COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0       4.931  -0.669  -0.026  1.00  0.00           C  
ATOM      2  N   PHE A   1       6.142  -0.502   0.543  1.00  0.00           N  
ATOM      3  CA  PHE A   1       7.358  -0.711  -0.246  1.00  0.00           C  
ATOM      4  CB  PHE A   1       8.506   0.098   0.360  1.00  0.00           C  
ATOM      5  CG  PHE A   1       8.201   1.569   0.241  1.00  0.00           C  
ATOM      6  CD1 PHE A   1       8.601   2.269  -0.882  1.00  0.00           C  
ATOM      7  CE1 PHE A   1       8.322   3.618  -0.991  1.00  0.00           C  
ATOM      8  CZ  PHE A   1       7.642   4.268   0.022  1.00  0.00           C  
ATOM      9  CE2 PHE A   1       7.241   3.568   1.145  1.00  0.00           C  
ATOM     10  CD2 PHE A   1       7.517   2.218   1.252  1.00  0.00           C  
ATOM     11  C   PHE A   1       7.716  -2.175  -0.238  1.00  0.00           C  
ATOM     12  O   PHE A   1       7.026  -2.963   0.365  1.00  0.00           O  
ATOM     13  OXT PHE A   1       8.801  -2.604  -0.902  1.00  0.00           O  
HETATM   14  O   UNK A   0       4.849  -0.997  -1.190  1.00  0.00           O  
HETATM   15  C   UNK A   0       3.681  -0.453   0.787  1.00  0.00           C  
HETATM   16  C   UNK A   0       2.471  -0.702  -0.078  1.00  0.00           C  
HETATM   17  N   UNK A   0       1.234  -0.568   0.440  1.00  0.00           N  
HETATM   18  C   UNK A   0       0.058  -0.809  -0.400  1.00  0.00           C  
HETATM   19  C   UNK A   0      -1.117  -0.043   0.149  1.00  0.00           C  
HETATM   20  N   UNK A   0      -2.315  -0.115  -0.466  1.00  0.00           N  
HETATM   21  C   UNK A   0      -3.458   0.630   0.068  1.00  0.00           C  
HETATM   22  C   UNK A   0      -4.738  -0.043  -0.356  1.00  0.00           C  
HETATM   23  N   UNK A   0      -5.896   0.264   0.260  1.00  0.00           N  
HETATM   24  C   UNK A   0      -7.118  -0.477  -0.065  1.00  0.00           C  
HETATM   25  C   UNK A   0      -8.339   0.393   0.240  1.00  0.00           C  
HETATM   26  C   UNK A   0      -8.278   1.671  -0.600  1.00  0.00           C  
HETATM   27  C   UNK A   0      -9.557   2.482  -0.388  1.00  0.00           C  
HETATM   28  O   UNK A   0      -9.500   3.675  -1.173  1.00  0.00           O  
HETATM   29  O   UNK A   0      -8.345   0.735   1.628  1.00  0.00           O  
HETATM   30  C   UNK A   0      -7.179  -1.754   0.774  1.00  0.00           C  
HETATM   31  C   UNK A   0      -6.027  -2.680   0.379  1.00  0.00           C  
HETATM   32  C   UNK A   0      -6.013  -3.900   1.302  1.00  0.00           C  
HETATM   33  C   UNK A   0      -6.214  -3.138  -1.069  1.00  0.00           C  
HETATM   34  O   UNK A   0      -4.725  -0.859  -1.252  1.00  0.00           O  
HETATM   35  C   UNK A   0      -3.431   2.062  -0.471  1.00  0.00           C  
HETATM   36  O   UNK A   0      -4.605   2.754  -0.043  1.00  0.00           O  
HETATM   37  C   UNK A   0      -2.190   2.783   0.060  1.00  0.00           C  
HETATM   38  O   UNK A   0      -0.986   0.637   1.144  1.00  0.00           O  
HETATM   39  C   UNK A   0      -0.265  -2.305  -0.407  1.00  0.00           C  
HETATM   40  C   UNK A   0       0.971  -3.092  -0.846  1.00  0.00           C  
HETATM   41  O   UNK A   0      -0.649  -2.715   0.908  1.00  0.00           O  
HETATM   42  O   UNK A   0       2.611  -1.022  -1.239  1.00  0.00           O  
HETATM   43  C   UNK A   0       3.650   0.986   1.304  1.00  0.00           C  
ATOM     44  H   PHE A   1       6.208  -0.243   1.476  1.00  0.00           H  
ATOM     45  HA  PHE A   1       7.186  -0.385  -1.272  1.00  0.00           H  
ATOM     46  HB1 PHE A   1       8.620  -0.165   1.412  1.00  0.00           H  
ATOM     47  HB2 PHE A   1       9.430  -0.126  -0.173  1.00  0.00           H  
ATOM     48  HD1 PHE A   1       9.132   1.762  -1.674  1.00  0.00           H  
ATOM     49  HE1 PHE A   1       8.635   4.165  -1.868  1.00  0.00           H  
