COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.823  -0.148  -0.071  1.00  0.00           C  
HETATM    2  N   UNL     1      -3.006  -1.155   1.191  1.00  0.00           N  
HETATM    3  O   UNL     1      -5.314  -1.251  -0.119  1.00  0.00           O  
HETATM    4  CA  UNL     1      -3.405   0.024   0.411  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.473   0.179  -0.793  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.076   0.474  -0.312  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.720   1.473   0.510  1.00  0.00           N  
HETATM    8  C   UNL     1       0.569   1.425   0.712  1.00  0.00           C  
HETATM    9  N   UNL     1       1.077   0.385   0.017  1.00  0.00           N  
HETATM   10  C   UNL     1       0.033  -0.221  -0.627  1.00  0.00           C  
HETATM   11  V   UNL     1       2.930  -0.152  -0.049  1.00  0.00           V  
HETATM   12  O   UNL     1       4.635  -0.645  -0.109  1.00  0.00           O1-
HETATM   13  O   UNL     1       2.941   0.100  -1.806  1.00  0.00           O1-
HETATM   14  O   UNL     1       2.495  -1.739   0.619  1.00  0.00           O1-
HETATM   15  O   UNL     1       3.356   1.184   1.042  1.00  0.00           O  
HETATM   16  OXT UNL     1      -5.538   0.922  -0.451  1.00  0.00           O  
HETATM   17  H1  UNL     1      -3.058  -1.993   0.631  1.00  0.00           H  
HETATM   18  H2  UNL     1      -2.082  -1.035   1.579  1.00  0.00           H  
HETATM   19  HA  UNL     1      -3.340   0.914   1.037  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.471  -0.744  -1.372  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.823   1.000  -1.420  1.00  0.00           H  
HETATM   22  H   UNL     1       1.134   2.105   1.331  1.00  0.00           H  
HETATM   23  H   UNL     1       0.088  -1.090  -1.267  1.00  0.00           H  
HETATM   24  HXT UNL     1      -6.441   0.761  -0.756  1.00  0.00           H  
CONECT    1    3    3    4   16                                       
CONECT    2    4   17   18                                            
CONECT    3    1    1                                                 
CONECT    4    5    1    2   19                                       
CONECT    5    6    4   20   21                                       
CONECT    6    5    7   10   10                                       
CONECT    7    6    8    8                                            
CONECT    8    7    7    9   22                                       
CONECT    9    8   10   11                                            
CONECT   10    6    6    9   23                                       
CONECT   11   14    9   13   12                                       
CONECT   11   15   15                                                 
CONECT   12   11                                                      
CONECT   13   11                                                      
CONECT   14   11                                                      
CONECT   15   11   11                                                 
CONECT   16    1   24                                                 
CONECT   17    2                                                      
CONECT   18    2                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    8                                                      
CONECT   23   10                                                      
CONECT   24   16                                                      
MASTER        0    0    0    0    0    0    0    0   24    0   24    0
END
