COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  CA  UNL     1      -2.301  -0.100  -0.001  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.330  -1.052   0.001  1.00  0.00           C  
HETATM    3  C   UNL     1       1.248  -0.844   0.001  1.00  0.00           C  
HETATM    4  C   UNL     1       2.272   0.057  -0.001  1.00  0.00           C  
HETATM    5  C   UNL     1       2.013   1.423  -0.002  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.747  -0.357  -0.001  1.00  0.00           C  
HETATM    7  OXT UNL     1      -4.615   0.674   0.003  1.00  0.00           O  
HETATM    8  O   UNL     1      -4.161  -1.501  -0.004  1.00  0.00           O  
HETATM    9  C   UNL     1       0.719   1.891  -0.002  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.343   0.992  -0.001  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.078  -0.392   0.000  1.00  0.00           C  
HETATM   12  N   UNL     1       3.672  -0.424   0.000  1.00  0.00           N1+
HETATM   13  O   UNL     1       3.905  -1.619   0.002  1.00  0.00           O1-
HETATM   14  O   UNL     1       4.591   0.376  -0.001  1.00  0.00           O  
HETATM   15  N   UNL     1      -1.709   1.149   0.003  1.00  0.00           N  
HETATM   16  H   UNL     1      -1.487  -2.121   0.002  1.00  0.00           H  
HETATM   17  H   UNL     1       1.459  -1.903   0.002  1.00  0.00           H  
HETATM   18  H   UNL     1       2.836   2.123  -0.003  1.00  0.00           H  
HETATM   19  HXT UNL     1      -5.557   0.455   0.003  1.00  0.00           H  
HETATM   20  H   UNL     1       0.528   2.955  -0.003  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.180   1.997   0.006  1.00  0.00           H  
CONECT    1    2    2    6   15                                       
CONECT    2   11    1    1   16                                       
CONECT    3    4    4   11   17                                       
CONECT    4   12    3    3    5                                       
CONECT    5    4    9    9   18                                       
CONECT    6    8    8    1    7                                       
CONECT    7    6   19                                                 
CONECT    8    6    6                                                 
CONECT    9    5    5   10   20                                       
CONECT   10   11   11    9   15                                       
CONECT   11    3    2   10   10                                       
CONECT   12   14   14   13    4                                       
CONECT   13   12                                                      
CONECT   14   12   12                                                 
CONECT   15   10    1   21                                            
CONECT   16    2                                                      
CONECT   17    3                                                      
CONECT   18    5                                                      
CONECT   19    7                                                      
CONECT   20    9                                                      
CONECT   21   15                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