ATOM     50  HZ  PHE A   1       7.424   5.322  -0.063  1.00  0.00           H  
ATOM     51  HE2 PHE A   1       6.710   4.075   1.936  1.00  0.00           H  
ATOM     52  HD2 PHE A   1       7.200   1.670   2.127  1.00  0.00           H  
ATOM     53  HXT PHE A   1       8.991  -3.552  -0.868  1.00  0.00           H  
HETATM   54  H   UNK A   0       3.672  -1.143   1.630  1.00  0.00           H  
HETATM   55  H   UNK A   0       1.122  -0.312   1.369  1.00  0.00           H  
HETATM   56  H   UNK A   0       0.265  -0.478  -1.418  1.00  0.00           H  
HETATM   57  H   UNK A   0      -2.419  -0.659  -1.262  1.00  0.00           H  
HETATM   58  H   UNK A   0      -3.401   0.651   1.156  1.00  0.00           H  
HETATM   59  H   UNK A   0      -5.922   0.975   0.920  1.00  0.00           H  
HETATM   60  H   UNK A   0      -7.113  -0.737  -1.124  1.00  0.00           H  
HETATM   61  H   UNK A   0      -9.247  -0.158  -0.002  1.00  0.00           H  
HETATM   62  H   UNK A   0      -7.416   2.265  -0.295  1.00  0.00           H  
HETATM   63  H   UNK A   0      -8.183   1.409  -1.653  1.00  0.00           H  
HETATM   64  H   UNK A   0     -10.419   1.888  -0.693  1.00  0.00           H  
HETATM   65  H   UNK A   0      -9.652   2.744   0.666  1.00  0.00           H  
HETATM   66  H   UNK A   0     -10.281   4.239  -1.087  1.00  0.00           H  
HETATM   67  H   UNK A   0      -7.564   1.228   1.915  1.00  0.00           H  
HETATM   68  H   UNK A   0      -7.094  -1.499   1.831  1.00  0.00           H  
HETATM   69  H   UNK A   0      -8.128  -2.260   0.598  1.00  0.00           H  
HETATM   70  H   UNK A   0      -5.082  -2.144   0.471  1.00  0.00           H  
HETATM   71  H   UNK A   0      -6.957  -4.436   1.210  1.00  0.00           H  
HETATM   72  H   UNK A   0      -5.192  -4.559   1.021  1.00  0.00           H  
HETATM   73  H   UNK A   0      -5.879  -3.574   2.334  1.00  0.00           H  
HETATM   74  H   UNK A   0      -6.223  -2.269  -1.726  1.00  0.00           H  
HETATM   75  H   UNK A   0      -5.393  -3.797  -1.350  1.00  0.00           H  
HETATM   76  H   UNK A   0      -7.158  -3.674  -1.161  1.00  0.00           H  
HETATM   77  H   UNK A   0      -3.399   2.039  -1.561  1.00  0.00           H  
HETATM   78  H   UNK A   0      -5.426   2.398  -0.408  1.00  0.00           H  
HETATM   79  H   UNK A   0      -1.295   2.255  -0.266  1.00  0.00           H  
HETATM   80  H   UNK A   0      -2.171   3.803  -0.324  1.00  0.00           H  
HETATM   81  H   UNK A   0      -2.222   2.806   1.149  1.00  0.00           H  
HETATM   82  H   UNK A   0      -1.084  -2.497  -1.100  1.00  0.00           H  
HETATM   83  H   UNK A   0       1.789  -2.901  -0.152  1.00  0.00           H  
HETATM   84  H   UNK A   0       0.740  -4.158  -0.850  1.00  0.00           H  
HETATM   85  H   UNK A   0       1.264  -2.780  -1.848  1.00  0.00           H  
HETATM   86  H   UNK A   0       0.033  -2.573   1.579  1.00  0.00           H  
HETATM   87  H   UNK A   0       2.746   1.142   1.892  1.00  0.00           H  
HETATM   88  H   UNK A   0       4.525   1.166   1.930  1.00  0.00           H  
HETATM   89  H   UNK A   0       3.659   1.676   0.461  1.00  0.00           H  
CONECT    1   14   14    2   15                                       
CONECT    2    1    3   44                                            
CONECT    3    2    4   11   45                                       
CONECT    4    3    5   46   47                                       
CONECT    5    4    6    6   10                                       
CONECT    6    5    5    7   48                                       
CONECT    7    6    8    8   49                                       
CONECT    8    7    7    9   50                                       
CONECT    9    8   10   10   51                                       
CONECT   10    5    9    9   52                                       
