COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  OXT PHE A   1      -4.742  -1.787   2.558  1.00  0.00           O  
ATOM      2  C   PHE A   1      -3.952  -1.819   1.473  1.00  0.00           C  
ATOM      3  O   PHE A   1      -3.651  -2.878   0.976  1.00  0.00           O  
ATOM      4  CA  PHE A   1      -3.442  -0.533   0.874  1.00  0.00           C  
ATOM      5  CB  PHE A   1      -4.627   0.335   0.444  1.00  0.00           C  
ATOM      6  CG  PHE A   1      -4.123   1.669  -0.041  1.00  0.00           C  
ATOM      7  CD1 PHE A   1      -3.970   2.716   0.850  1.00  0.00           C  
ATOM      8  CE1 PHE A   1      -3.507   3.940   0.405  1.00  0.00           C  
ATOM      9  CZ  PHE A   1      -3.197   4.118  -0.930  1.00  0.00           C  
ATOM     10  CE2 PHE A   1      -3.348   3.071  -1.821  1.00  0.00           C  
ATOM     11  CD2 PHE A   1      -3.807   1.846  -1.375  1.00  0.00           C  
ATOM     12  N   PHE A   1      -2.609  -0.834  -0.293  1.00  0.00           N  
HETATM   13  C   UNK A   0      -1.303  -1.126  -0.131  1.00  0.00           C  
HETATM   14  O   UNK A   0      -0.818  -1.139   0.981  1.00  0.00           O  
HETATM   15  C   UNK A   0      -0.446  -1.436  -1.331  1.00  0.00           C  
HETATM   16  C   UNK A   0      -0.666  -2.899  -1.769  1.00  0.00           C  
HETATM   17  C   UNK A   0       0.758  -3.356  -2.182  1.00  0.00           C  
HETATM   18  C   UNK A   0       1.637  -2.599  -1.156  1.00  0.00           C  
HETATM   19  N   UNK A   0       0.975  -1.290  -0.982  1.00  0.00           N  
HETATM   20  C   UNK A   0       1.573  -0.155  -0.570  1.00  0.00           C  
HETATM   21  O   UNK A   0       0.927   0.868  -0.463  1.00  0.00           O  
HETATM   22  O   UNK A   0       2.888  -0.155  -0.278  1.00  0.00           O  
HETATM   23  C   UNK A   0       3.466   1.103   0.159  1.00  0.00           C  
HETATM   24  C   UNK A   0       4.934   0.911   0.439  1.00  0.00           C  
HETATM   25  C   UNK A   0       5.354   0.539   1.702  1.00  0.00           C  
HETATM   26  C   UNK A   0       6.701   0.363   1.959  1.00  0.00           C  
HETATM   27  C   UNK A   0       5.860   1.101  -0.569  1.00  0.00           C  
HETATM   28  C   UNK A   0       7.207   0.925  -0.312  1.00  0.00           C  
HETATM   29  C   UNK A   0       7.628   0.558   0.952  1.00  0.00           C  
ATOM     30  HXT PHE A   1      -5.044  -2.637   2.906  1.00  0.00           H  
ATOM     31  HA  PHE A   1      -2.850   0.003   1.615  1.00  0.00           H  
ATOM     32  HB1 PHE A   1      -5.169  -0.163  -0.360  1.00  0.00           H  
ATOM     33  HB2 PHE A   1      -5.294   0.485   1.293  1.00  0.00           H  
ATOM     34  HD1 PHE A   1      -4.213   2.577   1.893  1.00  0.00           H  
ATOM     35  HE1 PHE A   1      -3.389   4.758   1.101  1.00  0.00           H  
ATOM     36  HZ  PHE A   1      -2.836   5.074  -1.278  1.00  0.00           H  
ATOM     37  HE2 PHE A   1      -3.106   3.210  -2.864  1.00  0.00           H  
ATOM     38  HD2 PHE A   1      -3.922   1.027  -2.070  1.00  0.00           H  
ATOM     39  H   PHE A   1      -2.997  -0.824  -1.181  1.00  0.00           H  
HETATM   40  H   UNK A   0      -0.698  -0.762  -2.150  1.00  0.00           H  
HETATM   41  H   UNK A   0      -1.038  -3.499  -0.938  1.00  0.00           H  
HETATM   42  H   UNK A   0      -1.351  -2.949  -2.616  1.00  0.00           H  
HETATM   43  H   UNK A   0       0.869  -4.435  -2.072  1.00  0.00           H  
HETATM   44  H   UNK A   0       0.989  -3.043  -3.201  1.00  0.00           H  
HETATM   45  H   UNK A   0       1.666  -3.140  -0.209  1.00  0.00           H  
HETATM   46  H   UNK A   0       2.645  -2.463  -1.547  1.00  0.00           H  
HETATM   47  H   UNK A   0       3.340   1.852  -0.623  1.00  0.00           H  
HETATM   48  H   UNK A   0       2.964   1.438   1.067  1.00  0.00           H  
HETATM   49  H   UNK A   0       4.630   0.386   2.489  1.00  0.00           H  
HETATM   50  H   UNK A   0       7.029   0.073   2.947  1.00  0.00           H  
HETATM   51  H   UNK A   0       5.532   1.387  -1.557  1.00  0.00           H  
HETATM   52  H   UNK A   0       7.931   1.074  -1.100  1.00  0.00           H  
HETATM   53  H   UNK A   0       8.680   0.421   1.153  1.00  0.00           H  
CONECT    1    2   30                                                 
CONECT    2    3    3    4    1                                       
CONECT    3    2    2                                                 
CONECT    4   12    2    5   31                                       
CONECT    5    4    6   32   33                                       
CONECT    6    7    5   11   11                                       
CONECT    7    8    8    6   34                                       
CONECT    8    7    7    9   35                                       
CONECT    9    8   10   10   36                                       
CONECT   10    9    9   11   37                                       
CONECT   11    6    6   10   38                                       
CONECT   12   13    4   39                                            
CONECT   13   15   12   14   14                                       
CONECT   14   13   13                                                 
CONECT   15   19   16   13   40                                       
CONECT   16   17   15   41   42                                       
CONECT   17   18   16   43   44                                       
CONECT   18   17   19   45   46                                       
CONECT   19   18   20   15                                            
CONECT   20   22   19   21   21                                       
CONECT   21   20   20                                                 
CONECT   22   23   20                                                 
CONECT   23   24   22   47   48                                       
CONECT   24   25   23   27   27                                       
CONECT   25   26   26   24   49                                       
CONECT   26   25   25   29   50                                       
CONECT   27   24   24   28   51                                       
CONECT   28   29   29   27   52                                       
CONECT   29   26   28   28   53                                       
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
