COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   1      -4.515   2.692  -0.976  1.00  0.00           C  
HETATM    2  C   UNK A   1      -4.214   1.231  -0.762  1.00  0.00           C  
HETATM    3  C   UNK A   1      -2.904   0.801  -0.672  1.00  0.00           C  
HETATM    4  C   UNK A   1      -2.627  -0.539  -0.475  1.00  0.00           C  
HETATM    5  C   UNK A   1      -1.198  -1.005  -0.378  1.00  0.00           C  
HETATM    6  C   UNK A   1      -0.745  -0.960   1.083  1.00  0.00           C  
ATOM      7  C   TYR A   2       0.384   1.149   1.628  1.00  0.00           C  
ATOM      8  CA  TYR A   2       1.734   0.603   1.273  1.00  0.00           C  
ATOM      9  CB  TYR A   2       2.124   1.096  -0.122  1.00  0.00           C  
ATOM     10  CG  TYR A   2       3.530   0.654  -0.437  1.00  0.00           C  
ATOM     11  CD2 TYR A   2       4.599   1.462  -0.099  1.00  0.00           C  
ATOM     12  CE2 TYR A   2       5.889   1.059  -0.387  1.00  0.00           C  
ATOM     13  CZ  TYR A   2       6.110  -0.158  -1.016  1.00  0.00           C  
ATOM     14  CE1 TYR A   2       5.035  -0.967  -1.353  1.00  0.00           C  
ATOM     15  CD1 TYR A   2       3.747  -0.562  -1.058  1.00  0.00           C  
HETATM   16  C   UNK A   1       0.615  -1.579   1.195  1.00  0.00           C  
HETATM   17  C   UNK A   1      -3.660  -1.452  -0.368  1.00  0.00           C  
HETATM   18  C   UNK A   1      -4.971  -1.027  -0.456  1.00  0.00           C  
HETATM   19  C   UNK A   1      -6.096  -2.023  -0.339  1.00  0.00           C  
HETATM   20  C   UNK A   1      -5.252   0.318  -0.648  1.00  0.00           C  
HETATM   21  N   UNK A   1      -0.735   0.424   1.536  1.00  0.00           N  
ATOM     22  N   TYR A   2       1.735  -0.854   1.281  1.00  0.00           N  
ATOM     23  O   TYR A   2       0.304   2.296   2.014  1.00  0.00           O  
ATOM     24  OH  TYR A   2       7.378  -0.557  -1.301  1.00  0.00           O  
HETATM   25  O   UNK A   1       0.704  -2.789   1.207  1.00  0.00           O  
HETATM   26  O   UNK A   1      -6.542   0.739  -0.729  1.00  0.00           O  
HETATM   27  H   UNK A   1      -4.605   3.190  -0.011  1.00  0.00           H  
HETATM   28  H   UNK A   1      -3.707   3.150  -1.547  1.00  0.00           H  
HETATM   29  H   UNK A   1      -5.451   2.794  -1.525  1.00  0.00           H  
HETATM   30  H   UNK A   1      -2.096   1.513  -0.756  1.00  0.00           H  
HETATM   31  H   UNK A   1      -1.123  -2.027  -0.750  1.00  0.00           H  
HETATM   32  H   UNK A   1      -0.561  -0.353  -0.976  1.00  0.00           H  
HETATM   33  H   UNK A   1      -1.448  -1.530   1.691  1.00  0.00           H  
ATOM     34  HA  TYR A   2       2.466   0.963   1.996  1.00  0.00           H  
ATOM     35  HB1 TYR A   2       1.438   0.679  -0.859  1.00  0.00           H  
ATOM     36  HB2 TYR A   2       2.070   2.184  -0.150  1.00  0.00           H  
ATOM     37  HD2 TYR A   2       4.427   2.409   0.390  1.00  0.00           H  
ATOM     38  HE2 TYR A   2       6.724   1.691  -0.124  1.00  0.00           H  
ATOM     39  HE1 TYR A   2       5.204  -1.915  -1.843  1.00  0.00           H  
ATOM     40  HD1 TYR A   2       2.911  -1.194  -1.317  1.00  0.00           H  
HETATM   41  H   UNK A   1      -3.441  -2.499  -0.214  1.00  0.00           H  
HETATM   42  H   UNK A   1      -6.390  -2.118   0.707  1.00  0.00           H  
HETATM   43  H   UNK A   1      -6.949  -1.679  -0.925  1.00  0.00           H  
HETATM   44  H   UNK A   1      -5.765  -2.991  -0.713  1.00  0.00           H  
HETATM   45  H   UNK A   1      -1.577   0.838   1.782  1.00  0.00           H  
ATOM     46  H   TYR A   2       2.584  -1.317   1.352  1.00  0.00           H  
ATOM     47  HH  TYR A   2       7.797  -1.069  -0.596  1.00  0.00           H  
HETATM   48  H   UNK A   1      -6.900   0.736  -1.628  1.00  0.00           H  
CONECT    1    2   27   28   29                                       
CONECT    2    3    1   20   20                                       
CONECT    3    4    4    2   30                                       
CONECT    4    5    3    3   17                                       
CONECT    5    6    4   31   32                                       
CONECT    6   21   16    5   33                                       
CONECT    7   21   23   23    8                                       
CONECT    8    7   22    9   34                                       
CONECT    9    8   10   35   36                                       
CONECT   10    9   15   15   11                                       
CONECT   11   10   12   12   37                                       
CONECT   12   11   11   13   38                                       
CONECT   13   14   14   12   24                                       
CONECT   14   15   13   13   39                                       
CONECT   15   10   10   14   40                                       
CONECT   16   25   25    6   22                                       
CONECT   17    4   18   18   41                                       
CONECT   18   17   17   20   19                                       
CONECT   19   18   42   43   44                                       
CONECT   20    2    2   18   26                                       
CONECT   21    6    7   45                                            
CONECT   22   16    8   46                                            
CONECT   23    7    7                                                 
CONECT   24   13   47                                                 
CONECT   25   16   16                                                 
CONECT   26   20   48                                                 
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   24                                                      
CONECT   48   26                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
