808  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.489  -4.545   1.221  1.00  0.00           H  
HETATM   67  H   UNL     1       1.627  -3.249  -1.183  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.198  -6.231  -0.022  1.00  0.00           H  
HETATM   69  H   UNL     1       0.851  -5.588  -1.219  1.00  0.00           H  
CONECT    1    2   15   45   46                                       
CONECT    2    1    3    3    4                                       
CONECT    3    2    2    5   47                                       
CONECT    4    2    6    6   48                                       
CONECT    5    3    7    7   49                                       
CONECT    6    4    4    7   50                                       
CONECT    7    5    5    6    8                                       
CONECT    8    7    9   10   11                                       
CONECT    9    8                                                      
CONECT   10    8                                                      
CONECT   11    8   12   13   14                                       
CONECT   11   14                                                      
CONECT   12   11   51                                                 
CONECT   13   11   52                                                 
CONECT   14   11   11                                                 
CONECT   15    1   16   30   36                                       
CONECT   16   15   17   53   54                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17   20   55                                       
CONECT   19   17   21   21   56                                       
CONECT   20   18   22   22   57                                       
CONECT   21   19   19   22   58                                       
CONECT   22   20   20   21   23                                       
CONECT   23   22   24   25   26                                       
CONECT   24   23                                                      
CONECT   25   23                                                      
CONECT   26   23   27   28   29                                       
CONECT   26   29                                                      
CONECT   27   26   59                                                 
CONECT   28   26   60                                                 
CONECT   29   26   26                                                 
CONECT   30   15   31   31   32                                       
CONECT   31   30   30   34   61                                       
CONECT   32   30   35   35   62                                       
CONECT   33   34   34   35   63                                       
CONECT   34   31   33   33   64                                       
CONECT   35   32   32   33   65                                       
CONECT   36   15   37   40                                            
CONECT   37   36   38   38                                            
CONECT   38   37   37   39                                            
CONECT   39   38   40   40   41                                       
CONECT   40   36   39   39   42                                       
CONECT   41   39   43   43   66                                       
CONECT   42   40   44   44   67                                       
CONECT   43   41   41   44   68                                       
CONECT   44   42   42   43   69                                       
CONECT   45    1                                                      
CONECT   46    1                                                      
CONECT   47    3                                                      
CONECT   48    4                                                      
CONECT   49    5                                                      
CONECT   50    6                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   31                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   35                                                      
CONECT   66   41                                                      
CONECT   67   42                                                      
CONECT   68   43                                                      
CONECT   69   44                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
