COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -8.697  -3.460   0.620  1.00  0.00           N1+
HETATM    2  O   UNL     1      -0.435   4.636  -0.990  1.00  0.00           O  
HETATM    3  P   UNL     1      -0.665   3.411  -0.077  1.00  0.00           P  
HETATM    4  C   UNL     1      -8.403  -3.143  -0.645  1.00  0.00           C  
HETATM    5  O   UNL     1       0.734   2.653   0.168  1.00  0.00           O  
HETATM    6  P   UNL     1       2.224   3.146   0.529  1.00  0.00           P  
HETATM    7  N   UNL     1      -7.503  -2.241  -0.953  1.00  0.00           N  
HETATM    8  O   UNL     1      -1.241   3.879   1.277  1.00  0.00           O1-
HETATM    9  C   UNL     1      -5.558  -0.350   1.298  1.00  0.00           C  
HETATM   10  O   UNL     1       3.099   1.889   1.025  1.00  0.00           O  
HETATM   11  C   UNL     1      -7.095  -1.879   1.341  1.00  0.00           C  
HETATM   12  O   UNL     1       2.879   3.766  -0.725  1.00  0.00           O1-
HETATM   13  C   UNL     1      -8.068  -2.853   1.632  1.00  0.00           C  
HETATM   14  N   UNL     1      -8.556  -3.362   2.806  1.00  0.00           N  
HETATM   15  O   UNL     1       2.159   4.204   1.653  1.00  0.00           O  
HETATM   16  N   UNL     1      -6.286  -1.089   2.085  1.00  0.00           N  
HETATM   17  C   UNL     1      -6.831  -1.591  -0.007  1.00  0.00           C  
HETATM   18  C   UNL     1      -9.505  -4.301   2.478  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.857  -0.622  -0.003  1.00  0.00           N  
HETATM   20  C   UNL     1       7.283  -0.084   1.622  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.251   0.003  -1.181  1.00  0.00           C  
HETATM   22  C   UNL     1      -9.579  -4.355   1.143  1.00  0.00           C  
HETATM   23  N   UNL     1       6.788  -1.505  -0.349  1.00  0.00           N1+
HETATM   24  C   UNL     1       7.315  -2.710  -0.413  1.00  0.00           C  
HETATM   25  C   UNL     1       7.820  -3.201  -1.618  1.00  0.00           C  
HETATM   26  C   UNL     1       7.756  -2.391  -2.758  1.00  0.00           C  
HETATM   27  C   UNL     1       7.192  -1.133  -2.638  1.00  0.00           C  
HETATM   28  C   UNL     1       6.714  -0.720  -1.407  1.00  0.00           C  
HETATM   29  C   UNL     1       8.412  -4.553  -1.689  1.00  0.00           C  
HETATM   30  N   UNL     1       8.896  -5.016  -2.859  1.00  0.00           N  
HETATM   31  O   UNL     1       8.463  -5.248  -0.693  1.00  0.00           O  
HETATM   32  C   UNL     1      -6.118   1.190  -1.675  1.00  0.00           C  
HETATM   33  O   UNL     1      -3.994   0.624  -0.838  1.00  0.00           O  
HETATM   34  C   UNL     1      -5.080   2.059  -2.425  1.00  0.00           C  
HETATM   35  O   UNL     1      -5.135   1.804  -3.830  1.00  0.00           O  
HETATM   36  C   UNL     1      -3.723   1.611  -1.848  1.00  0.00           C  
HETATM   37  O   UNL     1      -7.142   0.738  -2.563  1.00  0.00           O  
HETATM   38  C   UNL     1      -3.001   2.807  -1.226  1.00  0.00           C  
HETATM   39  O   UNL     1      -1.704   2.403  -0.783  1.00  0.00           O  
HETATM   40  C   UNL     1       4.435   2.016   1.517  1.00  0.00           C  
HETATM   41  O   UNL     1       5.111  -0.179   0.724  1.00  0.00           O  
HETATM   42  C   UNL     1       4.971   0.635   1.900  1.00  0.00           C  
HETATM   43  O   UNL     1       6.369   0.259   3.866  1.00  0.00           O  
HETATM   44  C   UNL     1       6.370   0.773   2.532  1.00  0.00           C  
HETATM   45  O   UNL     1       8.220  -0.832   2.399  1.00  0.00           O  
HETATM   46  C   UNL     1       6.263  -1.025   0.932  1.00  0.00           C  
HETATM   47  H   UNL     1      -8.927  -3.649  -1.442  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.825   0.372   1.627  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.283  -3.108   3.701  1.00  0.00           H  
HETATM   50  H   UNL     1     -10.084  -4.891   3.173  1.00  0.00           H  
HETATM   51  H   UNL     1       7.797   0.538   0.889  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.115  -0.730  -1.976  1.00  0.00           H  
HETATM   53  H   UNL     1     -10.231  -5.001   0.574  1.00  0.00           H  
HETATM   54  H   UNL     1       7.358  -3.323   0.475  1.00  0.00           H  
HETATM   55  H   UNL     1       8.137  -2.739  -3.707  1.00  0.00           H  
HETATM   56  H   UNL     1       7.126  -0.480  -3.495  1.00  0.00           H  
HETATM   57  H   UNL     1       6.273   0.262  -1.310  1.00  0.00           H  
HETATM   58  H   UNL     1       8.856  -4.462  -3.654  1.00  0.00           H  
HETATM   59  H   UNL     1       9.285  -5.904  -2.906  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.547   1.735  -0.834  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.251   3.117  -2.224  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.988   2.013  -4.235  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.111   1.174  -2.637  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.711   1.445  -2.899  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.901   3.598  -1.970  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.576   3.178  -0.377  1.00  0.00           H  
