COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   1      -7.391   3.943   1.242  1.00  0.00           C  
HETATM    2  N   UNK A   1      -7.046   4.778   2.273  1.00  0.00           N  
HETATM    3  O   UNK A   1     -10.028   3.511  -0.978  1.00  0.00           O  
HETATM    4  C   UNK A   1      -8.966   3.345  -0.408  1.00  0.00           C  
HETATM    5  N   UNK A   1      -8.585   4.145   0.615  1.00  0.00           N  
HETATM    6  C   UNK A   1      -8.040   2.270  -0.813  1.00  0.00           C  
HETATM    7  N   UNK A   1      -6.555   2.992   0.904  1.00  0.00           N  
HETATM    8  O   UNK A   1      -5.587  -1.477  -2.729  1.00  0.00           O  
HETATM    9  C   UNK A   1      -6.823   2.138  -0.102  1.00  0.00           C  
HETATM   10  N   UNK A   1      -5.968   1.175  -0.439  1.00  0.00           N  
HETATM   11  C   UNK A   1      -6.268   0.353  -1.436  1.00  0.00           C  
HETATM   12  N   UNK A   1      -8.327   1.442  -1.807  1.00  0.00           N  
HETATM   13  C   UNK A   1      -7.473   0.491  -2.133  1.00  0.00           C  
HETATM   14  C   UNK A   1      -5.317  -0.721  -1.816  1.00  0.00           C  
ATOM     15  N   GLY A   2      -4.154  -0.859  -1.149  1.00  0.00           N  
ATOM     16  CA  GLY A   2      -3.216  -1.920  -1.524  1.00  0.00           C  
ATOM     17  C   GLY A   2      -2.004  -1.857  -0.630  1.00  0.00           C  
ATOM     18  O   GLY A   2      -1.932  -1.010   0.235  1.00  0.00           O  
ATOM     19  N   PHE A   3      -1.001  -2.743  -0.792  1.00  0.00           N  
ATOM     20  CA  PHE A   3       0.177  -2.682   0.077  1.00  0.00           C  
ATOM     21  C   PHE A   3       1.357  -3.296  -0.633  1.00  0.00           C  
ATOM     22  O   PHE A   3       1.226  -3.740  -1.753  1.00  0.00           O  
ATOM     23  CB  PHE A   3      -0.101  -3.455   1.367  1.00  0.00           C  
ATOM     24  CG  PHE A   3      -1.200  -2.769   2.137  1.00  0.00           C  
ATOM     25  CD2 PHE A   3      -2.519  -3.118   1.918  1.00  0.00           C  
ATOM     26  CD1 PHE A   3      -0.888  -1.795   3.067  1.00  0.00           C  
ATOM     27  CE2 PHE A   3      -3.527  -2.488   2.623  1.00  0.00           C  
ATOM     28  CE1 PHE A   3      -1.896  -1.170   3.778  1.00  0.00           C  
ATOM     29  CZ  PHE A   3      -3.216  -1.510   3.549  1.00  0.00           C  
HETATM   30  C   UNK A   4       9.138   4.776  -1.222  1.00  0.00           C  
HETATM   31  C   UNK A   4       9.040   6.105  -1.592  1.00  0.00           C  
HETATM   32  C   UNK A   4       8.426   7.013  -0.750  1.00  0.00           C  
HETATM   33  C   UNK A   4       7.909   6.593   0.461  1.00  0.00           C  
HETATM   34  C   UNK A   4       8.007   5.265   0.831  1.00  0.00           C  
HETATM   35  C   UNK A   4       8.616   4.355  -0.013  1.00  0.00           C  
HETATM   36  C   UNK A   4       8.723   2.907   0.390  1.00  0.00           C  
HETATM   37  O   UNK A   4       7.552   2.187  -0.076  1.00  0.00           O  
HETATM   38  C   UNK A   4       7.491   0.872   0.204  1.00  0.00           C  
HETATM   39  O   UNK A   4       8.392   0.340   0.822  1.00  0.00           O  
HETATM   40  N   UNK A   4       6.430   0.145  -0.200  1.00  0.00           N  
HETATM   41  C   UNK A   4       6.364  -1.287   0.105  1.00  0.00           C  
HETATM   42  C   UNK A   4       5.068  -1.870  -0.462  1.00  0.00           C  
HETATM   43  C   UNK A   4       4.999  -3.364  -0.144  1.00  0.00           C  
HETATM   44  C   UNK A   4       3.703  -3.947  -0.711  1.00  0.00           C  
HETATM   45  C   UNK A   4       3.692  -5.440  -0.506  1.00  0.00           C  
HETATM   46  O   UNK A   4       2.816  -5.953   0.150  1.00  0.00           O  
HETATM   47  O   UNK A   4       4.655  -6.200  -1.050  1.00  0.00           O  
HETATM   48  N   UNK A   4       2.556  -3.351  -0.021  1.00  0.00           N  
HETATM   49  H   UNK A   1      -7.646   5.492   2.540  1.00  0.00           H  
HETATM   50  H   UNK A   1      -6.203   4.655   2.736  1.00  0.00           H  
HETATM   51  H   UNK A   1      -7.706  -0.184  -2.943  1.00  0.00           H  
HETATM   52  H   UNK A   1      -9.165   4.866   0.904  1.00  0.00           H  
ATOM     53  H   GLY A   2      -3.939  -0.256  -0.420  1.00  0.00           H  
ATOM     54  HA1 GLY A   2      -3.700  -2.890  -1.412  1.00  0.00           H  
ATOM     55  HA2 GLY A   2      -2.910  -1.784  -2.561  1.00  0.00           H  
ATOM     56  H   PHE A   3      -1.059  -3.420  -1.484  1.00  0.00           H  
ATOM     57  HA  PHE A   3       0.398  -1.642   0.317  1.00  0.00           H  
ATOM     58  HB1 PHE A   3      -0.408  -4.472   1.123  1.00  0.00           H  
ATOM     59  HB2 PHE A   3       0.804  -3.485   1.975  1.00  0.00           H  
ATOM     60  HD2 PHE A   3      -2.762  -3.882   1.194  1.00  0.00           H  
ATOM     61  HD1 PHE A   3       0.143  -1.523   3.239  1.00  0.00           H  
ATOM     62  HE2 PHE A   3      -4.558  -2.760   2.451  1.00  0.00           H  
ATOM     63  HE1 PHE A   3      -1.652  -0.409   4.505  1.00  0.00           H  
ATOM     64  HZ  PHE A   3      -4.003  -1.022   4.104  1.00  0.00           H  
HETATM   65  H   UNK A   4       9.618   4.067  -1.879  1.00  0.00           H  
HETATM   66  H   UNK A   4       9.444   6.433  -2.538  1.00  0.00           H  
HETATM   67  H   UNK A   4       8.349   8.051  -1.039  1.00  0.00           H  
HETATM   68  H   UNK A   4       7.429   7.303   1.119  1.00  0.00           H  
HETATM   69  H   UNK A   4       7.599   4.936   1.776  1.00  0.00           H  
