COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.504  -1.821  -1.519  1.00  0.00           O  
HETATM    2  P   UNL     1       5.136  -0.897  -0.253  1.00  0.00           P  
HETATM    3  O   UNL     1       4.940  -1.750   0.941  1.00  0.00           O  
HETATM    4  O   UNL     1       6.336   0.141   0.021  1.00  0.00           O  
HETATM    5  O   UNL     1       3.781  -0.083  -0.558  1.00  0.00           O  
HETATM    6  C   UNL     1       3.135   0.746   0.410  1.00  0.00           C  
HETATM    7  C   UNL     1       1.881   1.368  -0.206  1.00  0.00           C  
HETATM    8  O   UNL     1       0.913   0.342  -0.484  1.00  0.00           O  
HETATM    9  C   UNL     1       1.236   2.347   0.795  1.00  0.00           C  
HETATM   10  O   UNL     1       1.188   3.665   0.244  1.00  0.00           O  
HETATM   11  C   UNL     1      -0.195   1.792   1.000  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.151   2.853   1.044  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.391   0.923  -0.269  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.389  -0.122  -0.028  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.143  -1.381   0.438  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.259  -2.043   0.531  1.00  0.00           N1+
HETATM   17  C   UNL     1      -2.387  -3.427   0.995  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.284  -1.252   0.132  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.683  -1.432   0.025  1.00  0.00           C  
HETATM   20  O   UNL     1      -5.202  -2.492   0.329  1.00  0.00           O  
HETATM   21  N   UNL     1      -5.431  -0.399  -0.423  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.840   0.783  -0.761  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.624   1.814  -1.212  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.542   0.962  -0.665  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.739  -0.013  -0.225  1.00  0.00           C  
HETATM   26  H   UNL     1       6.312  -2.341  -1.405  1.00  0.00           H  
HETATM   27  H   UNL     1       6.520   0.734  -0.721  1.00  0.00           H  
HETATM   28  H   UNL     1       2.856   0.144   1.275  1.00  0.00           H  
HETATM   29  H   UNL     1       3.817   1.537   0.724  1.00  0.00           H  
HETATM   30  H   UNL     1       2.140   1.892  -1.125  1.00  0.00           H  
HETATM   31  H   UNL     1       1.786   2.347   1.736  1.00  0.00           H  
HETATM   32  H   UNL     1       0.791   4.322   0.832  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.250   1.183   1.902  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.014   3.476   1.771  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.680   1.543  -1.117  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.167  -1.770   0.691  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.536  -3.435   2.075  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.241  -3.896   0.507  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.480  -3.978   0.749  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.392  -0.498  -0.506  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.584   1.697  -1.288  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.219   2.661  -1.456  1.00  0.00           H  
CONECT    1    2   26                                                 
CONECT    2    1    3    3    4                                       
CONECT    2    5                                                      
CONECT    3    2    2                                                 
CONECT    4    2   27                                                 
CONECT    5    2    6                                                 
CONECT    6    5    7   28   29                                       
CONECT    7    6    8    9   30                                       
CONECT    8    7   13                                                 
CONECT    9    7   10   11   31                                       
CONECT   10    9   32                                                 
CONECT   11    9   12   13   33                                       
CONECT   12   11   34                                                 
CONECT   13    8   11   14   35                                       
CONECT   14   13   15   25                                            
CONECT   15   14   16   16   36                                       
CONECT   16   15   15   17   18                                       
CONECT   17   16   37   38   39                                       
CONECT   18   16   19   25   25                                       
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   40                                            
CONECT   22   21   23   24   24                                       
CONECT   23   22   41   42                                            
CONECT   24   22   22   25                                            
CONECT   25   14   18   18   24                                       
CONECT   26    1                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   15                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   21                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
