COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.872  -0.822   0.115  1.00  0.00           O  
HETATM    2  C   UNL     1       3.174   0.136  -0.119  1.00  0.00           C  
HETATM    3  N   UNL     1       1.472  -1.442  -0.840  1.00  0.00           N  
HETATM    4  OXT UNL     1       3.704   1.369  -0.115  1.00  0.00           O  
HETATM    5  CA  UNL     1       1.710  -0.054  -0.421  1.00  0.00           C  
HETATM    6  C   UNL     1       0.887   0.248   0.834  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.581   0.178   0.501  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.276   0.049  -0.110  1.00  0.00           C  
HETATM    9  N   UNL     1      -4.637  -0.016  -0.419  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.245   1.311   0.067  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.260  -1.020   0.624  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.590   1.250  -0.239  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.605  -1.088   0.319  1.00  0.00           C  
HETATM   14  H1  UNL     1       1.740  -2.089  -0.114  1.00  0.00           H  
HETATM   15  H2  UNL     1       0.510  -1.578  -1.110  1.00  0.00           H  
HETATM   16  HXT UNL     1       4.648   1.441   0.080  1.00  0.00           H  
HETATM   17  HA  UNL     1       1.413   0.623  -1.221  1.00  0.00           H  
HETATM   18  H   UNL     1       1.120  -0.485   1.606  1.00  0.00           H  
HETATM   19  H   UNL     1       1.130   1.247   1.196  1.00  0.00           H  
HETATM   20  H   UNL     1      -5.114  -0.856  -0.333  1.00  0.00           H  
HETATM   21  H   UNL     1      -5.105   0.780  -0.719  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.710   2.244  -0.033  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.737  -1.904   0.959  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.108   2.135  -0.578  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.136  -2.023   0.420  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    5    4                                       
CONECT    3    5   14   15                                            
CONECT    4    2   16                                                 
CONECT    5    2    3    6   17                                       
CONECT    6    5    7   18   19                                       
CONECT    7    6   10   10   11                                       
CONECT    8   12   12   13    9                                       
CONECT    9    8   20   21                                            
CONECT   10    7    7   12   22                                       
CONECT   11    7   13   13   23                                       
CONECT   12    8    8   10   24                                       
CONECT   13    8   11   11   25                                       
CONECT   14    3                                                      
CONECT   15    3                                                      
CONECT   16    4                                                      
CONECT   17    5                                                      
CONECT   18    6                                                      
CONECT   19    6                                                      
CONECT   20    9                                                      
CONECT   21    9                                                      
CONECT   22   10                                                      
CONECT   23   11                                                      
CONECT   24   12                                                      
CONECT   25   13                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
