COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      10.377   1.291   0.187  1.00  0.00           C  
HETATM    2  C   UNK A   0       7.910   1.530   0.112  1.00  0.00           C  
HETATM    3  C   UNK A   0       9.317   2.925  -1.378  1.00  0.00           C  
HETATM    4  C   UNK A   0       9.169   1.554  -0.715  1.00  0.00           C  
HETATM    5  N   UNK A   0       9.095   0.515  -1.750  1.00  0.00           N  
HETATM    6  O   UNK A   0       7.959   1.777   1.299  1.00  0.00           O  
HETATM    7  C   UNK A   0      10.309   0.509  -2.578  1.00  0.00           C  
HETATM    8  N   UNK A   0       6.729   1.234  -0.466  1.00  0.00           N  
HETATM    9  C   UNK A   0       5.505   1.210   0.338  1.00  0.00           C  
HETATM   10  C   UNK A   0       4.492   0.305  -0.315  1.00  0.00           C  
HETATM   11  O   UNK A   0       4.319   0.354  -1.515  1.00  0.00           O  
HETATM   12  C   UNK A   0       4.933   2.626   0.439  1.00  0.00           C  
HETATM   13  C   UNK A   0       3.682   2.609   1.319  1.00  0.00           C  
HETATM   14  C   UNK A   0       5.979   3.555   1.057  1.00  0.00           C  
HETATM   15  N   UNK A   0       3.779  -0.560   0.434  1.00  0.00           N  
HETATM   16  C   UNK A   0       1.458  -1.329   0.384  1.00  0.00           C  
HETATM   17  C   UNK A   0       3.342  -2.931   0.026  1.00  0.00           C  
HETATM   18  C   UNK A   0       2.858  -1.499  -0.210  1.00  0.00           C  
HETATM   19  C   UNK A   0       0.435  -2.028  -0.513  1.00  0.00           C  
HETATM   20  C   UNK A   0      -0.943  -1.495  -0.214  1.00  0.00           C  
HETATM   21  O   UNK A   0       1.421  -1.908   1.690  1.00  0.00           O  
HETATM   22  O   UNK A   0      -1.080  -0.567   0.555  1.00  0.00           O  
HETATM   23  C   UNK A   0       4.802  -3.055  -0.414  1.00  0.00           C  
HETATM   24  C   UNK A   0       5.714  -2.508   0.686  1.00  0.00           C  
HETATM   25  C   UNK A   0       2.480  -3.901  -0.785  1.00  0.00           C  
HETATM   26  C   UNK A   0       3.925  -0.560   1.891  1.00  0.00           C  
HETATM   27  C   UNK A   0       0.474  -1.300   2.569  1.00  0.00           C  
HETATM   28  C   UNK A   0      -3.303  -3.025  -2.575  1.00  0.00           C  
HETATM   29  C   UNK A   0      -5.712  -1.700   2.482  1.00  0.00           C  
HETATM   30  C   UNK A   0      -5.242  -1.318   1.077  1.00  0.00           C  
HETATM   31  C   UNK A   0      -3.122  -3.438   2.487  1.00  0.00           C  
HETATM   32  C   UNK A   0      -5.285   0.181   0.923  1.00  0.00           C  
HETATM   33  N   UNK A   0      -2.022  -2.049  -0.802  1.00  0.00           N  
HETATM   34  C   UNK A   0      -3.417  -1.629  -0.601  1.00  0.00           C  
HETATM   35  C   UNK A   0      -4.298  -2.526  -1.494  1.00  0.00           C  
HETATM   36  C   UNK A   0      -1.999  -3.175  -1.753  1.00  0.00           C  
HETATM   37  C   UNK A   0      -3.809  -1.810   0.867  1.00  0.00           C  
HETATM   38  O   UNK A   0      -3.725  -3.194   1.215  1.00  0.00           O  
HETATM   39  O   UNK A   0      -4.253   0.817   0.889  1.00  0.00           O  
ATOM     40  N   PHE A   1      -6.471   0.814   0.823  1.00  0.00           N  
ATOM     41  CA  PHE A   1      -6.514   2.270   0.673  1.00  0.00           C  
ATOM     42  C   PHE A   1      -6.446   2.917   2.033  1.00  0.00           C  
ATOM     43  O   PHE A   1      -6.371   2.232   3.025  1.00  0.00           O  
ATOM     44  CB  PHE A   1      -7.816   2.674  -0.020  1.00  0.00           C  
ATOM     45  CG  PHE A   1      -7.828   2.128  -1.425  1.00  0.00           C  
ATOM     46  CD2 PHE A   1      -8.354   0.875  -1.675  1.00  0.00           C  
ATOM     47  CD1 PHE A   1      -7.318   2.884  -2.464  1.00  0.00           C  
ATOM     48  CE2 PHE A   1      -8.365   0.374  -2.963  1.00  0.00           C  
ATOM     49  CE1 PHE A   1      -7.329   2.383  -3.753  1.00  0.00           C  
ATOM     50  CZ  PHE A   1      -7.849   1.127  -4.002  1.00  0.00           C  
ATOM     51  OXT PHE A   1      -6.470   4.255   2.141  1.00  0.00           O  
HETATM   52  H   UNK A   0      10.271   0.315   0.660  1.00  0.00           H  
HETATM   53  H   UNK A   0      11.288   1.309  -0.411  1.00  0.00           H  
