COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.409   1.225   0.002  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.540  -1.982   0.002  1.00  0.00           C  
HETATM    3  C   UNL     1       0.766  -2.444   0.000  1.00  0.00           C  
HETATM    4  C   UNL     1       1.796  -1.517  -0.001  1.00  0.00           C  
HETATM    5  CA  UNL     1       1.488  -0.155   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1       2.582   0.844  -0.001  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.787   1.723  -0.002  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.172  -0.102   0.000  1.00  0.00           C  
HETATM    9  O   UNL     1      -3.101  -0.885  -0.004  1.00  0.00           O  
HETATM   10  C   UNL     1      -0.778  -0.605   0.004  1.00  0.00           C  
HETATM   11  N   UNL     1       0.229   0.254   0.003  1.00  0.00           N  
HETATM   12  OXT UNL     1       2.293   2.159   0.001  1.00  0.00           O  
HETATM   13  O   UNL     1       3.740   0.477  -0.003  1.00  0.00           O  
HETATM   14  H   UNL     1      -1.667   1.850   0.001  1.00  0.00           H  
HETATM   15  H   UNL     1      -1.366  -2.678  -0.002  1.00  0.00           H  
HETATM   16  H   UNL     1       0.976  -3.503  -0.001  1.00  0.00           H  
HETATM   17  H   UNL     1       2.825  -1.844  -0.003  1.00  0.00           H  
HETATM   18  H   UNL     1      -4.302   1.360  -0.891  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.304   1.366   0.889  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.779   2.813  -0.005  1.00  0.00           H  
HETATM   21  HXT UNL     1       3.041   2.773   0.000  1.00  0.00           H  
CONECT    1    8    7   14                                            
CONECT    2    3    3   10   15                                       
CONECT    3    4    2    2   16                                       
CONECT    4    5    5    3   17                                       
CONECT    5    6    4    4   11                                       
CONECT    6   13   13   12    5                                       
CONECT    7    1   18   19   20                                       
CONECT    8   10    1    9    9                                       
CONECT    9    8    8                                                 
CONECT   10   11   11    2    8                                       
CONECT   11    5   10   10                                            
CONECT   12    6   21                                                 
CONECT   13    6    6                                                 
CONECT   14    1                                                      
CONECT   15    2                                                      
CONECT   16    3                                                      
CONECT   17    4                                                      
CONECT   18    7                                                      
CONECT   19    7                                                      
CONECT   20    7                                                      
CONECT   21   12                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
