COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0       2.766  -2.491   1.548  1.00  0.00           C  
HETATM    2  C   UNK A   0       3.330  -3.741   0.868  1.00  0.00           C  
HETATM    3  C   UNK A   0       4.229  -4.494   1.850  1.00  0.00           C  
HETATM    4  C   UNK A   0       2.177  -4.648   0.432  1.00  0.00           C  
HETATM    5  C   UNK A   0       1.982  -1.685   0.545  1.00  0.00           C  
HETATM    6  O   UNK A   0       1.882  -2.072  -0.600  1.00  0.00           O  
ATOM      7  N   TYR A   1       1.390  -0.534   0.922  1.00  0.00           N  
ATOM      8  CA  TYR A   1       0.627   0.250  -0.053  1.00  0.00           C  
ATOM      9  C   TYR A   1      -0.508  -0.584  -0.590  1.00  0.00           C  
ATOM     10  O   TYR A   1      -0.468  -1.793  -0.498  1.00  0.00           O  
ATOM     11  CB  TYR A   1       1.544   0.666  -1.204  1.00  0.00           C  
ATOM     12  CG  TYR A   1       2.608   1.599  -0.686  1.00  0.00           C  
ATOM     13  CD1 TYR A   1       3.806   1.090  -0.221  1.00  0.00           C  
ATOM     14  CD2 TYR A   1       2.386   2.964  -0.683  1.00  0.00           C  
ATOM     15  CE1 TYR A   1       4.783   1.944   0.254  1.00  0.00           C  
ATOM     16  CE2 TYR A   1       3.360   3.822  -0.210  1.00  0.00           C  
ATOM     17  CZ  TYR A   1       4.561   3.313   0.264  1.00  0.00           C  
ATOM     18  OH  TYR A   1       5.520   4.155   0.731  1.00  0.00           O  
ATOM     19  C   TYR A   2      -2.333  -1.259  -3.116  1.00  0.00           C  
ATOM     20  N   TYR A   2      -1.566   0.014  -1.174  1.00  0.00           N  
ATOM     21  O   TYR A   2      -2.255  -0.124  -3.981  1.00  0.00           O  
ATOM     22  CA  TYR A   2      -2.668  -0.797  -1.696  1.00  0.00           C  
ATOM     23  CB  TYR A   2      -3.949   0.040  -1.722  1.00  0.00           C  
ATOM     24  CG  TYR A   2      -4.347   0.392  -0.312  1.00  0.00           C  
ATOM     25  OH  TYR A   2      -5.436   1.356   3.549  1.00  0.00           O  
ATOM     26  CZ  TYR A   2      -5.077   1.038   2.277  1.00  0.00           C  
ATOM     27  CD1 TYR A   2      -5.180  -0.451   0.401  1.00  0.00           C  
ATOM     28  CD2 TYR A   2      -3.874   1.554   0.269  1.00  0.00           C  
ATOM     29  CE1 TYR A   2      -5.546  -0.130   1.694  1.00  0.00           C  
ATOM     30  CE2 TYR A   2      -4.237   1.879   1.562  1.00  0.00           C  
HETATM   31  H   UNK A   0       2.112  -2.787   2.368  1.00  0.00           H  
HETATM   32  H   UNK A   0       3.587  -1.888   1.937  1.00  0.00           H  
HETATM   33  H   UNK A   0       3.912  -3.448  -0.006  1.00  0.00           H  
HETATM   34  H   UNK A   0       3.647  -4.787   2.724  1.00  0.00           H  
HETATM   35  H   UNK A   0       4.630  -5.385   1.366  1.00  0.00           H  
HETATM   36  H   UNK A   0       5.050  -3.848   2.161  1.00  0.00           H  
HETATM   37  H   UNK A   0       1.595  -4.941   1.306  1.00  0.00           H  
HETATM   38  H   UNK A   0       1.537  -4.111  -0.268  1.00  0.00           H  
HETATM   39  H   UNK A   0       2.579  -5.538  -0.052  1.00  0.00           H  
ATOM     40  H   TYR A   1       1.469  -0.225   1.838  1.00  0.00           H  
ATOM     41  HA  TYR A   1       0.225   1.140   0.432  1.00  0.00           H  
ATOM     42  HB1 TYR A   1       2.015  -0.220  -1.631  1.00  0.00           H  
ATOM     43  HB2 TYR A   1       0.959   1.172  -1.971  1.00  0.00           H  
ATOM     44  HD1 TYR A   1       3.979   0.024  -0.228  1.00  0.00           H  
ATOM     45  HD2 TYR A   1       1.451   3.360  -1.052  1.00  0.00           H  
ATOM     46  HE1 TYR A   1       5.718   1.546   0.618  1.00  0.00           H  
ATOM     47  HE2 TYR A   1       3.187   4.888  -0.208  1.00  0.00           H  
ATOM     48  HH  TYR A   1       6.139   4.460   0.054  1.00  0.00           H  
ATOM     49  H1  TYR A   2      -3.112  -1.934  -3.472  1.00  0.00           H  
ATOM     50  H2  TYR A   2      -1.375  -1.780  -3.112  1.00  0.00           H  
ATOM     51  H   TYR A   2      -1.597   0.980  -1.247  1.00  0.00           H  
ATOM     52  H   TYR A   2      -2.045  -0.343  -4.899  1.00  0.00           H  
ATOM     53  HA  TYR A   2      -2.815  -1.667  -1.056  1.00  0.00           H  
ATOM     54  HB1 TYR A   2      -3.775   0.954  -2.289  1.00  0.00           H  
ATOM     55  HB2 TYR A   2      -4.748  -0.533  -2.193  1.00  0.00           H  
ATOM     56  HH  TYR A   2      -6.242   1.888   3.609  1.00  0.00           H  
ATOM     57  HD1 TYR A   2      -5.545  -1.360  -0.053  1.00  0.00           H  
ATOM     58  HD2 TYR A   2      -3.220   2.208  -0.288  1.00  0.00           H  
ATOM     59  HE1 TYR A   2      -6.196  -0.789   2.251  1.00  0.00           H  
ATOM     60  HE2 TYR A   2      -3.871   2.789   2.013  1.00  0.00           H  
CONECT    1    2    5   31   32                                       
CONECT    2    1    3    4   33                                       
CONECT    3    2   34   35   36                                       
CONECT    4    2   37   38   39                                       
CONECT    5    1    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    8   40    5                                            
CONECT    8    7    9   11   41                                       
CONECT    9    8   10   10   20                                       
CONECT   10    9    9                                                 
CONECT   11    8   12   42   43                                       
CONECT   12   11   13   13   14                                       
CONECT   13   12   12   15   44                                       
CONECT   14   12   16   16   45                                       
CONECT   15   13   17   17   46                                       
CONECT   16   14   14   17   47                                       
CONECT   17   15   15   16   18                                       
CONECT   18   17   48                                                 
CONECT   19   21   22   49   50                                       
CONECT   20   22   51    9                                            
CONECT   21   19   52                                                 
CONECT   22   19   20   23   53                                       
CONECT   23   22   24   54   55                                       
CONECT   24   23   27   27   28                                       
CONECT   25   26   56                                                 
CONECT   26   25   29   29   30                                       
CONECT   27   24   24   29   57                                       
CONECT   28   24   30   30   58                                       
CONECT   29   26   26   27   59                                       
CONECT   30   26   28   28   60                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   25                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
