COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  OH  TYR A   1      -4.881  -0.555  -0.355  1.00  0.00           O  
HETATM    2  C   UNK A   0       1.713  -1.855  -0.300  1.00  0.00           C  
ATOM      3  O   TYR A   1       3.579   0.497   0.588  1.00  0.00           O  
HETATM    4  O   UNK A   0       2.086  -1.672  -1.443  1.00  0.00           O  
ATOM      5  CA  TYR A   1       1.327   0.543  -0.103  1.00  0.00           C  
ATOM      6  CB  TYR A   1       0.305   1.409   0.635  1.00  0.00           C  
HETATM    7  N   UNK A   0       1.699  -3.102   0.212  1.00  0.00           N  
ATOM      8  CG  TYR A   1      -1.083   0.884   0.371  1.00  0.00           C  
ATOM      9  OXT TYR A   1       2.951   2.381  -0.380  1.00  0.00           O  
ATOM     10  CD2 TYR A   1      -1.631  -0.071   1.208  1.00  0.00           C  
ATOM     11  CE2 TYR A   1      -2.903  -0.554   0.967  1.00  0.00           C  
ATOM     12  CZ  TYR A   1      -3.630  -0.081  -0.116  1.00  0.00           C  
ATOM     13  C   TYR A   1       2.701   1.138   0.060  1.00  0.00           C  
ATOM     14  CD1 TYR A   1      -1.808   1.361  -0.706  1.00  0.00           C  
ATOM     15  CE1 TYR A   1      -3.078   0.877  -0.954  1.00  0.00           C  
ATOM     16  N   TYR A   1       1.312  -0.812   0.454  1.00  0.00           N  
ATOM     17  HH  TYR A   1      -5.582  -0.053   0.083  1.00  0.00           H  
ATOM     18  HA  TYR A   1       1.072   0.503  -1.162  1.00  0.00           H  
ATOM     19  HB1 TYR A   1       0.507   1.377   1.706  1.00  0.00           H  
ATOM     20  HB2 TYR A   1       0.377   2.437   0.282  1.00  0.00           H  
HETATM   21  H   UNK A   0       1.988  -3.852  -0.330  1.00  0.00           H  
HETATM   22  H   UNK A   0       1.402  -3.248   1.124  1.00  0.00           H  
ATOM     23  HXT TYR A   1       3.848   2.720  -0.253  1.00  0.00           H  
ATOM     24  HD2 TYR A   1      -1.065  -0.439   2.050  1.00  0.00           H  
ATOM     25  HE2 TYR A   1      -3.330  -1.299   1.621  1.00  0.00           H  
ATOM     26  HD1 TYR A   1      -1.380   2.110  -1.355  1.00  0.00           H  
ATOM     27  HE1 TYR A   1      -3.644   1.250  -1.795  1.00  0.00           H  
ATOM     28  H   TYR A   1       1.014  -0.959   1.365  1.00  0.00           H  
CONECT    1   12   17                                                 
CONECT    2    7    4    4   16                                       
CONECT    3   13   13                                                 
CONECT    4    2    2                                                 
CONECT    5   16    6   13   18                                       
CONECT    6    5    8   19   20                                       
CONECT    7    2   21   22                                            
CONECT    8    6   14   14   10                                       
CONECT    9   13   23                                                 
CONECT   10    8   11   11   24                                       
CONECT   11   10   10   12   25                                       
CONECT   12   15   15   11    1                                       
CONECT   13    5    3    3    9                                       
CONECT   14    8    8   15   26                                       
CONECT   15   14   12   12   27                                       
CONECT   16    2    5   28                                            
CONECT   17    1                                                      
CONECT   18    5                                                      
CONECT   19    6                                                      
CONECT   20    6                                                      
CONECT   21    7                                                      
CONECT   22    7                                                      
CONECT   23    9                                                      
CONECT   24   10                                                      
CONECT   25   11                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