HETATM   54  H   UNK A   0      10.432   2.063   0.955  1.00  0.00           H  
HETATM   55  H   UNK A   0       9.372   3.697  -0.610  1.00  0.00           H  
HETATM   56  H   UNK A   0      10.228   2.943  -1.977  1.00  0.00           H  
HETATM   57  H   UNK A   0       8.457   3.112  -2.021  1.00  0.00           H  
HETATM   58  H   UNK A   0       8.933  -0.393  -1.340  1.00  0.00           H  
HETATM   59  H   UNK A   0      10.228  -0.270  -3.336  1.00  0.00           H  
HETATM   60  H   UNK A   0      10.422   1.478  -3.063  1.00  0.00           H  
HETATM   61  H   UNK A   0      11.177   0.314  -1.948  1.00  0.00           H  
HETATM   62  H   UNK A   0       6.690   1.036  -1.415  1.00  0.00           H  
HETATM   63  H   UNK A   0       5.733   0.838   1.337  1.00  0.00           H  
HETATM   64  H   UNK A   0       4.672   2.984  -0.557  1.00  0.00           H  
HETATM   65  H   UNK A   0       3.923   2.166   2.285  1.00  0.00           H  
HETATM   66  H   UNK A   0       3.327   3.629   1.465  1.00  0.00           H  
HETATM   67  H   UNK A   0       2.904   2.020   0.834  1.00  0.00           H  
HETATM   68  H   UNK A   0       6.871   3.567   0.430  1.00  0.00           H  
HETATM   69  H   UNK A   0       5.572   4.564   1.129  1.00  0.00           H  
HETATM   70  H   UNK A   0       6.241   3.197   2.053  1.00  0.00           H  
HETATM   71  H   UNK A   0       1.218  -0.268   0.451  1.00  0.00           H  
HETATM   72  H   UNK A   0       3.260  -3.172   1.086  1.00  0.00           H  
HETATM   73  H   UNK A   0       2.824  -1.299  -1.281  1.00  0.00           H  
HETATM   74  H   UNK A   0       0.679  -1.839  -1.558  1.00  0.00           H  
HETATM   75  H   UNK A   0       0.458  -3.101  -0.323  1.00  0.00           H  
HETATM   76  H   UNK A   0       5.039  -4.104  -0.594  1.00  0.00           H  
HETATM   77  H   UNK A   0       4.955  -2.485  -1.330  1.00  0.00           H  
HETATM   78  H   UNK A   0       6.722  -2.900   0.550  1.00  0.00           H  
HETATM   79  H   UNK A   0       5.737  -1.420   0.631  1.00  0.00           H  
HETATM   80  H   UNK A   0       5.333  -2.815   1.660  1.00  0.00           H  
HETATM   81  H   UNK A   0       3.024  -4.834  -0.932  1.00  0.00           H  
HETATM   82  H   UNK A   0       1.554  -4.102  -0.247  1.00  0.00           H  
HETATM   83  H   UNK A   0       2.249  -3.459  -1.754  1.00  0.00           H  
HETATM   84  H   UNK A   0       3.289   0.214   2.320  1.00  0.00           H  
HETATM   85  H   UNK A   0       3.631  -1.532   2.286  1.00  0.00           H  
HETATM   86  H   UNK A   0       4.965  -0.361   2.152  1.00  0.00           H  
HETATM   87  H   UNK A   0       0.519  -1.786   3.544  1.00  0.00           H  
HETATM   88  H   UNK A   0       0.708  -0.241   2.680  1.00  0.00           H  
HETATM   89  H   UNK A   0      -0.529  -1.409   2.155  1.00  0.00           H  
HETATM   90  H   UNK A   0      -3.619  -3.985  -2.984  1.00  0.00           H  
HETATM   91  H   UNK A   0      -3.183  -2.286  -3.367  1.00  0.00           H  
HETATM   92  H   UNK A   0      -6.685  -1.249   2.675  1.00  0.00           H  
HETATM   93  H   UNK A   0      -5.793  -2.784   2.556  1.00  0.00           H  
HETATM   94  H   UNK A   0      -4.992  -1.339   3.217  1.00  0.00           H  
HETATM   95  H   UNK A   0      -5.896  -1.778   0.337  1.00  0.00           H  
HETATM   96  H   UNK A   0      -3.647  -2.867   3.253  1.00  0.00           H  
HETATM   97  H   UNK A   0      -3.184  -4.501   2.721  1.00  0.00           H  
HETATM   98  H   UNK A   0      -2.076  -3.132   2.459  1.00  0.00           H  
HETATM   99  H   UNK A   0      -3.535  -0.584  -0.889  1.00  0.00           H  
HETATM  100  H   UNK A   0      -5.103  -1.948  -1.948  1.00  0.00           H  
HETATM  101  H   UNK A   0      -4.699  -3.364  -0.923  1.00  0.00           H  
HETATM  102  H   UNK A   0      -1.996  -4.124  -1.217  1.00  0.00           H  
HETATM  103  H   UNK A   0      -1.129  -3.103  -2.405  1.00  0.00           H  
HETATM  104  H   UNK A   0      -3.131  -1.235   1.498  1.00  0.00           H  
ATOM    105  H   PHE A   1      -7.296   0.305   0.850  1.00  0.00           H  
ATOM    106  HA  PHE A   1      -5.665   2.599   0.072  1.00  0.00           H  
ATOM    107  HB1 PHE A   1      -8.663   2.269   0.534  1.00  0.00           H  