HETATM   70  H   UNK A   4       9.618   2.471  -0.054  1.00  0.00           H  
HETATM   71  H   UNK A   4       8.785   2.836   1.476  1.00  0.00           H  
HETATM   72  H   UNK A   4       5.711   0.569  -0.693  1.00  0.00           H  
HETATM   73  H   UNK A   4       7.218  -1.794  -0.345  1.00  0.00           H  
HETATM   74  H   UNK A   4       6.385  -1.429   1.185  1.00  0.00           H  
HETATM   75  H   UNK A   4       4.214  -1.362  -0.013  1.00  0.00           H  
HETATM   76  H   UNK A   4       5.048  -1.727  -1.543  1.00  0.00           H  
HETATM   77  H   UNK A   4       5.853  -3.872  -0.593  1.00  0.00           H  
HETATM   78  H   UNK A   4       5.019  -3.507   0.937  1.00  0.00           H  
HETATM   79  H   UNK A   4       3.641  -3.727  -1.777  1.00  0.00           H  
HETATM   80  H   UNK A   4       4.605  -7.153  -0.891  1.00  0.00           H  
HETATM   81  H   UNK A   4       2.661  -2.995   0.875  1.00  0.00           H  
CONECT    1    2    7    7    5                                       
CONECT    2    1   49   50                                            
CONECT    3    4    4                                                 
CONECT    4    5    6    3    3                                       
CONECT    5    1    4   52                                            
CONECT    6    9    4   12   12                                       
CONECT    7    1    1    9                                            
CONECT    8   14   14                                                 
CONECT    9    7   10   10    6                                       
CONECT   10    9    9   11                                            
CONECT   11   10   14   13   13                                       
CONECT   12    6    6   13                                            
CONECT   13   11   11   12   51                                       
CONECT   14   15   11    8    8                                       
CONECT   15   16   14   53                                            
CONECT   16   15   17   54   55                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   56                                            
CONECT   20   21   19   23   57                                       
CONECT   21   48   22   22   20                                       
CONECT   22   21   21                                                 
CONECT   23   20   24   58   59                                       
CONECT   24   26   25   25   23                                       
CONECT   25   24   24   27   60                                       
CONECT   26   28   28   24   61                                       
CONECT   27   29   29   25   62                                       
CONECT   28   26   26   29   63                                       
CONECT   29   28   27   27   64                                       
CONECT   30   35   31   31   65                                       
CONECT   31   30   30   32   66                                       
CONECT   32   33   33   31   67                                       
CONECT   33   34   32   32   68                                       
CONECT   34   35   35   33   69                                       
CONECT   35   36   34   34   30                                       
CONECT   36   35   37   70   71                                       
CONECT   37   36   38                                                 
CONECT   38   37   39   39   40                                       
CONECT   39   38   38                                                 
CONECT   40   38   41   72                                            
CONECT   41   40   42   73   74                                       
CONECT   42   43   41   75   76                                       
CONECT   43   44   42   77   78                                       
CONECT   44   45   43   48   79                                       
CONECT   45   46   46   44   47                                       
CONECT   46   45   45                                                 
CONECT   47   45   80                                                 
CONECT   48   44   21   81                                            
CONECT   49    2                                                      
CONECT   50    2                                                      
CONECT   51   13                                                      
CONECT   52    5                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   16                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
CONECT   69   34                                                      
CONECT   70   36                                                      
CONECT   71   36                                                      
CONECT   72   40                                                      
CONECT   73   41                                                      
CONECT   74   41                                                      
CONECT   75   42                                                      
CONECT   76   42                                                      
CONECT   77   43                                                      
CONECT   78   43                                                      
CONECT   79   44                                                      
CONECT   80   47                                                      
CONECT   81   48                                                      
MASTER        0    0    0    0    0    0    0    0   81    0   81    0
END
