COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -5.689   2.908   1.173  1.00  0.00           P  
HETATM    2  O   UNL     1      -6.808   3.404   0.341  1.00  0.00           O  
HETATM    3  O   UNL     1      -5.202   4.074   2.170  1.00  0.00           O  
HETATM    4  O   UNL     1      -6.181   1.638   2.032  1.00  0.00           O  
HETATM    5  O   UNL     1      -4.466   2.470   0.221  1.00  0.00           O  
HETATM    6  C   UNL     1      -4.607   1.528  -0.844  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.258   1.342  -1.542  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.309   0.712  -0.655  1.00  0.00           O  
HETATM    9  C   UNL     1      -3.384   0.333  -2.712  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.802   0.990  -3.910  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.933  -0.190  -2.846  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.291   0.122  -1.480  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.806  -1.116  -0.864  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.587  -2.185  -0.456  1.00  0.00           C  
HETATM   15  N   UNL     1      -2.916  -2.366  -0.510  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.474  -3.469  -0.064  1.00  0.00           C  
HETATM   17  N   UNL     1      -4.837  -3.609  -0.140  1.00  0.00           N  
HETATM   18  N   UNL     1      -2.732  -4.475   0.472  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.390  -4.354   0.555  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.714  -5.252   1.034  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.787  -3.180   0.081  1.00  0.00           C  
HETATM   22  N   UNL     1       0.567  -2.782   0.038  1.00  0.00           N  
HETATM   23  C   UNL     1       0.594  -1.447  -0.575  1.00  0.00           C  
HETATM   24  N   UNL     1       1.161  -0.474   0.362  1.00  0.00           N  
HETATM   25  C   UNL     1       0.348   0.349   1.054  1.00  0.00           C  
HETATM   26  C   UNL     1       0.927   1.312   2.057  1.00  0.00           C  
HETATM   27  O   UNL     1      -0.850   0.313   0.869  1.00  0.00           O  
HETATM   28  C   UNL     1       2.546  -0.398   0.539  1.00  0.00           C  
HETATM   29  C   UNL     1       3.159  -1.212   1.500  1.00  0.00           C  
HETATM   30  C   UNL     1       4.498  -1.180   1.712  1.00  0.00           C  
HETATM   31  C   UNL     1       5.305  -0.306   0.950  1.00  0.00           C  
HETATM   32  C   UNL     1       4.667   0.547  -0.058  1.00  0.00           C  
HETATM   33  C   UNL     1       3.270   0.462  -0.234  1.00  0.00           C  
HETATM   34  C   UNL     1       6.683  -0.250   1.145  1.00  0.00           C  
HETATM   35  C   UNL     1       7.452   0.623   0.377  1.00  0.00           C  
HETATM   36  C   UNL     1       6.814   1.477  -0.631  1.00  0.00           C  
HETATM   37  C   UNL     1       5.436   1.420  -0.826  1.00  0.00           C  
HETATM   38  C   UNL     1       8.851   0.706   0.549  1.00  0.00           C  
HETATM   39  C   UNL     1       9.569   1.567  -0.216  1.00  0.00           C  
HETATM   40  C   UNL     1       7.623   2.349  -1.391  1.00  0.00           C  
HETATM   41  C   UNL     1       8.962   2.380  -1.175  1.00  0.00           C  
HETATM   42  H   UNL     1      -5.889   4.387   2.774  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.942   0.572  -0.441  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.339   1.897  -1.561  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.876   2.299  -1.897  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.067  -0.477  -2.456  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.466   0.822  -1.610  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.930  -1.264  -3.033  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.409   0.338  -3.643  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.377  -2.898  -0.521  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.261  -4.418   0.186  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.167  -5.280   0.795  1.00  0.00           H  
HETATM   53  H   UNL     1       1.331  -3.292   0.350  1.00  0.00           H  
HETATM   54  H   UNL     1       1.244   2.222   1.547  1.00  0.00           H  
HETATM   55  H   UNL     1       0.171   1.559   2.803  1.00  0.00           H  
HETATM   56  H   UNL     1       1.786   0.854   2.548  1.00  0.00           H  
HETATM   57  H   UNL     1       2.549  -1.883   2.088  1.00  0.00           H  
HETATM   58  H   UNL     1       2.776   1.077  -0.971  1.00  0.00           H  
HETATM   59  H   UNL     1       4.945  -1.818   2.461  1.00  0.00           H  
HETATM   60  H   UNL     1       7.153  -0.878   1.887  1.00  0.00           H  
HETATM   61  H   UNL     1       4.966   2.049  -1.568  1.00  0.00           H  
HETATM   62  H   UNL     1       9.346   0.089   1.284  1.00  0.00           H  
HETATM   63  H   UNL     1       7.178   2.988  -2.139  1.00  0.00           H  
HETATM   64  H   UNL     1      10.639   1.626  -0.079  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.895   0.401  -4.670  1.00  0.00           H  
HETATM   66  H   UNL     1       9.575   3.050  -1.760  1.00  0.00           H  
HETATM   67  H   UNL     1       1.175  -1.466  -1.497  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.497   1.260   2.602  1.00  0.00           H  
CONECT    1    2    2    3    5                                       
CONECT    1    4                                                      
CONECT    2    1    1                                                 
CONECT    3    1   42                                                 
CONECT    4    1   68                                                 
CONECT    5    1    6                                                 
CONECT    6    5    7   43   44                                       
CONECT    7    6    8    9   45                                       
CONECT    8    7   12                                                 
CONECT    9    7   10   11   46                                       
CONECT   10    9   65                                                 
CONECT   11    9   12   48   49                                       
CONECT   12    8   11   13   47                                       
CONECT   13   12   14   23                                            
CONECT   14   13   15   21   21                                       
CONECT   15   14   16   16                                            
CONECT   16   15   15   17   18                                       
CONECT   17   16   50   51                                            
CONECT   18   16   19   52                                            
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   14   14   19   22                                       
CONECT   22   21   23   53                                            
CONECT   23   13   22   24   67                                       
CONECT   24   23   25   28                                            
CONECT   25   24   26   27   27                                       
CONECT   26   25   54   55   56                                       
CONECT   27   25   25                                                 
CONECT   28   24   29   33   33                                       
CONECT   29   28   30   30   57                                       
CONECT   30   29   29   31   59                                       
CONECT   31   30   32   34   34                                       
CONECT   32   31   33   37   37                                       
CONECT   33   28   28   32   58                                       
CONECT   34   31   31   35   60                                       
CONECT   35   34   36   36   38                                       
CONECT   36   35   35   37   40                                       
CONECT   37   32   32   36   61                                       
CONECT   38   35   39   39   62                                       
CONECT   39   38   38   41   64                                       
CONECT   40   36   41   41   63                                       
CONECT   41   40   40   39   66                                       
CONECT   42    3                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    9                                                      
CONECT   47   12                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   22                                                      
CONECT   54   26                                                      
CONECT   55   26                                                      
CONECT   56   26                                                      
CONECT   57   29                                                      
CONECT   58   33                                                      
CONECT   59   30                                                      
CONECT   60   34                                                      
CONECT   61   37                                                      
CONECT   62   38                                                      
CONECT   63   40                                                      
CONECT   64   39                                                      
CONECT   65   10                                                      
CONECT   66   41                                                      
CONECT   67   23                                                      
CONECT   68    4                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
