COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.159  -2.720   0.588  1.00  0.00           O  
HETATM    2  P   UNL     1      -0.116  -2.823   1.566  1.00  0.00           P  
HETATM    3  P   UNL     1       2.638  -3.355   0.608  1.00  0.00           P  
HETATM    4  N   UNL     1      -8.360   1.410  -3.724  1.00  0.00           N  
HETATM    5  O   UNL     1      -0.826  -4.255   1.373  1.00  0.00           O  
HETATM    6  C   UNL     1      -4.736   0.343  -0.159  1.00  0.00           C  
HETATM    7  C   UNL     1       6.751   0.290  -1.323  1.00  0.00           C  
HETATM    8  N   UNL     1       7.045   1.423  -0.442  1.00  0.00           N1+
HETATM    9  O   UNL     1       3.161  -3.343   1.993  1.00  0.00           O  
HETATM   10  O   UNL     1      -8.199   1.782   0.527  1.00  0.00           O  
HETATM   11  C   UNL     1      -7.668   2.248  -2.973  1.00  0.00           C  
HETATM   12  O   UNL     1       0.327  -2.677   2.970  1.00  0.00           O  
HETATM   13  C   UNL     1      -5.426   0.514   1.213  1.00  0.00           C  
HETATM   14  O   UNL     1      -5.833   1.871   1.403  1.00  0.00           O  
HETATM   15  P   UNL     1      -7.367   2.301   1.636  1.00  0.00           P  
HETATM   16  C   UNL     1       7.864  -0.783  -1.222  1.00  0.00           C  
HETATM   17  O   UNL     1       8.937  -0.492  -2.119  1.00  0.00           O  
HETATM   18  C   UNL     1       7.565   2.516  -0.960  1.00  0.00           C  
HETATM   19  O   UNL     1       2.579  -4.872   0.070  1.00  0.00           O  
HETATM   20  O   UNL     1      -7.473   3.907   1.680  1.00  0.00           O  
HETATM   21  N   UNL     1      -6.771   1.840  -2.101  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.333   0.126   2.234  1.00  0.00           C  
HETATM   23  O   UNL     1      -4.030   1.232   3.087  1.00  0.00           O  
HETATM   24  C   UNL     1       7.116  -2.068  -1.654  1.00  0.00           C  
HETATM   25  O   UNL     1       7.362  -2.350  -3.033  1.00  0.00           O  
HETATM   26  C   UNL     1       7.859   3.616  -0.152  1.00  0.00           C  
HETATM   27  O   UNL     1      -7.890   1.690   3.030  1.00  0.00           O  
HETATM   28  C   UNL     1      -6.524   0.544  -1.939  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.112  -0.233   1.358  1.00  0.00           C  
HETATM   30  O   UNL     1      -3.671  -0.603   0.079  1.00  0.00           O  
HETATM   31  C   UNL     1       5.628  -1.733  -1.430  1.00  0.00           C  
HETATM   32  O   UNL     1       5.568  -0.407  -0.877  1.00  0.00           O  
HETATM   33  C   UNL     1       7.592   3.540   1.219  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.235  -0.389  -2.714  1.00  0.00           C  
HETATM   35  C   UNL     1      -2.349  -1.411   1.967  1.00  0.00           C  
HETATM   36  O   UNL     1      -1.162  -1.653   1.208  1.00  0.00           O  
HETATM   37  C   UNL     1       5.011  -2.734  -0.451  1.00  0.00           C  
HETATM   38  O   UNL     1       3.608  -2.487  -0.339  1.00  0.00           O  
HETATM   39  C   UNL     1       7.042   2.366   1.717  1.00  0.00           C  
HETATM   40  C   UNL     1      -8.182   0.096  -3.632  1.00  0.00           C  
HETATM   41  N   UNL     1      -8.911  -0.775  -4.422  1.00  0.00           N  
HETATM   42  C   UNL     1       6.775   1.320   0.845  1.00  0.00           C  
HETATM   43  N   UNL     1      -6.797  -1.620  -2.357  1.00  0.00           N  
HETATM   44  C   UNL     1       8.444   4.842  -0.737  1.00  0.00           C  
HETATM   45  N   UNL     1       8.724   5.898   0.053  1.00  0.00           N  
HETATM   46  O   UNL     1       8.673   4.897  -1.929  1.00  0.00           O  
HETATM   47  C   UNL     1      -5.886  -1.505  -1.435  1.00  0.00           C  
HETATM   48  O   UNL     1       6.765   2.245   3.042  1.00  0.00           O  
HETATM   49  N   UNL     1      -5.682  -0.190  -1.143  1.00  0.00           N  
HETATM   50  H   UNL     1      -1.142  -4.420   0.474  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.329   1.294  -0.502  1.00  0.00           H  
HETATM   52  H   UNL     1       6.634   0.627  -2.354  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.845   3.308  -3.080  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.282  -0.156   1.296  1.00  0.00           H  
HETATM   55  H   UNL     1       8.228  -0.871  -0.198  1.00  0.00           H  
HETATM   56  H   UNL     1       9.658  -1.135  -2.092  1.00  0.00           H  
HETATM   57  H   UNL     1       7.767   2.562  -2.019  1.00  0.00           H  
HETATM   58  H   UNL     1       2.245  -4.956  -0.833  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.371   4.238   1.818  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.648  -0.736   2.822  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.349   1.044   3.747  1.00  0.00           H  
HETATM   62  H   UNL     1       7.417  -2.912  -1.034  1.00  0.00           H  
HETATM   63  H   UNL     1       8.293  -2.511  -3.242  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.390   1.987   3.802  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.454   0.630   1.252  1.00  0.00           H  
HETATM   66  H   UNL     1       5.095  -1.763  -2.380  1.00  0.00           H  
HETATM   67  H   UNL     1       7.807   4.373   1.873  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.080  -1.177   2.997  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.979  -2.301   1.949  1.00  0.00           H  
HETATM   70  H   UNL     1       5.174  -3.747  -0.818  1.00  0.00           H  
HETATM   71  H   UNL     1       5.479  -2.622   0.527  1.00  0.00           H  
HETATM   72  H   UNL     1      -9.562  -0.428  -5.052  1.00  0.00           H  
