COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.112  -0.311  -2.134  1.00  0.00           N  
HETATM    2  CA  UNL     1       1.931  -1.013  -1.603  1.00  0.00           C  
HETATM    3  C   UNL     1       1.932  -2.420  -2.199  1.00  0.00           C  
HETATM    4  O   UNL     1       2.822  -2.883  -2.900  1.00  0.00           O  
HETATM    5  C   UNL     1       1.885  -1.036  -0.112  1.00  0.00           C  
HETATM    6  C   UNL     1       0.807  -0.463   0.561  1.00  0.00           C  
HETATM    7  C   UNL     1       0.764  -0.484   1.955  1.00  0.00           C  
HETATM    8  C   UNL     1       1.800  -1.079   2.676  1.00  0.00           C  
HETATM    9  O   UNL     1       1.759  -1.098   4.036  1.00  0.00           O  
HETATM   10  C   UNL     1       2.878  -1.652   2.002  1.00  0.00           C  
HETATM   11  C   UNL     1       2.921  -1.631   0.608  1.00  0.00           C  
HETATM   12  OXT UNL     1       0.809  -3.126  -1.893  1.00  0.00           O  
HETATM   13  H1  UNL     1       3.901  -0.861  -2.374  1.00  0.00           H  
HETATM   14  H2  UNL     1       3.139   0.675  -2.036  1.00  0.00           H  
HETATM   15  HA  UNL     1       1.035  -0.505  -2.005  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.005   0.002   0.008  1.00  0.00           H  
HETATM   17  H   UNL     1      -0.079  -0.036   2.474  1.00  0.00           H  
HETATM   18  H   UNL     1       1.063  -0.504   4.360  1.00  0.00           H  
HETATM   19  H   UNL     1       3.689  -2.116   2.558  1.00  0.00           H  
HETATM   20  H   UNL     1       3.766  -2.080   0.092  1.00  0.00           H  
HETATM   21  HXT UNL     1       0.767  -4.028  -2.275  1.00  0.00           H  
CONECT    1    2   13   14                                            
CONECT    2    1    3    5   15                                       
CONECT    3    2    4    4   12                                       
CONECT    4    3    3                                                 
CONECT    5    2    6    6   11                                       
CONECT    6    5    5    7   16                                       
CONECT    7    6    8    8   17                                       
CONECT    8    7    7    9   10                                       
CONECT    9    8   18                                                 
CONECT   10    8   11   11   19                                       
CONECT   11    5   10   10   20                                       
CONECT   12    3   21                                                 
CONECT   13    1                                                      
CONECT   14    1                                                      
CONECT   15    2                                                      
CONECT   16    6                                                      
CONECT   17    7                                                      
CONECT   18    9                                                      
CONECT   19   10                                                      
CONECT   20   11                                                      
CONECT   21   12                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