HETATM   67  H   UNL     1       5.068   2.449   0.743  1.00  0.00           H  
HETATM   68  H   UNL     1       4.439   2.663   2.394  1.00  0.00           H  
HETATM   69  H   UNL     1       4.290   0.155   2.603  1.00  0.00           H  
HETATM   70  H   UNL     1       7.238   0.268   4.291  1.00  0.00           H  
HETATM   71  H   UNL     1       6.692   1.814   2.523  1.00  0.00           H  
HETATM   72  H   UNL     1       8.823  -0.285   2.921  1.00  0.00           H  
HETATM   73  H   UNL     1       6.013  -1.864   1.581  1.00  0.00           H  
CONECT    1    4    4   13   22                                       
CONECT    2    3    3                                                 
CONECT    3    2    2    5    8                                       
CONECT    3   39                                                      
CONECT    4    1    1    7   47                                       
CONECT    5    3    6                                                 
CONECT    6    5   10   12   15                                       
CONECT    6   15                                                      
CONECT    7    4   17   17                                            
CONECT    8    3                                                      
CONECT    9   16   16   19   48                                       
CONECT   10    6   40                                                 
CONECT   11   13   13   16   17                                       
CONECT   12    6                                                      
CONECT   13    1   11   11   14                                       
CONECT   14   13   18   49                                            
CONECT   15    6    6                                                 
CONECT   16    9    9   11                                            
CONECT   17    7    7   11   19                                       
CONECT   18   14   22   22   50                                       
CONECT   19    9   17   21                                            
CONECT   20   44   45   46   51                                       
CONECT   21   19   32   33   52                                       
CONECT   22    1   18   18   53                                       
CONECT   23   24   24   28   46                                       
CONECT   24   23   23   25   54                                       
CONECT   25   24   26   26   29                                       
CONECT   26   25   25   27   55                                       
CONECT   27   26   28   28   56                                       
CONECT   28   23   27   27   57                                       
CONECT   29   25   30   31   31                                       
CONECT   30   29   58   59                                            
CONECT   31   29   29                                                 
CONECT   32   21   34   37   60                                       
CONECT   33   21   36                                                 
CONECT   34   32   35   36   61                                       
CONECT   35   34   62                                                 
CONECT   36   33   34   38   63                                       
CONECT   37   32   64                                                 
CONECT   38   36   39   65   66                                       
CONECT   39    3   38                                                 
CONECT   40   10   42   67   68                                       
CONECT   41   42   46                                                 
CONECT   42   40   41   44   69                                       
CONECT   43   44   70                                                 
CONECT   44   20   42   43   71                                       
CONECT   45   20   72                                                 
CONECT   46   20   23   41   73                                       
CONECT   47    4                                                      
CONECT   48    9                                                      
CONECT   49   14                                                      
CONECT   50   18                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   24                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   32                                                      
CONECT   61   34                                                      
CONECT   62   35                                                      
CONECT   63   36                                                      
CONECT   64   37                                                      
CONECT   65   38                                                      
CONECT   66   38                                                      
CONECT   67   40                                                      
CONECT   68   40                                                      
CONECT   69   42                                                      
CONECT   70   43                                                      
CONECT   71   44                                                      
CONECT   72   45                                                      
CONECT   73   46                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
