COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       3.644   4.572   0.057  1.00  0.00           P  
HETATM    2  O   UNL     1       2.895   3.257   0.062  1.00  0.00           O1-
HETATM    3  O   UNL     1       5.064   4.651  -0.461  1.00  0.00           O  
HETATM    4  O   UNL     1       2.721   5.683  -0.711  1.00  0.00           O  
HETATM    5  P   UNL     1       4.294   4.655   2.944  1.00  0.00           P  
HETATM    6  O   UNL     1       3.633   3.349   3.329  1.00  0.00           O1-
HETATM    7  O   UNL     1       5.797   4.749   2.800  1.00  0.00           O  
HETATM    8  O   UNL     1       3.600   5.194   1.567  1.00  0.00           O  
HETATM    9  P   UNL     1       3.049  11.320  -2.671  1.00  0.00           P  
HETATM   10  O   UNL     1       3.497  11.299  -4.225  1.00  0.00           O  
HETATM   11  O   UNL     1       4.443  11.552  -1.885  1.00  0.00           O  
HETATM   12  O   UNL     1       1.960  12.294  -2.331  1.00  0.00           O  
HETATM   13  N   UNL     1       1.091   9.592   2.007  1.00  0.00           N  
HETATM   14  C   UNL     1       0.325  10.326   2.869  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.902  10.823   2.651  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.339  11.496   3.738  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.710  11.698   4.921  1.00  0.00           N  
HETATM   18  C   UNL     1       0.527  11.167   5.071  1.00  0.00           C  
HETATM   19  N   UNL     1       1.230  11.342   6.275  1.00  0.00           N  
HETATM   20  C   UNL     1       1.088  10.450   4.019  1.00  0.00           C  
HETATM   21  N   UNL     1       2.293   9.810   3.873  1.00  0.00           N  
HETATM   22  C   UNL     1       2.263   9.307   2.657  1.00  0.00           C  
HETATM   23  C   UNL     1       3.205   7.008  -0.849  1.00  0.00           C  
HETATM   24  C   UNL     1       2.027   7.965  -0.873  1.00  0.00           C  
HETATM   25  O   UNL     1       1.311   7.887   0.370  1.00  0.00           O  
HETATM   26  C   UNL     1       0.736   9.182   0.647  1.00  0.00           C  
HETATM   27  C   UNL     1       1.230  10.147  -0.433  1.00  0.00           C  
HETATM   28  O   UNL     1       0.210  10.314  -1.416  1.00  0.00           O  
HETATM   29  C   UNL     1       2.433   9.423  -1.007  1.00  0.00           C  
HETATM   30  O   UNL     1       2.716   9.775  -2.345  1.00  0.00           O  
HETATM   31  O   UNL     1       1.352   6.892   5.386  1.00  0.00           O  
HETATM   32  C   UNL     1       2.158   6.934   6.552  1.00  0.00           C  
HETATM   33  C   UNL     1       3.619   6.922   6.139  1.00  0.00           C  
HETATM   34  O   UNL     1       4.451   6.935   7.312  1.00  0.00           O  
HETATM   35  C   UNL     1       5.558   6.046   7.100  1.00  0.00           C  
HETATM   36  C   UNL     1       5.496   5.601   5.650  1.00  0.00           C  
HETATM   37  C   UNL     1       4.015   5.681   5.355  1.00  0.00           C  
HETATM   38  O   UNL     1       3.772   5.820   3.971  1.00  0.00           O  
HETATM   39  P   UNL     1      -0.257   6.895   5.560  1.00  0.00           P  
HETATM   40  O   UNL     1      -0.513   5.648   6.558  1.00  0.00           O  
HETATM   41  O   UNL     1      -0.540   8.184   6.494  1.00  0.00           O  
HETATM   42  O   UNL     1      -1.034   6.849   4.277  1.00  0.00           O  
HETATM   43  N   UNL     1       5.433   4.942   8.013  1.00  0.00           N  
HETATM   44  C   UNL     1       4.329   4.901   8.856  1.00  0.00           C  
HETATM   45  C   UNL     1       6.403   3.918   8.059  1.00  0.00           C  
HETATM   46  O   UNL     1       7.406   3.890   7.343  1.00  0.00           O  
HETATM   47  N   UNL     1       6.154   2.907   8.994  1.00  0.00           N  
HETATM   48  C   UNL     1       5.072   2.818   9.857  1.00  0.00           C  
HETATM   49  O   UNL     1       4.915   1.900  10.657  1.00  0.00           O  
HETATM   50  C   UNL     1       4.094   3.933   9.749  1.00  0.00           C  
HETATM   51  C   UNL     1       2.898   3.908  10.647  1.00  0.00           C  
HETATM   52  H   UNL     1       3.692  12.149  -4.674  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.328  11.933   3.653  1.00  0.00           H  
HETATM   54  H   UNL     1       2.157  11.723   6.254  1.00  0.00           H  
HETATM   55  H   UNL     1       0.836  10.998   7.130  1.00  0.00           H  
HETATM   56  H   UNL     1       3.053   8.731   2.195  1.00  0.00           H  
HETATM   57  H   UNL     1       3.864   7.232  -0.005  1.00  0.00           H  
HETATM   58  H   UNL     1       3.777   7.079  -1.779  1.00  0.00           H  
HETATM   59  H   UNL     1       1.348   7.666  -1.681  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.354   9.080   0.653  1.00  0.00           H  
HETATM   61  H   UNL     1       1.478  11.144  -0.059  1.00  0.00           H  
HETATM   62  H   UNL     1       0.652  10.512  -2.260  1.00  0.00           H  
HETATM   63  H   UNL     1       3.315   9.629  -0.389  1.00  0.00           H  
HETATM   64  H   UNL     1       1.928   7.844   7.110  1.00  0.00           H  
HETATM   65  H   UNL     1       1.932   6.063   7.172  1.00  0.00           H  
HETATM   66  H   UNL     1       3.829   7.834   5.568  1.00  0.00           H  
HETATM   67  H   UNL     1       6.493   6.561   7.337  1.00  0.00           H  
HETATM   68  H   UNL     1       5.917   4.608   5.466  1.00  0.00           H  
HETATM   69  H   UNL     1       6.040   6.308   5.011  1.00  0.00           H  
HETATM   70  H   UNL     1       3.499   4.787   5.724  1.00  0.00           H  
