COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.133   1.351  -0.632  1.00  0.00           N  
HETATM    2  N   UNL     1       6.860   2.600   1.211  1.00  0.00           N  
HETATM    3  C   UNL     1       7.131   3.652   0.412  1.00  0.00           C  
HETATM    4  C   UNL     1       6.885   3.551  -0.978  1.00  0.00           C  
HETATM    5  C   UNL     1       6.389   2.398  -1.475  1.00  0.00           C  
HETATM    6  C   UNL     1       6.366   1.462   0.688  1.00  0.00           C  
HETATM    7  O   UNL     1       6.126   0.521   1.420  1.00  0.00           O  
HETATM    8  O   UNL     1       7.578   4.682   0.884  1.00  0.00           O  
HETATM    9  P   UNL     1       0.774  -2.321   1.121  1.00  0.00           P  
HETATM   10  P   UNL     1      -2.161  -2.032   0.820  1.00  0.00           P  
HETATM   11  O   UNL     1      -4.139   3.150   3.255  1.00  0.00           O  
HETATM   12  O   UNL     1      -5.305   1.341   3.754  1.00  0.00           O  
HETATM   13  C   UNL     1      -4.477  -0.763   0.412  1.00  0.00           C  
HETATM   14  O   UNL     1       0.695  -3.799   1.143  1.00  0.00           O  
HETATM   15  O   UNL     1      -2.392  -2.157   2.277  1.00  0.00           O  
HETATM   16  C   UNL     1       5.595   0.099  -1.172  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.104  -0.035  -0.780  1.00  0.00           C  
HETATM   18  N   UNL     1      -4.752  -0.731  -2.020  1.00  0.00           N  
HETATM   19  O   UNL     1       1.018  -1.775   2.616  1.00  0.00           O  
HETATM   20  O   UNL     1      -2.566  -3.409   0.092  1.00  0.00           O  
HETATM   21  C   UNL     1       6.581  -1.063  -0.919  1.00  0.00           C  
HETATM   22  O   UNL     1       7.363  -1.318  -2.088  1.00  0.00           O  
HETATM   23  C   UNL     1      -4.572   1.401  -0.830  1.00  0.00           C  
HETATM   24  N   UNL     1      -5.225   2.128  -1.922  1.00  0.00           N  
HETATM   25  O   UNL     1      -0.605  -1.718   0.549  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.060  -0.831   0.235  1.00  0.00           O  
HETATM   27  C   UNL     1       5.667  -2.269  -0.606  1.00  0.00           C  
HETATM   28  O   UNL     1       5.858  -3.306  -1.570  1.00  0.00           O  
HETATM   29  C   UNL     1      -4.878   2.093   0.502  1.00  0.00           C  
HETATM   30  O   UNL     1      -4.323   3.410   0.494  1.00  0.00           O  
HETATM   31  C   UNL     1       4.238  -1.692  -0.705  1.00  0.00           C  
HETATM   32  O   UNL     1       4.393  -0.277  -0.465  1.00  0.00           O  
HETATM   33  C   UNL     1      -4.259   1.283   1.644  1.00  0.00           C  
HETATM   34  O   UNL     1      -4.773  -0.050   1.614  1.00  0.00           O  
HETATM   35  C   UNL     1       3.335  -2.319   0.359  1.00  0.00           C  
HETATM   36  O   UNL     1       1.994  -1.862   0.176  1.00  0.00           O  
HETATM   37  C   UNL     1      -4.606   1.926   2.962  1.00  0.00           C  
HETATM   38  C   UNL     1      -5.490  -1.779  -2.438  1.00  0.00           C  
HETATM   39  O   UNL     1      -6.445  -2.146  -1.787  1.00  0.00           O  
HETATM   40  C   UNL     1      -5.127  -2.495  -3.713  1.00  0.00           C  
HETATM   41  O   UNL     1      -3.518   3.534  -2.096  1.00  0.00           O  
HETATM   42  C   UNL     1      -4.610   3.184  -2.489  1.00  0.00           C  
HETATM   43  C   UNL     1      -5.281   3.932  -3.612  1.00  0.00           C  
HETATM   44  H   UNL     1       7.022   2.663   2.165  1.00  0.00           H  
HETATM   45  H   UNL     1       7.096   4.383  -1.633  1.00  0.00           H  
HETATM   46  H   UNL     1       6.196   2.302  -2.534  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.388   3.521   4.113  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.884  -1.771   0.477  1.00  0.00           H  
HETATM   49  H   UNL     1       5.392   0.203  -2.238  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.188  -0.018  -0.666  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.988  -0.437  -2.540  1.00  0.00           H  
HETATM   52  H   UNL     1       1.080  -0.812   2.678  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.440  -3.399  -0.866  1.00  0.00           H  
HETATM   54  H   UNL     1       7.225  -0.840  -0.069  1.00  0.00           H  
HETATM   55  H   UNL     1       8.000  -2.039  -1.985  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.495   1.385  -0.995  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.099   1.848  -2.236  1.00  0.00           H  
HETATM   58  H   UNL     1       5.859  -2.642   0.400  1.00  0.00           H  
HETATM   59  H   UNL     1       6.756  -3.662  -1.592  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.958   2.154   0.641  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.479   3.908   1.308  1.00  0.00           H  