CONECT   11    3   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   53                                                 
CONECT   14    1    1                                                 
CONECT   15    1   43   16   54                                       
CONECT   16   15   42   42   17                                       
CONECT   17   16   18   55                                            
CONECT   18   17   39   19   56                                       
CONECT   19   18   38   38   20                                       
CONECT   20   19   21   57                                            
CONECT   21   20   35   22   58                                       
CONECT   22   21   34   34   23                                       
CONECT   23   22   24   59                                            
CONECT   24   23   30   25   60                                       
CONECT   25   24   29   26   61                                       
CONECT   26   25   27   62   63                                       
CONECT   27   26   28   64   65                                       
CONECT   28   27   66                                                 
CONECT   29   25   67                                                 
CONECT   30   24   31   68   69                                       
CONECT   31   30   32   33   70                                       
CONECT   32   31   71   72   73                                       
CONECT   33   31   74   75   76                                       
CONECT   34   22   22                                                 
CONECT   35   21   37   36   77                                       
CONECT   36   35   78                                                 
CONECT   37   35   79   80   81                                       
CONECT   38   19   19                                                 
CONECT   39   18   41   40   82                                       
CONECT   40   39   83   84   85                                       
CONECT   41   39   86                                                 
CONECT   42   16   16                                                 
CONECT   43   15   87   88   89                                       
CONECT   44    2                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    4                                                      
CONECT   48    6                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   13                                                      
CONECT   54   15                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   30                                                      
CONECT   70   31                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   32                                                      
CONECT   74   33                                                      
CONECT   75   33                                                      
CONECT   76   33                                                      
CONECT   77   35                                                      
CONECT   78   36                                                      
CONECT   79   37                                                      
CONECT   80   37                                                      
CONECT   81   37                                                      
CONECT   82   39                                                      
CONECT   83   40                                                      
CONECT   84   40                                                      
CONECT   85   40                                                      
CONECT   86   41                                                      
CONECT   87   43                                                      
CONECT   88   43                                                      
CONECT   89   43                                                      
MASTER        0    0    0    0    0    0    0    0   89    0   89    0
END
