COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.278   0.484   0.089  1.00  0.00           O  
HETATM    2  C   UNL     1       0.596  -0.512  -0.676  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.459  -1.193   0.197  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.505  -0.262   0.550  1.00  0.00           O  
HETATM    5  C   UNL     1      -1.207  -2.289  -0.604  1.00  0.00           C  
HETATM    6  O   UNL     1      -0.502  -3.531  -0.550  1.00  0.00           O  
HETATM    7  C   UNL     1      -2.553  -2.384   0.153  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.659  -1.042   0.904  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.996   0.526   1.038  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.873  -0.122   1.413  1.00  0.00           C  
HETATM   11  N   UNL     1      -3.879  -0.339   0.498  1.00  0.00           N  
HETATM   12  C   UNL     1      -4.011   0.088  -0.771  1.00  0.00           C  
HETATM   13  N   UNL     1      -5.120   0.737  -1.171  1.00  0.00           N  
HETATM   14  C   UNL     1      -6.124   0.966  -0.301  1.00  0.00           C  
HETATM   15  P   UNL     1       2.456   1.400  -0.515  1.00  0.00           P  
HETATM   16  O   UNL     1       2.012   1.994  -1.795  1.00  0.00           O  
HETATM   17  C   UNL     1      -7.102   0.774   2.032  1.00  0.00           C  
HETATM   18  O   UNL     1      -7.131   1.548  -0.664  1.00  0.00           O  
HETATM   19  O   UNL     1      -3.115  -0.116  -1.568  1.00  0.00           O  
HETATM   20  N   UNL     1       3.822   0.454  -0.779  1.00  0.00           N  
HETATM   21  C   UNL     1       4.293  -0.154   0.473  1.00  0.00           C  
HETATM   22  N   UNL     1       5.063  -1.376   0.177  1.00  0.00           N  
HETATM   23  N   UNL     1       5.188   0.788   1.181  1.00  0.00           N  
HETATM   24  C   UNL     1       6.228  -0.078   1.799  1.00  0.00           C  
HETATM   25  C   UNL     1       5.789   1.747   0.245  1.00  0.00           C  
HETATM   26  C   UNL     1       5.103  -1.636  -1.269  1.00  0.00           C  
HETATM   27  C   UNL     1       6.427  -1.171   0.717  1.00  0.00           C  
HETATM   28  H   UNL     1       0.112  -0.043  -1.533  1.00  0.00           H  
HETATM   29  H   UNL     1       1.313  -1.255  -1.026  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.001  -1.614   1.092  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.362  -1.977  -1.637  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.930  -4.248  -1.037  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.379  -2.494  -0.549  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.537  -3.215   0.858  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.674  -1.219   1.979  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.759  -0.467   2.430  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.199   1.038  -2.090  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.919   1.303   1.542  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.465  -0.179   2.417  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.721   1.377   2.856  1.00  0.00           H  
HETATM   41  H   UNL     1       3.440  -0.399   1.107  1.00  0.00           H  
HETATM   42  H   UNL     1       7.150   0.479   1.962  1.00  0.00           H  
HETATM   43  H   UNL     1       5.866  -0.515   2.730  1.00  0.00           H  
HETATM   44  H   UNL     1       5.012   2.392  -0.164  1.00  0.00           H  
HETATM   45  H   UNL     1       6.527   2.354   0.770  1.00  0.00           H  
HETATM   46  H   UNL     1       6.276   1.206  -0.567  1.00  0.00           H  
HETATM   47  H   UNL     1       5.575  -0.794  -1.776  1.00  0.00           H  
HETATM   48  H   UNL     1       5.677  -2.542  -1.459  1.00  0.00           H  
HETATM   49  H   UNL     1       4.088  -1.763  -1.643  1.00  0.00           H  
HETATM   50  H   UNL     1       6.805  -2.090   1.165  1.00  0.00           H  
HETATM   51  H   UNL     1       7.101  -0.818  -0.064  1.00  0.00           H  
HETATM   52  O   UNL     1       2.810   2.575   0.528  1.00  0.00           O  
HETATM   53  H   UNL     1       3.109   2.258   1.391  1.00  0.00           H  
HETATM   54  H   UNL     1       4.555   0.991  -1.218  1.00  0.00           H  
CONECT    1    2   15                                                 
CONECT    2    3    1   28   29                                       
CONECT    3    5    4    2   30                                       
CONECT    4    8    3                                                 
CONECT    5    6    7    3   31                                       
CONECT    6    5   32                                                 
CONECT    7    5    8   33   34                                       
CONECT    8    7   11    4   35                                       
CONECT    9   10   10   17   14                                       
CONECT   10   11    9    9   36                                       
CONECT   11    8   10   12                                            
CONECT   12   11   19   19   13                                       
CONECT   13   12   14   37                                            
CONECT   14    9   13   18   18                                       
CONECT   15    1   20   16   16                                       
CONECT   15   52                                                      
CONECT   16   15   15                                                 
CONECT   17    9   38   39   40                                       
CONECT   18   14   14                                                 
CONECT   19   12   12                                                 
CONECT   20   21   15   54                                            
CONECT   21   23   22   20   41                                       
CONECT   22   27   21   26                                            
CONECT   23   24   25   21                                            
CONECT   24   27   23   42   43                                       
CONECT   25   23   44   45   46                                       
CONECT   26   22   47   48   49                                       
CONECT   27   24   22   50   51                                       
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   13                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   21                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   15   53                                                 
CONECT   53   52                                                      
CONECT   54   20                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
