COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.162   0.971   2.538  1.00  0.00           O  
HETATM    2  C   UNL     1       3.134   0.917   3.202  1.00  0.00           C  
HETATM    3  OXT UNL     1       2.919   1.710   4.284  1.00  0.00           O  
HETATM    4  CA  UNL     1       1.957   0.004   2.913  1.00  0.00           C  
HETATM    5  N   UNL     1       2.270  -0.703   1.668  1.00  0.00           N  
HETATM    6  C   UNL     1       1.755  -1.018   4.040  1.00  0.00           C  
HETATM    7  C   UNL     1       0.565  -1.955   3.834  1.00  0.00           C  
HETATM    8  C   UNL     1       0.356  -2.918   4.988  1.00  0.00           C  
HETATM    9  O   UNL     1       1.067  -2.855   5.991  1.00  0.00           O  
HETATM   10  C   UNL     1      -0.746  -3.942   4.834  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.786  -4.759   6.045  1.00  0.00           N  
HETATM   12  N   UNL     1      -1.682  -5.623   5.988  1.00  0.00           N  
HETATM   13  HXT UNL     1       3.644   2.333   4.502  1.00  0.00           H  
HETATM   14  HA  UNL     1       1.052   0.595   2.738  1.00  0.00           H  
HETATM   15  H1  UNL     1       1.704  -0.515   0.872  1.00  0.00           H  
HETATM   16  H2  UNL     1       2.891  -1.478   1.718  1.00  0.00           H  
HETATM   17  H   UNL     1       2.657  -1.636   4.145  1.00  0.00           H  
HETATM   18  H   UNL     1       1.630  -0.489   4.994  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.359  -1.387   3.679  1.00  0.00           H  
HETATM   20  H   UNL     1       0.713  -2.551   2.926  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.704  -3.433   4.700  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.538  -4.579   3.971  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.707  -6.194   6.840  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   13                                                 
CONECT    4    2    5    6   14                                       
CONECT    5    4   15   16                                            
CONECT    6    4    7   17   18                                       
CONECT    7    6    8   19   20                                       
CONECT    8    7    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   21   22                                       
CONECT   11   10   12   12                                            
CONECT   12   11   11   23                                            
CONECT   13    3                                                      
CONECT   14    4                                                      
CONECT   15    5                                                      
CONECT   16    5                                                      
CONECT   17    6                                                      
CONECT   18    6                                                      
CONECT   19    7                                                      
CONECT   20    7                                                      
CONECT   21   10                                                      
CONECT   22   10                                                      
CONECT   23   12                                                      
MASTER        0    0    0    0    0    0    0    0   23    0   23    0
END
