COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       2.787   0.324  -4.407  1.00  0.00           P  
HETATM    2  O   UNL     1       1.198   0.588  -4.548  1.00  0.00           O  
HETATM    3  O   UNL     1       3.659   1.172  -5.286  1.00  0.00           O  
HETATM    4  O   UNL     1       3.063   0.476  -2.819  1.00  0.00           O  
HETATM    5  N   UNL     1       0.452   2.524   0.177  1.00  0.00           N  
HETATM    6  C   UNL     1       0.309   2.663  -1.199  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.300   3.336   1.055  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.225   3.269   2.283  1.00  0.00           O  
HETATM    9  N   UNL     1      -1.159   4.248   0.431  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.338   4.427  -0.932  1.00  0.00           C  
HETATM   11  O   UNL     1      -2.112   5.251  -1.413  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.514   3.537  -1.792  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.651   3.669  -3.275  1.00  0.00           C  
HETATM   14  C   UNL     1       0.748   0.163   0.786  1.00  0.00           C  
HETATM   15  C   UNL     1       2.282  -0.292  -1.921  1.00  0.00           C  
HETATM   16  C   UNL     1       2.725   0.023  -0.498  1.00  0.00           C  
HETATM   17  O   UNL     1       2.470   1.422  -0.246  1.00  0.00           O  
HETATM   18  C   UNL     1       1.373   1.543   0.675  1.00  0.00           C  
HETATM   19  C   UNL     1       1.940  -0.742   0.560  1.00  0.00           C  
HETATM   20  O   UNL     1       2.742  -0.809   1.739  1.00  0.00           O  
HETATM   21  O   UNL     1       0.137  -0.058   2.041  1.00  0.00           O  
HETATM   22  C   UNL     1      -0.332  -1.396   2.174  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.980  -1.603   3.526  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.077  -0.708   4.360  1.00  0.00           O  
HETATM   25  N   UNL     1      -1.433  -2.904   3.682  1.00  0.00           N  
HETATM   26  C   UNL     1      -2.091  -3.371   4.881  1.00  0.00           C  
HETATM   27  O   UNL     1       2.921  -1.270  -4.647  1.00  0.00           O  
HETATM   28  H   UNL     1       0.799   0.616  -5.443  1.00  0.00           H  
HETATM   29  H   UNL     1       0.928   1.995  -1.790  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.709   4.843   1.045  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.057   2.748  -3.690  1.00  0.00           H  
HETATM   32  H   UNL     1       0.324   3.866  -3.719  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.320   4.497  -3.510  1.00  0.00           H  
HETATM   34  H   UNL     1       0.000   0.004   0.000  1.00  0.00           H  
HETATM   35  H   UNL     1       1.229  -0.035  -2.051  1.00  0.00           H  
HETATM   36  H   UNL     1       2.428  -1.352  -2.133  1.00  0.00           H  
HETATM   37  H   UNL     1       3.804  -0.139  -0.410  1.00  0.00           H  
HETATM   38  H   UNL     1       1.754   1.910   1.633  1.00  0.00           H  
HETATM   39  H   UNL     1       1.675  -1.764   0.277  1.00  0.00           H  
HETATM   40  H   UNL     1       3.447  -0.153   1.628  1.00  0.00           H  
HETATM   41  H   UNL     1       0.521  -2.074   2.075  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.050  -1.607   1.376  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.295  -3.560   2.919  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.796  -4.170   4.635  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.637  -2.552   5.356  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.354  -3.758   5.590  1.00  0.00           H  
HETATM   47  H   UNL     1       2.886  -1.617  -5.563  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    1   27                                                      
CONECT    2    1   28                                                 
CONECT    3    1    1                                                 
CONECT    4    1   15                                                 
CONECT    5    6    7   18                                            
CONECT    6    5   12   12   29                                       
CONECT    7    5    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   30                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12    6    6   10   13                                       
CONECT   13   12   31   32   33                                       
CONECT   14   18   19   21   34                                       
CONECT   15    4   16   35   36                                       
CONECT   16   15   17   19   37                                       
CONECT   17   16   18                                                 
CONECT   18    5   14   17   38                                       
CONECT   19   14   16   20   39                                       
CONECT   20   19   40                                                 
CONECT   21   14   22                                                 
CONECT   22   21   23   41   42                                       
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   43                                            
CONECT   26   25   44   45   46                                       
CONECT   27    1   47                                                 
CONECT   28    2                                                      
CONECT   29    6                                                      
CONECT   30    9                                                      
CONECT   31   13                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   22                                                      
CONECT   43   25                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
