COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -9.567   1.219  -0.830  1.00  0.00           O  
HETATM    2  P   UNL     1      -8.747   1.623   0.334  1.00  0.00           P  
HETATM    3  O   UNL     1      -9.620   2.563   1.306  1.00  0.00           O  
HETATM    4  O   UNL     1      -7.453   2.434  -0.176  1.00  0.00           O  
HETATM    5  O   UNL     1      -8.275   0.310   1.139  1.00  0.00           O  
HETATM    6  C   UNL     1      -7.610  -0.534   0.197  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.133  -1.806   0.902  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.165  -1.435   2.026  1.00  0.00           C  
HETATM    9  C   UNL     1      -8.337  -2.546   1.489  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.421  -2.711  -0.106  1.00  0.00           C  
HETATM   11  O   UNL     1      -7.358  -3.161  -1.087  1.00  0.00           O  
HETATM   12  C   UNL     1      -5.318  -1.939  -0.783  1.00  0.00           C  
HETATM   13  O   UNL     1      -5.453  -1.568  -1.930  1.00  0.00           O  
HETATM   14  N   UNL     1      -4.182  -1.659  -0.113  1.00  0.00           N  
HETATM   15  C   UNL     1      -3.099  -0.932  -0.779  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.934  -0.747   0.195  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.820   0.001  -0.490  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.945   0.351  -1.640  1.00  0.00           O  
HETATM   19  O   UNL     1       0.311   0.279   0.177  1.00  0.00           O  
HETATM   20  P   UNL     1       1.501   1.079  -0.556  1.00  0.00           P  
HETATM   21  O   UNL     1       1.879   0.372  -1.800  1.00  0.00           O  
HETATM   22  O   UNL     1       1.006   2.568  -0.914  1.00  0.00           O  
HETATM   23  O   UNL     1       2.776   1.159   0.424  1.00  0.00           O  
HETATM   24  C   UNL     1       3.831   1.771  -0.320  1.00  0.00           C  
HETATM   25  C   UNL     1       5.080   1.878   0.558  1.00  0.00           C  
HETATM   26  O   UNL     1       5.586   0.564   0.850  1.00  0.00           O  
HETATM   27  C   UNL     1       6.186   2.642  -0.194  1.00  0.00           C  
HETATM   28  O   UNL     1       6.562   3.822   0.518  1.00  0.00           O  
HETATM   29  C   UNL     1       7.368   1.638  -0.245  1.00  0.00           C  
HETATM   30  O   UNL     1       8.610   2.303  -0.004  1.00  0.00           O  
HETATM   31  C   UNL     1       7.024   0.672   0.917  1.00  0.00           C  
HETATM   32  N   UNL     1       7.649  -0.636   0.706  1.00  0.00           N  
HETATM   33  C   UNL     1       8.542  -1.115   1.618  1.00  0.00           C  
HETATM   34  C   UNL     1       9.114  -2.325   1.412  1.00  0.00           C  
HETATM   35  C   UNL     1       8.767  -3.057   0.258  1.00  0.00           C  
HETATM   36  N   UNL     1       9.333  -4.289   0.024  1.00  0.00           N  
HETATM   37  N   UNL     1       7.892  -2.551  -0.601  1.00  0.00           N  
HETATM   38  C   UNL     1       7.335  -1.361  -0.383  1.00  0.00           C  
HETATM   39  O   UNL     1       6.533  -0.917  -1.188  1.00  0.00           O  
HETATM   40  H   UNL     1      -9.882   3.335   0.787  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.947   2.677   0.611  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.752  -0.008  -0.221  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.300  -0.799  -0.604  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.726  -2.342   2.442  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.375  -0.798   1.629  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.704  -0.900   2.808  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.881  -1.880   2.159  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.997  -2.865   0.681  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.993  -3.418   2.043  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.997  -3.570   0.413  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.709  -2.372  -1.522  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.082  -1.940   0.810  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.761  -1.498  -1.647  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.462   0.045  -1.101  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.273  -0.181   1.063  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.572  -1.723   0.517  1.00  0.00           H  
HETATM   57  H   UNL     1       0.770   2.994  -0.078  1.00  0.00           H  
HETATM   58  H   UNL     1       4.056   1.165  -1.198  1.00  0.00           H  
HETATM   59  H   UNL     1       3.523   2.768  -0.635  1.00  0.00           H  
HETATM   60  H   UNL     1       4.837   2.396   1.486  1.00  0.00           H  
HETATM   61  H   UNL     1       5.857   2.894  -1.202  1.00  0.00           H  
HETATM   62  H   UNL     1       7.295   4.221   0.031  1.00  0.00           H  
HETATM   63  H   UNL     1       7.391   1.109  -1.198  1.00  0.00           H  
HETATM   64  H   UNL     1       8.766   2.886  -0.759  1.00  0.00           H  
HETATM   65  H   UNL     1       7.333   1.095   1.872  1.00  0.00           H  
HETATM   66  H   UNL     1       8.792  -0.535   2.494  1.00  0.00           H  
HETATM   67  H   UNL     1       9.824  -2.723   2.121  1.00  0.00           H  
HETATM   68  H   UNL     1       9.972  -4.656   0.654  1.00  0.00           H  
HETATM   69  H   UNL     1       9.092  -4.790  -0.770  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    2    5                                                      
CONECT    3    2   40                                                 
CONECT    4    2   41                                                 
CONECT    5    2    6                                                 
CONECT    6    5    7   42   43                                       
CONECT    7    6    8    9   10                                       
CONECT    8    7   44   45   46                                       
CONECT    9    7   47   48   49                                       
CONECT   10    7   11   12   50                                       
CONECT   11   10   51                                                 
CONECT   12   10   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   52                                            
CONECT   15   14   16   53   54                                       
CONECT   16   15   17   55   56                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20                                                 
CONECT   20   19   21   21   22                                       
CONECT   20   23                                                      
CONECT   21   20   20                                                 
CONECT   22   20   57                                                 
CONECT   23   20   24                                                 
CONECT   24   23   25   58   59                                       
CONECT   25   24   26   27   60                                       
CONECT   26   25   31                                                 
CONECT   27   25   28   29   61                                       
CONECT   28   27   62                                                 
CONECT   29   27   30   31   63                                       
CONECT   30   29   64                                                 
CONECT   31   26   29   32   65                                       
CONECT   32   31   33   38                                            
CONECT   33   32   34   34   66                                       
CONECT   34   33   33   35   67                                       
CONECT   35   34   36   37   37                                       
CONECT   36   35   68   69                                            
CONECT   37   35   35   38                                            
CONECT   38   32   37   39   39                                       
CONECT   39   38   38                                                 
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   16                                                      
CONECT   57   22                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   33                                                      
CONECT   67   34                                                      
CONECT   68   36                                                      
CONECT   69   36                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