ATOM    108  HB2 PHE A   1      -7.889   3.761  -0.052  1.00  0.00           H  
ATOM    109  HD2 PHE A   1      -8.756   0.286  -0.863  1.00  0.00           H  
ATOM    110  HD1 PHE A   1      -6.911   3.865  -2.269  1.00  0.00           H  
ATOM    111  HE2 PHE A   1      -8.775  -0.605  -3.159  1.00  0.00           H  
ATOM    112  HE1 PHE A   1      -6.930   2.974  -4.564  1.00  0.00           H  
ATOM    113  HZ  PHE A   1      -7.858   0.736  -5.008  1.00  0.00           H  
ATOM    114  HXT PHE A   1      -6.425   4.624   3.034  1.00  0.00           H  
CONECT    1    4   52   53   54                                       
CONECT    2    6    6    8    4                                       
CONECT    3    4   55   56   57                                       
CONECT    4    2    5    1    3                                       
CONECT    5    4    7   58                                            
CONECT    6    2    2                                                 
CONECT    7    5   59   60   61                                       
CONECT    8    9    2   62                                            
CONECT    9   12   10    8   63                                       
CONECT   10   15    9   11   11                                       
CONECT   11   10   10                                                 
CONECT   12   14    9   13   64                                       
CONECT   13   12   65   66   67                                       
CONECT   14   12   68   69   70                                       
CONECT   15   18   26   10                                            
CONECT   16   19   21   18   71                                       
CONECT   17   25   18   23   72                                       
CONECT   18   16   17   15   73                                       
CONECT   19   20   16   74   75                                       
CONECT   20   33   22   22   19                                       
CONECT   21   16   27                                                 
CONECT   22   20   20                                                 
CONECT   23   17   24   76   77                                       
CONECT   24   23   78   79   80                                       
CONECT   25   17   81   82   83                                       
CONECT   26   15   84   85   86                                       
CONECT   27   21   87   88   89                                       
CONECT   28   35   36   90   91                                       
CONECT   29   30   92   93   94                                       
CONECT   30   32   29   37   95                                       
CONECT   31   38   96   97   98                                       
CONECT   32   40   39   39   30                                       
CONECT   33   34   36   20                                            
CONECT   34   35   37   33   99                                       
CONECT   35   28   34  100  101                                       
CONECT   36   28   33  102  103                                       
CONECT   37   30   34   38  104                                       
CONECT   38   31   37                                                 
CONECT   39   32   32                                                 
CONECT   40   41   32  105                                            
CONECT   41   44   42   40  106                                       
CONECT   42   43   43   51   41                                       
CONECT   43   42   42                                                 
CONECT   44   45   41  107  108                                       
CONECT   45   44   47   47   46                                       
CONECT   46   45   48   48  109                                       
CONECT   47   45   45   49  110                                       
CONECT   48   46   46   50  111                                       
CONECT   49   47   50   50  112                                       
CONECT   50   49   49   48  113                                       
CONECT   51   42  114                                                 
CONECT   52    1                                                      
CONECT   53    1                                                      
CONECT   54    1                                                      
