sim/src/tests/amino_acids/glu_l_aminoacid.pdb


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COMPND    glu.inp.log 
AUTHOR    GENERATED BY OPEN BABEL 2.0.0rc1
ATOM      1  N   UNK     0      -0.510   1.988  -0.010  1.00  0.00           N  
ATOM      2  C   UNK     0       0.438   1.024   0.553  1.00  0.00           C  
ATOM      3  C   UNK     0       1.753   1.049  -0.223  1.00  0.00           C  
ATOM      4  O   UNK     0       2.465   0.094  -0.433  1.00  0.00           O  
ATOM      5  O   UNK     0       2.090   2.306  -0.607  1.00  0.00           O  
ATOM      6  C   UNK     0      -0.170  -0.388   0.586  1.00  0.00           C  
ATOM      7  C   UNK     0      -0.614  -0.894  -0.798  1.00  0.00           C  
ATOM      8  C   UNK     0      -1.407  -2.178  -0.748  1.00  0.00           C  
ATOM      9  O   UNK     0      -1.193  -3.174  -1.404  1.00  0.00           O  
ATOM     10  O   UNK     0      -2.450  -2.105   0.126  1.00  0.00           O  
ATOM     11  H   UNK     0      -0.069   2.898  -0.106  1.00  0.00           H  
ATOM     12  H   UNK     0      -1.298   2.095   0.624  1.00  0.00           H  
ATOM     13  H   UNK     0       0.742   1.266   1.590  1.00  0.00           H  
ATOM     14  H   UNK     0      -1.033  -0.368   1.260  1.00  0.00           H  
ATOM     15  H   UNK     0       0.566  -1.073   1.016  1.00  0.00           H  
ATOM     16  H   UNK     0       0.247  -1.071  -1.444  1.00  0.00           H  
ATOM     17  H   UNK     0      -1.243  -0.125  -1.264  1.00  0.00           H  
ATOM     18  H   UNK     0      -2.896  -2.967   0.073  1.00  0.00           H  
ATOM     19  H   UNK     0       2.946   2.232  -1.062  1.00  0.00           H  
CONECT    1   11    2   12                                            
CONECT    2    3    1    6   13                                       
CONECT    3    5    4    2                                            
CONECT    4    3                                                      
CONECT    5   19    3                                                 
CONECT    6    7    2   15   14                                       
CONECT    7   16   17    8    6                                       
CONECT    8    9    7   10                                            
CONECT    9    8                                                      
CONECT   10    8   18                                                 
CONECT   11    1                                                      
CONECT   12    1                                                      
CONECT   13    2                                                      
CONECT   14    6                                                      
CONECT   15    6                                                      
CONECT   16    7                                                      
CONECT   17    7                                                      
CONECT   18   10                                                      
CONECT   19    5                                                      
MASTER        0    0    0    0    0    0    0    0   19    0   19    0
END