COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.462  -1.829  -0.491  1.00  0.00           O  
HETATM    2  C   UNL     1       3.685  -0.940  -0.193  1.00  0.00           C  
HETATM    3  N   UNL     1       4.136   0.290   0.134  1.00  0.00           N  
HETATM    4  C   UNL     1       3.282   1.274   0.462  1.00  0.00           C  
HETATM    5  O   UNL     1       3.729   2.367   0.750  1.00  0.00           O  
HETATM    6  N   UNL     1       1.950   1.091   0.483  1.00  0.00           N  
HETATM    7  C   UNL     1       1.401  -0.130   0.165  1.00  0.00           C  
HETATM    8  C   UNL     1       2.241  -1.179  -0.188  1.00  0.00           C  
HETATM    9  N   UNL     1       1.459  -2.251  -0.458  1.00  0.00           N  
HETATM   10  C   UNL     1       0.210  -1.918  -0.298  1.00  0.00           C  
HETATM   11  N   UNL     1       0.133  -0.614   0.096  1.00  0.00           N  
HETATM   12  C1* UNL     1      -1.095   0.133   0.380  1.00  0.00           C  
HETATM   13  O4* UNL     1      -2.194  -0.771   0.625  1.00  0.00           O  
HETATM   14  C4* UNL     1      -3.405  -0.032   0.389  1.00  0.00           C  
HETATM   15  C5* UNL     1      -4.473  -0.957  -0.199  1.00  0.00           C  
HETATM   16  O5* UNL     1      -4.848  -1.931   0.777  1.00  0.00           O  
HETATM   17  C3* UNL     1      -3.070   1.087  -0.615  1.00  0.00           C  
HETATM   18  O3* UNL     1      -3.351   2.369  -0.048  1.00  0.00           O  
HETATM   19  C2* UNL     1      -1.552   0.928  -0.869  1.00  0.00           C  
HETATM   20  O2* UNL     1      -0.908   2.202  -0.927  1.00  0.00           O  
HETATM   21  H   UNL     1       5.090   0.466   0.132  1.00  0.00           H  
HETATM   22  H   UNL     1       1.369   1.829   0.727  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.634  -2.576  -0.444  1.00  0.00           H  
HETATM   24  H1* UNL     1      -0.949   0.802   1.228  1.00  0.00           H  
HETATM   25  H4* UNL     1      -3.763   0.400   1.324  1.00  0.00           H  
HETATM   26 H5*1 UNL     1      -5.346  -0.370  -0.481  1.00  0.00           H  
HETATM   27 H5*2 UNL     1      -4.073  -1.460  -1.079  1.00  0.00           H  
HETATM   28  H5* UNL     1      -5.523  -2.553   0.472  1.00  0.00           H  
HETATM   29  H3* UNL     1      -3.631   0.950  -1.540  1.00  0.00           H  
HETATM   30  H3* UNL     1      -4.280   2.501   0.185  1.00  0.00           H  
HETATM   31  H2* UNL     1      -1.368   0.359  -1.781  1.00  0.00           H  
HETATM   32  H2* UNL     1      -1.161   2.737  -1.691  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    8    3                                       
CONECT    3    2    4   21                                            
CONECT    4    3    6    5    5                                       
CONECT    5    4    4                                                 
CONECT    6    7    4   22                                            
CONECT    7    8    8   11    6                                       
CONECT    8    9    2    7    7                                       
CONECT    9   10   10    8                                            
CONECT   10    9    9   11   23                                       
CONECT   11   10    7   12                                            
CONECT   12   11   19   13   24                                       
CONECT   13   12   14                                                 
CONECT   14   13   17   15   25                                       
CONECT   15   14   16   26   27                                       
CONECT   16   15   28                                                 
CONECT   17   19   14   18   29                                       
CONECT   18   17   30                                                 
CONECT   19   12   20   17   31                                       
CONECT   20   19   32                                                 
CONECT   21    3                                                      
CONECT   22    6                                                      
CONECT   23   10                                                      
CONECT   24   12                                                      
CONECT   25   14                                                      
CONECT   26   15                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30   18                                                      
CONECT   31   19                                                      
CONECT   32   20                                                      
MASTER        0    0    0    0    0    0    0    0   32    0   32    0
END