HETATM   62  H   UNL     1       3.827  -1.866  -1.700  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.176   1.258   1.526  1.00  0.00           H  
HETATM   64  H   UNL     1       3.364  -3.405   0.266  1.00  0.00           H  
HETATM   65  H   UNL     1       3.686  -2.030   1.349  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.247  -2.026  -4.155  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.911  -3.540  -3.494  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.961  -2.435  -4.413  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.638   4.749  -3.941  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.460   3.253  -4.446  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.232   4.336  -3.263  1.00  0.00           H  
CONECT    1    5    6   16                                            
CONECT    2    3    6   44                                            
CONECT    3    8    8    4    2                                       
CONECT    4    3    5    5   45                                       
CONECT    5    4    4    1   46                                       
CONECT    6    2    1    7    7                                       
CONECT    7    6    6                                                 
CONECT    8    3    3                                                 
CONECT    9   14   14   19   25                                       
CONECT    9   36                                                      
CONECT   10   15   15   25   20                                       
CONECT   10   26                                                      
CONECT   11   37   47                                                 
CONECT   12   37   37                                                 
CONECT   13   26   17   34   48                                       
CONECT   14    9    9                                                 
CONECT   15   10   10                                                 
CONECT   16    1   21   32   49                                       
CONECT   17   18   13   23   50                                       
CONECT   18   38   17   51                                            
CONECT   19    9   52                                                 
CONECT   20   10   53                                                 
CONECT   21   22   16   27   54                                       
CONECT   22   21   55                                                 
CONECT   23   17   24   29   56                                       
CONECT   24   42   23   57                                            
CONECT   25    9   10                                                 
CONECT   26   10   13                                                 
CONECT   27   21   31   28   58                                       
CONECT   28   27   59                                                 
CONECT   29   23   33   30   60                                       
CONECT   30   29   61                                                 
CONECT   31   32   35   27   62                                       
CONECT   32   16   31                                                 
CONECT   33   34   29   37   63                                       
CONECT   34   13   33                                                 
CONECT   35   36   31   64   65                                       
CONECT   36    9   35                                                 
CONECT   37   33   12   12   11                                       
CONECT   38   40   18   39   39                                       
CONECT   39   38   38                                                 
CONECT   40   38   66   67   68                                       
CONECT   41   42   42                                                 
CONECT   42   41   41   43   24                                       
CONECT   43   42   69   70   71                                       
CONECT   44    2                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47   11                                                      
CONECT   48   13                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   24                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   33                                                      
CONECT   64   35                                                      
CONECT   65   35                                                      
CONECT   66   40                                                      
CONECT   67   40                                                      
CONECT   68   40                                                      
CONECT   69   43                                                      
CONECT   70   43                                                      
CONECT   71   43                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
