COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.106   1.917   2.323  1.00  0.00           N  
HETATM    2  CA  UNL     1      -0.537   0.611   2.123  1.00  0.00           C  
HETATM    3  C   UNL     1       0.302  -0.465   2.759  1.00  0.00           C  
HETATM    4  O   UNL     1       1.501  -0.332   2.831  1.00  0.00           O  
HETATM    5  OXT UNL     1      -0.280  -1.572   3.246  1.00  0.00           O  
HETATM    6  C   UNL     1      -0.672   0.338   0.647  1.00  0.00           C  
HETATM    7  C   UNL     1       0.455   0.285  -0.149  1.00  0.00           C  
HETATM    8  C   UNL     1       0.335   0.029  -1.503  1.00  0.00           C  
HETATM    9 CL   UNL     1       1.752  -0.043  -2.503  1.00  0.00          Cl  
HETATM   10  C   UNL     1      -0.920  -0.164  -2.061  1.00  0.00           C  
HETATM   11  O   UNL     1      -1.042  -0.411  -3.393  1.00  0.00           O  
HETATM   12  C   UNL     1      -2.050  -0.105  -1.259  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.924   0.145   0.092  1.00  0.00           C  
HETATM   14  H1  UNL     1       1.013   1.863   1.883  1.00  0.00           H  
HETATM   15  H2  UNL     1      -0.431   2.589   1.796  1.00  0.00           H  
HETATM   16  HA  UNL     1      -1.526   0.620   2.583  1.00  0.00           H  
HETATM   17  HXT UNL     1       0.259  -2.263   3.654  1.00  0.00           H  
HETATM   18  H   UNL     1       1.432   0.436   0.285  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.135   0.446  -3.829  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.028  -0.256  -1.692  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.803   0.191   0.717  1.00  0.00           H  
CONECT    1    2   14   15                                            
CONECT    2    1    3    6   16                                       
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3   17                                                 
CONECT    6    2    7    7   13                                       
CONECT    7    6    6    8   18                                       
CONECT    8    7    9   10   10                                       
CONECT    9    8                                                      
CONECT   10    8    8   11   12                                       
CONECT   11   10   19                                                 
CONECT   12   10   13   13   20                                       
CONECT   13    6   12   12   21                                       
CONECT   14    1                                                      
CONECT   15    1                                                      
CONECT   16    2                                                      
CONECT   17    5                                                      
CONECT   18    7                                                      
CONECT   19   11                                                      
CONECT   20   12                                                      
CONECT   21   13                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
