COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.140   1.816  -0.282  1.00  0.00           N  
HETATM    2  CA  UNL     1       2.001   0.523   0.401  1.00  0.00           C  
HETATM    3  C   UNL     1       0.679  -0.130  -0.006  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.488   0.722   0.499  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.790   0.079   0.098  1.00  0.00           C  
HETATM    6  O   UNL     1       3.776  -0.151  -0.994  1.00  0.00           O  
HETATM    7  O   UNL     1      -1.786  -0.954  -0.528  1.00  0.00           O  
HETATM    8  C   UNL     1      -3.098   0.726   0.477  1.00  0.00           C  
HETATM    9  H1  UNL     1       2.974   2.297   0.020  1.00  0.00           H  
HETATM   10  HA  UNL     1       2.012   0.679   1.480  1.00  0.00           H  
HETATM   11  H   UNL     1       0.630  -0.205  -1.092  1.00  0.00           H  
HETATM   12  H   UNL     1       0.616  -1.127   0.430  1.00  0.00           H  
HETATM   13  H   UNL     1      -0.439   0.797   1.585  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.425   1.719   0.063  1.00  0.00           H  
HETATM   15  N   UNL     1      -4.181  -0.068  -0.014  1.00  0.00           N1+
HETATM   16  N   UNL     1      -4.965  -0.642  -0.368  1.00  0.00           N  
HETATM   17  H   UNL     1      -3.164   0.801   1.562  1.00  0.00           H  
HETATM   18  H2  UNL     1       2.133   1.698  -1.284  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.150   1.723   0.040  1.00  0.00           H  
HETATM   20  C   UNL     1       3.146  -0.376   0.012  1.00  0.00           C  
HETATM   21  OXT UNL     1       3.466  -1.427   0.784  1.00  0.00           O  
HETATM   22  HXT UNL     1       4.208  -1.975   0.493  1.00  0.00           H  
CONECT    1    2    9   18                                            
CONECT    2    1   20   10    3                                       
CONECT    3    2   11   12    4                                       
CONECT    4    3   13   14    5                                       
CONECT    5    4    7    7    8                                       
CONECT    6   20   20                                                 
CONECT    7    5    5                                                 
CONECT    8    5   15   17   19                                       
CONECT    9    1                                                      
CONECT   10    2                                                      
CONECT   11    3                                                      
CONECT   12    3                                                      
CONECT   13    4                                                      
CONECT   14    4                                                      
CONECT   15    8   16   16   16                                       
CONECT   16   15   15   15                                            
CONECT   17    8                                                      
CONECT   18    1                                                      
CONECT   19    8                                                      
CONECT   20    2    6    6   21                                       
CONECT   21   20   22                                                 
CONECT   22   21                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
