COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.861   0.676  -0.004  1.00  0.00           N  
HETATM    2  C   UNL     1       6.226   1.677   0.668  1.00  0.00           C  
HETATM    3  N   UNL     1       7.025   2.695   0.808  1.00  0.00           N  
HETATM    4  C   UNL     1       8.222   2.410   0.241  1.00  0.00           C  
HETATM    5  C   UNL     1       9.431   3.108   0.081  1.00  0.00           C  
HETATM    6  N   UNL     1       9.579   4.391   0.580  1.00  0.00           N  
HETATM    7  N   UNL     1      10.430   2.506  -0.556  1.00  0.00           N  
HETATM    8  C   UNL     1      10.297   1.283  -1.036  1.00  0.00           C  
HETATM    9  N   UNL     1       9.182   0.594  -0.914  1.00  0.00           N  
HETATM   10  C   UNL     1       8.129   1.113  -0.292  1.00  0.00           C  
HETATM   11  O   UNL     1       2.093  -1.431  -0.722  1.00  0.00           O  
HETATM   12  C   UNL     1       2.961  -1.967   0.278  1.00  0.00           C  
HETATM   13  C   UNL     1       4.405  -1.928  -0.226  1.00  0.00           C  
HETATM   14  O   UNL     1       4.851  -0.561  -0.369  1.00  0.00           O  
HETATM   15  C   UNL     1       5.359  -2.546   0.820  1.00  0.00           C  
HETATM   16  O   UNL     1       5.657  -3.903   0.485  1.00  0.00           O  
HETATM   17  C   UNL     1       6.632  -1.673   0.731  1.00  0.00           C  
HETATM   18  O   UNL     1       7.756  -2.464   0.341  1.00  0.00           O  
HETATM   19  C   UNL     1       6.293  -0.628  -0.355  1.00  0.00           C  
HETATM   20  P   UNL     1       0.598  -1.502  -0.128  1.00  0.00           P  
HETATM   21  O   UNL     1       0.552  -0.805   1.176  1.00  0.00           O  
HETATM   22  O   UNL     1       0.173  -3.042   0.071  1.00  0.00           O  
HETATM   23  O   UNL     1      -0.421  -0.792  -1.153  1.00  0.00           O  
HETATM   24  P   UNL     1      -1.743  -0.420  -0.312  1.00  0.00           P  
HETATM   25  O   UNL     1      -2.059  -1.524   0.623  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.485   0.932   0.522  1.00  0.00           O  
HETATM   27  O   UNL     1      -2.978  -0.201  -1.321  1.00  0.00           O  
HETATM   28  P   UNL     1      -4.318  -0.232  -0.430  1.00  0.00           P  
HETATM   29  O   UNL     1      -4.121   0.588   0.786  1.00  0.00           O  
HETATM   30  O   UNL     1      -4.646  -1.751  -0.006  1.00  0.00           O  
HETATM   31  O   UNL     1      -5.545   0.363  -1.286  1.00  0.00           O  
HETATM   32  P   UNL     1      -6.680   0.799  -0.231  1.00  0.00           P  
HETATM   33  O   UNL     1      -6.766  -0.211   0.847  1.00  0.00           O  
HETATM   34  O   UNL     1      -6.301   2.230   0.403  1.00  0.00           O  
HETATM   35  O   UNL     1      -8.100   0.904  -0.983  1.00  0.00           O  
HETATM   36  P   UNL     1      -9.231   0.945   0.162  1.00  0.00           P  
HETATM   37  O   UNL     1      -8.818   1.882   1.231  1.00  0.00           O  
HETATM   38  O   UNL     1     -10.624   1.439  -0.476  1.00  0.00           O  
HETATM   39  O   UNL     1      -9.418  -0.529   0.784  1.00  0.00           O  
HETATM   40  H   UNL     1       5.210   1.633   1.031  1.00  0.00           H  
HETATM   41  H   UNL     1      10.420   4.861   0.466  1.00  0.00           H  
HETATM   42  H   UNL     1       8.841   4.821   1.039  1.00  0.00           H  
HETATM   43  H   UNL     1      11.135   0.832  -1.547  1.00  0.00           H  
HETATM   44  H   UNL     1       2.678  -2.998   0.490  1.00  0.00           H  
HETATM   45  H   UNL     1       2.877  -1.373   1.188  1.00  0.00           H  
HETATM   46  H   UNL     1       4.489  -2.456  -1.176  1.00  0.00           H  
HETATM   47  H   UNL     1       4.922  -2.487   1.817  1.00  0.00           H  
HETATM   48  H   UNL     1       6.254  -4.235   1.170  1.00  0.00           H  
HETATM   49  H   UNL     1       6.825  -1.181   1.685  1.00  0.00           H  
HETATM   50  H   UNL     1       7.879  -3.133   1.028  1.00  0.00           H  
HETATM   51  H   UNL     1       6.667  -0.955  -1.326  1.00  0.00           H  
HETATM   52  H   UNL     1       0.216  -3.459  -0.801  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.283   1.624  -0.122  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.767  -2.250  -0.826  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.255   2.857  -0.331  1.00  0.00           H  
HETATM   56  H   UNL     1     -11.272   1.449   0.241  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.687  -1.107   0.056  1.00  0.00           H  
CONECT    1    2   10   19                                            
CONECT    2    1    3    3   40                                       
CONECT    3    2    2    4                                            
CONECT    4    3    5   10   10                                       
CONECT    5    4    6    7    7                                       
CONECT    6    5   41   42                                            
CONECT    7    5    5    8                                            
CONECT    8    7    9    9   43                                       
CONECT    9    8    8   10                                            
CONECT   10    1    4    4    9                                       
CONECT   11   12   20                                                 
CONECT   12   11   13   44   45                                       
CONECT   13   12   14   15   46                                       
CONECT   14   13   19                                                 
CONECT   15   13   16   17   47                                       
CONECT   16   15   48                                                 
CONECT   17   15   18   19   49                                       
CONECT   18   17   50                                                 
CONECT   19    1   14   17   51                                       
CONECT   20   11   21   21   22                                       
CONECT   20   23                                                      
CONECT   21   20   20                                                 
CONECT   22   20   52                                                 
CONECT   23   20   24                                                 
CONECT   24   23   25   25   26                                       
CONECT   24   27                                                      
CONECT   25   24   24                                                 
CONECT   26   24   53                                                 
CONECT   27   24   28                                                 
CONECT   28   27   29   29   30                                       
CONECT   28   31                                                      
CONECT   29   28   28                                                 
CONECT   30   28   54                                                 
CONECT   31   28   32                                                 
CONECT   32   31   33   33   34                                       
CONECT   32   35                                                      
CONECT   33   32   32                                                 
CONECT   34   32   55                                                 
CONECT   35   32   36                                                 
CONECT   36   35   37   37   38                                       
CONECT   36   39                                                      
CONECT   37   36   36                                                 
CONECT   38   36   56                                                 
CONECT   39   36   57                                                 
CONECT   40    2                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    8                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   22                                                      
CONECT   53   26                                                      
CONECT   54   30                                                      
CONECT   55   34                                                      
CONECT   56   38                                                      
CONECT   57   39                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
