COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   1       4.730   1.438  -0.735  1.00  0.00           C  
HETATM    2  C   UNK A   1      -0.942   2.025   0.581  1.00  0.00           C  
ATOM      3  CG  TYR A   2      -3.597  -0.895  -0.176  1.00  0.00           C  
ATOM      4  CD2 TYR A   2      -3.891   0.000  -1.188  1.00  0.00           C  
ATOM      5  CE2 TYR A   2      -5.195   0.157  -1.615  1.00  0.00           C  
ATOM      6  CD1 TYR A   2      -4.606  -1.635   0.411  1.00  0.00           C  
ATOM      7  C   TYR A   2      -0.502  -0.345   1.951  1.00  0.00           C  
HETATM    8  C   UNK A   1       0.468   1.532   0.704  1.00  0.00           C  
HETATM    9  C   UNK A   1       0.971   1.103  -0.676  1.00  0.00           C  
HETATM   10  C   UNK A   1       2.437   0.764  -0.594  1.00  0.00           C  
HETATM   11  C   UNK A   1       2.831  -0.529  -0.303  1.00  0.00           C  
HETATM   12  C   UNK A   1       4.175  -0.844  -0.232  1.00  0.00           C  
HETATM   13  C   UNK A   1       5.128   0.142  -0.443  1.00  0.00           C  
HETATM   14  C   UNK A   1       6.787  -1.518  -0.059  1.00  0.00           C  
HETATM   15  C   UNK A   1       3.385   1.746  -0.809  1.00  0.00           C  
ATOM     16  CA  TYR A   2      -1.878  -0.083   1.418  1.00  0.00           C  
ATOM     17  CB  TYR A   2      -2.172  -1.068   0.284  1.00  0.00           C  
ATOM     18  CZ  TYR A   2      -6.210  -0.584  -1.028  1.00  0.00           C  
ATOM     19  CE1 TYR A   2      -5.912  -1.482  -0.013  1.00  0.00           C  
HETATM   20  N   UNK A   1       0.556   0.400   1.617  1.00  0.00           N  
ATOM     21  N   TYR A   2      -2.000   1.277   0.911  1.00  0.00           N  
ATOM     22  O   TYR A   2      -0.342  -1.271   2.718  1.00  0.00           O  
HETATM   23  O   UNK A   1       6.450  -0.163  -0.363  1.00  0.00           O  
HETATM   24  O   UNK A   1       6.571  -2.333  -1.213  1.00  0.00           O  
HETATM   25  O   UNK A   1      -1.131   3.150   0.170  1.00  0.00           O  
ATOM     26  OH  TYR A   2      -7.494  -0.431  -1.446  1.00  0.00           O  
HETATM   27  H   UNK A   1       5.471   2.207  -0.899  1.00  0.00           H  
ATOM     28  HD2 TYR A   2      -3.100   0.577  -1.645  1.00  0.00           H  
ATOM     29  HE2 TYR A   2      -5.424   0.857  -2.405  1.00  0.00           H  
ATOM     30  HD1 TYR A   2      -4.374  -2.333   1.201  1.00  0.00           H  
HETATM   31  H   UNK A   1       1.098   2.340   1.076  1.00  0.00           H  
HETATM   32  H   UNK A   1       0.414   0.227  -1.010  1.00  0.00           H  
HETATM   33  H   UNK A   1       0.826   1.918  -1.385  1.00  0.00           H  
HETATM   34  H   UNK A   1       2.088  -1.295  -0.135  1.00  0.00           H  
HETATM   35  H   UNK A   1       4.482  -1.854  -0.005  1.00  0.00           H  
HETATM   36  H   UNK A   1       7.835  -1.574   0.235  1.00  0.00           H  
HETATM   37  H   UNK A   1       6.160  -1.873   0.759  1.00  0.00           H  
HETATM   38  H   UNK A   1       3.075   2.756  -1.036  1.00  0.00           H  
ATOM     39  HA  TYR A   2      -2.605  -0.232   2.216  1.00  0.00           H  
ATOM     40  HB1 TYR A   2      -2.028  -2.088   0.642  1.00  0.00           H  
ATOM     41  HB2 TYR A   2      -1.495  -0.876  -0.549  1.00  0.00           H  
ATOM     42  HE1 TYR A   2      -6.701  -2.061   0.445  1.00  0.00           H  
HETATM   43  H   UNK A   1       1.419   0.177   1.998  1.00  0.00           H  
ATOM     44  H   TYR A   2      -2.886   1.657   0.809  1.00  0.00           H  
HETATM   45  H   UNK A   1       6.780  -3.267  -1.079  1.00  0.00           H  
ATOM     46  HH  TYR A   2      -7.747  -1.024  -2.167  1.00  0.00           H  
CONECT    1   15   15   13   27                                       
CONECT    2   25   25    8   21                                       
CONECT    3   17    6    6    4                                       
CONECT    4    3    5    5   28                                       
CONECT    5    4    4   18   29                                       
CONECT    6    3    3   19   30                                       
CONECT    7   20   22   22   16                                       
CONECT    8   20    2    9   31                                       
CONECT    9    8   10   32   33                                       
CONECT   10    9   11   11   15                                       
CONECT   11   10   10   12   34                                       
CONECT   12   11   13   13   35                                       
CONECT   13   12   12    1   23                                       
CONECT   14   23   24   36   37                                       
CONECT   15   10    1    1   38                                       
CONECT   16    7   21   17   39                                       
CONECT   17   16    3   40   41                                       
CONECT   18   19   19    5   26                                       
CONECT   19    6   18   18   42                                       
CONECT   20    8    7   43                                            
CONECT   21    2   16   44                                            
CONECT   22    7    7                                                 
CONECT   23   13   14                                                 
CONECT   24   14   45                                                 
CONECT   25    2    2                                                 
CONECT   26   18   46                                                 
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   24                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
