COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  N   HIS A   1      -1.368   1.195  -0.639  1.00  0.00           N  
ATOM      2  CA  HIS A   1      -1.396  -0.247  -0.360  1.00  0.00           C  
ATOM      3  CB  HIS A   1      -0.436  -0.563   0.788  1.00  0.00           C  
ATOM      4  CG  HIS A   1       0.978  -0.268   0.356  1.00  0.00           C  
ATOM      5  ND1 HIS A   1       1.648   0.872   0.578  1.00  0.00           N1+
ATOM      6  CD2 HIS A   1       1.791  -1.106  -0.316  1.00  0.00           C  
ATOM      7  CE1 HIS A   1       2.844   0.775   0.065  1.00  0.00           C  
ATOM      8  NE2 HIS A   1       2.976  -0.445  -0.498  1.00  0.00           N  
ATOM      9  C   HIS A   1      -2.794  -0.656   0.027  1.00  0.00           C  
ATOM     10  O   HIS A   1      -3.675   0.168   0.067  1.00  0.00           O  
ATOM     11  H1  HIS A   1      -1.945   1.421  -1.435  1.00  0.00           H  
ATOM     12  H2  HIS A   1      -1.648   1.726   0.173  1.00  0.00           H  
ATOM     13  HA  HIS A   1      -1.091  -0.795  -1.251  1.00  0.00           H  
ATOM     14  HB1 HIS A   1      -0.687   0.052   1.652  1.00  0.00           H  
ATOM     15  HB2 HIS A   1      -0.522  -1.617   1.054  1.00  0.00           H  
ATOM     16  HD1 HIS A   1       1.299   1.646   1.046  1.00  0.00           H  
ATOM     17  HD2 HIS A   1       1.554  -2.106  -0.647  1.00  0.00           H  
ATOM     18  HE1 HIS A   1       3.605   1.541   0.093  1.00  0.00           H  
ATOM     19  HE2 HIS A   1       3.763  -0.789  -0.949  1.00  0.00           H  
ATOM     20  H   HIS A   1      -3.007  -1.687   0.269  1.00  0.00           H  
CONECT    1    2   11   12                                            
CONECT    2    9    3    1   13                                       
CONECT    3    4    2   14   15                                       
CONECT    4    6    6    5    3                                       
CONECT    5    7    7    4   16                                       
CONECT    6    8    4    4   17                                       
CONECT    7    8    5    5   18                                       
CONECT    8    6    7   19                                            
CONECT    9   10   10    2   20                                       
CONECT   10    9    9                                                 
CONECT   11    1                                                      
CONECT   12    1                                                      
CONECT   13    2                                                      
CONECT   14    3                                                      
CONECT   15    3                                                      
CONECT   16    5                                                      
CONECT   17    6                                                      
CONECT   18    7                                                      
CONECT   19    8                                                      
CONECT   20    9                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