HETATM   73  H   UNL     1      -8.772  -1.732  -4.346  1.00  0.00           H  
HETATM   74  H   UNL     1       6.344   0.406   1.226  1.00  0.00           H  
HETATM   75  H   UNL     1       8.541   5.854   1.005  1.00  0.00           H  
HETATM   76  H   UNL     1       9.108   6.702  -0.331  1.00  0.00           H  
HETATM   77  H   UNL     1      -5.368  -2.331  -0.970  1.00  0.00           H  
HETATM   78  H   UNL     1       5.873   2.530   3.285  1.00  0.00           H  
CONECT    1    2    3                                                 
CONECT    2    1    5   12   12                                       
CONECT    2   36                                                      
CONECT    3    1   19   38    9                                       
CONECT    3    9                                                      
CONECT    4   40   11   11                                            
CONECT    5    2   50                                                 
CONECT    6   30   49   51   13                                       
CONECT    7    8   16   52   32                                       
CONECT    8    7   42   18   18                                       
CONECT    9    3    3                                                 
CONECT   10   15   15                                                 
CONECT   11    4    4   53   21                                       
CONECT   12    2    2                                                 
CONECT   13    6   54   14   22                                       
CONECT   14   13   15                                                 
CONECT   15   10   10   14   27                                       
CONECT   15   20                                                      
CONECT   16    7   17   55   24                                       
CONECT   17   16   56                                                 
CONECT   18    8    8   26   57                                       
CONECT   19    3   58                                                 
CONECT   20   15   59                                                 
CONECT   21   11   28   28                                            
CONECT   22   13   29   60   23                                       
CONECT   23   22   61                                                 
CONECT   24   16   25   62   31                                       
CONECT   25   24   63                                                 
CONECT   26   18   33   33   44                                       
CONECT   27   15   64                                                 
CONECT   28   21   21   34   49                                       
CONECT   29   22   35   30   65                                       
CONECT   30    6   29                                                 
CONECT   31   24   32   66   37                                       
CONECT   32   31    7                                                 
CONECT   33   26   26   39   67                                       
CONECT   34   28   40   40   43                                       
CONECT   35   29   68   69   36                                       
CONECT   36    2   35                                                 
CONECT   37   31   38   70   71                                       
CONECT   38    3   37                                                 
CONECT   39   33   48   42   42                                       
CONECT   40    4   34   34   41                                       
CONECT   41   40   72   73                                            
CONECT   42    8   39   39   74                                       
CONECT   43   34   47   47                                            
CONECT   44   26   46   46   45                                       
CONECT   45   44   75   76                                            
CONECT   46   44   44                                                 
CONECT   47   43   43   77   49                                       
CONECT   48   39   78                                                 
CONECT   49    6   28   47                                            
CONECT   50    5                                                      
CONECT   51    6                                                      
CONECT   52    7                                                      
CONECT   53   11                                                      
CONECT   54   13                                                      
CONECT   55   16                                                      
CONECT   56   17                                                      
CONECT   57   18                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   27                                                      
CONECT   65   29                                                      
CONECT   66   31                                                      
CONECT   67   33                                                      
CONECT   68   35                                                      
CONECT   69   35                                                      
CONECT   70   37                                                      
CONECT   71   37                                                      
CONECT   72   41                                                      
CONECT   73   41                                                      
CONECT   74   42                                                      
CONECT   75   45                                                      
CONECT   76   45                                                      
CONECT   77   47                                                      
CONECT   78   48                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
