COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  O   HIS A   1       2.622  -1.378   1.433  1.00  0.00           O  
ATOM      2  C   HIS A   1       2.623  -1.401   0.225  1.00  0.00           C  
ATOM      3  CA  HIS A   1       1.545  -0.683  -0.544  1.00  0.00           C  
ATOM      4  CB  HIS A   1       0.777  -1.687  -1.406  1.00  0.00           C  
ATOM      5  N   HIS A   1       0.620  -0.037   0.397  1.00  0.00           N  
ATOM      6  CA  HIS A   1      -0.053   1.109  -0.228  1.00  0.00           C  
ATOM      7  C   HIS A   1       0.821   2.331  -0.108  1.00  0.00           C  
ATOM      8  OXT HIS A   1       0.407   3.505  -0.612  1.00  0.00           O  
ATOM      9  O   HIS A   1       1.893   2.255   0.443  1.00  0.00           O  
ATOM     10  CB  HIS A   1      -1.387   1.364   0.476  1.00  0.00           C  
ATOM     11  CG  HIS A   1      -2.306   0.191   0.251  1.00  0.00           C  
ATOM     12  ND1 HIS A   1      -2.655  -0.320  -0.939  1.00  0.00           N  
ATOM     13  CD2 HIS A   1      -2.916  -0.531   1.210  1.00  0.00           C  
ATOM     14  CE1 HIS A   1      -3.463  -1.328  -0.754  1.00  0.00           C  
ATOM     15  NE2 HIS A   1      -3.652  -1.494   0.572  1.00  0.00           N  
ATOM     16  OXT HIS A   1       3.589  -2.062  -0.433  1.00  0.00           O  
ATOM     17  HA  HIS A   1       1.998   0.074  -1.185  1.00  0.00           H  
ATOM     18  HB1 HIS A   1      -0.003  -1.167  -1.962  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       1.463  -2.166  -2.104  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       0.324  -2.444  -0.765  1.00  0.00           H  
ATOM     21  H   HIS A   1       1.098   0.241   1.241  1.00  0.00           H  
ATOM     22  HA  HIS A   1      -0.233   0.894  -1.282  1.00  0.00           H  
ATOM     23  HXT HIS A   1       1.001   4.260  -0.510  1.00  0.00           H  
ATOM     24  HB1 HIS A   1      -1.215   1.491   1.545  1.00  0.00           H  
ATOM     25  HB2 HIS A   1      -1.845   2.267   0.072  1.00  0.00           H  
ATOM     26  HD2 HIS A   1      -2.840  -0.380   2.276  1.00  0.00           H  
ATOM     27  HE1 HIS A   1      -3.904  -1.932  -1.534  1.00  0.00           H  
ATOM     28  HE2 HIS A   1      -4.205  -2.169   0.995  1.00  0.00           H  
ATOM     29  HXT HIS A   1       4.261  -2.505   0.103  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   16                                       
CONECT    3    5    2    4   17                                       
CONECT    4    3   18   19   20                                       
CONECT    5    6    3   21                                            
CONECT    6    7   10    5   22                                       
CONECT    7    9    9    8    6                                       
CONECT    8    7   23                                                 
CONECT    9    7    7                                                 
CONECT   10   11    6   24   25                                       
CONECT   11   12   10   13   13                                       
CONECT   12   14   14   11                                            
CONECT   13   15   11   11   26                                       
CONECT   14   12   12   15   27                                       
CONECT   15   14   13   28                                            
CONECT   16    2   29                                                 
CONECT   17    3                                                      
CONECT   18    4                                                      
CONECT   19    4                                                      
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    6                                                      
CONECT   23    8                                                      
CONECT   24   10                                                      
CONECT   25   10                                                      
CONECT   26   13                                                      
CONECT   27   14                                                      
CONECT   28   15                                                      
CONECT   29   16                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