CONECT   55    3                                                      
CONECT   56    3                                                      
CONECT   57    3                                                      
CONECT   58    5                                                      
CONECT   59    7                                                      
CONECT   60    7                                                      
CONECT   61    7                                                      
CONECT   62    8                                                      
CONECT   63    9                                                      
CONECT   64   12                                                      
CONECT   65   13                                                      
CONECT   66   13                                                      
CONECT   67   13                                                      
CONECT   68   14                                                      
CONECT   69   14                                                      
CONECT   70   14                                                      
CONECT   71   16                                                      
CONECT   72   17                                                      
CONECT   73   18                                                      
CONECT   74   19                                                      
CONECT   75   19                                                      
CONECT   76   23                                                      
CONECT   77   23                                                      
CONECT   78   24                                                      
CONECT   79   24                                                      
CONECT   80   24                                                      
CONECT   81   25                                                      
CONECT   82   25                                                      
CONECT   83   25                                                      
CONECT   84   26                                                      
CONECT   85   26                                                      
CONECT   86   26                                                      
CONECT   87   27                                                      
CONECT   88   27                                                      
CONECT   89   27                                                      
CONECT   90   28                                                      
CONECT   91   28                                                      
CONECT   92   29                                                      
CONECT   93   29                                                      
CONECT   94   29                                                      
CONECT   95   30                                                      
CONECT   96   31                                                      
CONECT   97   31                                                      
CONECT   98   31                                                      
CONECT   99   34                                                      
CONECT  100   35                                                      
CONECT  101   35                                                      
CONECT  102   36                                                      
CONECT  103   36                                                      
CONECT  104   37                                                      
CONECT  105   40                                                      
CONECT  106   41                                                      
CONECT  107   44                                                      
CONECT  108   44                                                      
CONECT  109   46                                                      
CONECT  110   47                                                      
CONECT  111   48                                                      
CONECT  112   49                                                      
CONECT  113   50                                                      
CONECT  114   51                                                      
MASTER        0    0    0    0    0    0    0    0  114    0  114    0
END
