COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O5* UNL     1      -5.004   1.235  -1.416  1.00  0.00           O  
HETATM    2  C5* UNL     1      -4.562   0.785  -0.133  1.00  0.00           C  
HETATM    3  C4* UNL     1      -3.427  -0.226  -0.311  1.00  0.00           C  
HETATM    4  O4* UNL     1      -2.224   0.429  -0.775  1.00  0.00           O  
HETATM    5  C1* UNL     1      -1.124  -0.431  -0.435  1.00  0.00           C  
HETATM    6  N   UNL     1       0.052   0.375  -0.098  1.00  0.00           N  
HETATM    7  C   UNL     1       1.361  -0.033  -0.160  1.00  0.00           C  
HETATM    8  N   UNL     1       1.977  -1.160  -0.501  1.00  0.00           N  
HETATM    9  C   UNL     1       3.292  -1.247  -0.454  1.00  0.00           C  
HETATM   10  F   UNL     1       3.880  -2.411  -0.809  1.00  0.00           F  
HETATM   11  N   UNL     1       4.056  -0.237  -0.073  1.00  0.00           N  
HETATM   12  C   UNL     1       3.527   0.928   0.286  1.00  0.00           C  
HETATM   13  N   UNL     1       4.335   1.979   0.684  1.00  0.00           N  
HETATM   14  C   UNL     1       2.129   1.067   0.258  1.00  0.00           C  
HETATM   15  N   UNL     1       1.267   2.073   0.539  1.00  0.00           N  
HETATM   16  C   UNL     1       0.047   1.669   0.334  1.00  0.00           C  
HETATM   17  C2* UNL     1      -1.552  -1.268   0.786  1.00  0.00           C  
HETATM   18  C3* UNL     1      -3.011  -0.826   1.056  1.00  0.00           C  
HETATM   19  O3* UNL     1      -3.830  -1.948   1.392  1.00  0.00           O  
HETATM   20  H5* UNL     1      -5.717   1.868  -1.259  1.00  0.00           H  
HETATM   21 H5*1 UNL     1      -5.391   0.311   0.392  1.00  0.00           H  
HETATM   22 H5*2 UNL     1      -4.203   1.635   0.446  1.00  0.00           H  
HETATM   23  H4* UNL     1      -3.723  -1.016  -1.003  1.00  0.00           H  
HETATM   24  H1* UNL     1      -0.894  -1.089  -1.273  1.00  0.00           H  
HETATM   25  H   UNL     1       5.298   1.869   0.703  1.00  0.00           H  
HETATM   26  H   UNL     1       3.938   2.826   0.940  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.838   2.268   0.483  1.00  0.00           H  
HETATM   28 H2*1 UNL     1      -1.513  -2.332   0.552  1.00  0.00           H  
HETATM   29 H2*2 UNL     1      -0.920  -1.042   1.644  1.00  0.00           H  
HETATM   30  H3* UNL     1      -3.049  -0.070   1.840  1.00  0.00           H  
HETATM   31  H3* UNL     1      -3.463  -2.329   2.201  1.00  0.00           H  
CONECT    1    2   20                                                 
CONECT    2    1    3   21   22                                       
CONECT    3    2    4   18   23                                       
CONECT    4    3    5                                                 
CONECT    5    4    6   17   24                                       
CONECT    6    5    7   16                                            
CONECT    7    6    8    8   14                                       
CONECT    8    7    7    9                                            
CONECT    9    8   10   11   11                                       
CONECT   10    9                                                      
CONECT   11    9    9   12                                            
CONECT   12   11   13   14   14                                       
CONECT   13   12   25   26                                            
CONECT   14    7   12   12   15                                       
CONECT   15   14   16   16                                            
CONECT   16    6   15   15   27                                       
CONECT   17    5   18   28   29                                       
CONECT   18    3   17   19   30                                       
CONECT   19   18   31                                                 
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    5                                                      
CONECT   25   13                                                      
CONECT   26   13                                                      
CONECT   27   16                                                      
CONECT   28   17                                                      
CONECT   29   17                                                      
CONECT   30   18                                                      
CONECT   31   19                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