HETATM   71  H   UNL     1      -1.468   8.436   6.687  1.00  0.00           H  
HETATM   72  H   UNL     1       3.640   5.733   8.745  1.00  0.00           H  
HETATM   73  H   UNL     1       6.840   2.159   9.045  1.00  0.00           H  
HETATM   74  H   UNL     1       2.313   3.010  10.456  1.00  0.00           H  
HETATM   75  H   UNL     1       2.281   4.787  10.462  1.00  0.00           H  
HETATM   76  H   UNL     1       3.220   3.916  11.688  1.00  0.00           H  
HETATM   77  H   UNL     1       4.822  12.456  -1.848  1.00  0.00           H  
HETATM   78  H   UNL     1      -1.436   5.378   6.752  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    1    8                                                      
CONECT    2    1                                                      
CONECT    3    1    1                                                 
CONECT    4    1   23                                                 
CONECT    5    6    7    7    8                                       
CONECT    5   38                                                      
CONECT    6    5                                                      
CONECT    7    5    5                                                 
CONECT    8    1    5                                                 
CONECT    9   10   11   12   12                                       
CONECT    9   30                                                      
CONECT   10    9   52                                                 
CONECT   11    9   77                                                 
CONECT   12    9    9                                                 
CONECT   13   14   22   26                                            
CONECT   14   13   15   15   20                                       
CONECT   15   14   14   16                                            
CONECT   16   15   17   17   53                                       
CONECT   17   16   16   18                                            
CONECT   18   17   19   20   20                                       
CONECT   19   18   54   55                                            
CONECT   20   14   18   18   21                                       
CONECT   21   20   22   22                                            
CONECT   22   13   21   21   56                                       
CONECT   23    4   24   57   58                                       
CONECT   24   23   25   29   59                                       
CONECT   25   24   26                                                 
CONECT   26   13   25   27   60                                       
CONECT   27   26   28   29   61                                       
CONECT   28   27   62                                                 
CONECT   29   24   27   30   63                                       
CONECT   30    9   29                                                 
CONECT   31   32   39                                                 
CONECT   32   31   33   64   65                                       
CONECT   33   32   34   37   66                                       
CONECT   34   33   35                                                 
CONECT   35   34   36   43   67                                       
CONECT   36   35   37   68   69                                       
CONECT   37   33   36   38   70                                       
CONECT   38    5   37                                                 
CONECT   39   31   40   41   42                                       
CONECT   39   42                                                      
CONECT   40   39   78                                                 
CONECT   41   39   71                                                 
CONECT   42   39   39                                                 
CONECT   43   35   44   45                                            
CONECT   44   43   50   50   72                                       
CONECT   45   43   46   46   47                                       
CONECT   46   45   45                                                 
CONECT   47   45   48   73                                            
CONECT   48   47   49   49   50                                       
CONECT   49   48   48                                                 
CONECT   50   44   44   48   51                                       
CONECT   51   50   74   75   76                                       
CONECT   52   10                                                      
CONECT   53   16                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   22                                                      
CONECT   57   23                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
CONECT   66   33                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   36                                                      
CONECT   70   37                                                      
CONECT   71   41                                                      
CONECT   72   44                                                      
CONECT   73   47                                                      
CONECT   74   51                                                      
CONECT   75   51                                                      
CONECT   76   51                                                      
CONECT   77   11                                                      
CONECT   78   40                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
