COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNK A   0      -6.386   0.245  -0.365  1.00  0.00           F  
HETATM    2  C   UNK A   0      -5.159   0.729   0.100  1.00  0.00           C  
HETATM    3  F   UNK A   0      -4.947   2.019  -0.397  1.00  0.00           F  
HETATM    4  F   UNK A   0      -5.171   0.763   1.498  1.00  0.00           F  
HETATM    5  C   UNK A   0      -4.034  -0.192  -0.378  1.00  0.00           C  
HETATM    6  F   UNK A   0      -4.246  -1.483   0.119  1.00  0.00           F  
HETATM    7  F   UNK A   0      -4.022  -0.227  -1.776  1.00  0.00           F  
HETATM    8  C   UNK A   0      -2.691   0.336   0.131  1.00  0.00           C  
HETATM    9  F   UNK A   0      -2.480   1.627  -0.366  1.00  0.00           F  
HETATM   10  F   UNK A   0      -2.703   0.371   1.530  1.00  0.00           F  
HETATM   11  C   UNK A   0      -1.567  -0.585  -0.347  1.00  0.00           C  
HETATM   12  F   UNK A   0      -1.778  -1.876   0.150  1.00  0.00           F  
HETATM   13  F   UNK A   0      -1.555  -0.620  -1.745  1.00  0.00           F  
HETATM   14  C   UNK A   0      -0.224  -0.057   0.162  1.00  0.00           C  
HETATM   15  F   UNK A   0      -0.012   1.234  -0.335  1.00  0.00           F  
HETATM   16  F   UNK A   0      -0.236  -0.022   1.561  1.00  0.00           F  
HETATM   17  C   UNK A   0       0.884  -0.964  -0.308  1.00  0.00           C  
HETATM   18  O   UNK A   0       0.734  -1.637  -1.306  1.00  0.00           O  
ATOM     19  N   TRP A   1       2.040  -1.028   0.381  1.00  0.00           N  
ATOM     20  CA  TRP A   1       3.117  -1.910  -0.077  1.00  0.00           C  
ATOM     21  C   TRP A   1       2.889  -3.300   0.458  1.00  0.00           C  
ATOM     22  O   TRP A   1       1.926  -3.531   1.151  1.00  0.00           O  
ATOM     23  OXT TRP A   1       3.756  -4.283   0.166  1.00  0.00           O  
ATOM     24  CB  TRP A   1       4.460  -1.382   0.432  1.00  0.00           C  
ATOM     25  CG  TRP A   1       4.745  -0.044  -0.200  1.00  0.00           C  
ATOM     26  CD2 TRP A   1       4.279   1.261   0.275  1.00  0.00           C  
ATOM     27  CE3 TRP A   1       3.496   1.679   1.353  1.00  0.00           C  
ATOM     28  CZ3 TRP A   1       3.233   3.008   1.526  1.00  0.00           C  
ATOM     29  CH2 TRP A   1       3.737   3.948   0.637  1.00  0.00           C  
ATOM     30  CZ2 TRP A   1       4.512   3.558  -0.433  1.00  0.00           C  
ATOM     31  CE2 TRP A   1       4.792   2.210  -0.628  1.00  0.00           C  
ATOM     32  NE1 TRP A   1       5.514   1.519  -1.576  1.00  0.00           N  
ATOM     33  CD1 TRP A   1       5.479   0.179  -1.301  1.00  0.00           C  
ATOM     34  H   TRP A   1       2.160  -0.491   1.179  1.00  0.00           H  
ATOM     35  HA  TRP A   1       3.126  -1.937  -1.166  1.00  0.00           H  
ATOM     36  HXT TRP A   1       3.568  -5.158   0.532  1.00  0.00           H  
ATOM     37  HB1 TRP A   1       4.420  -1.271   1.516  1.00  0.00           H  
ATOM     38  HB2 TRP A   1       5.250  -2.084   0.168  1.00  0.00           H  
ATOM     39  HE3 TRP A   1       3.100   0.953   2.048  1.00  0.00           H  
ATOM     40  HZ3 TRP A   1       2.628   3.331   2.360  1.00  0.00           H  
ATOM     41  HH2 TRP A   1       3.521   4.995   0.787  1.00  0.00           H  
ATOM     42  HZ2 TRP A   1       4.899   4.297  -1.119  1.00  0.00           H  
ATOM     43  HE1 TRP A   1       5.981   1.923  -2.324  1.00  0.00           H  
ATOM     44  HD1 TRP A   1       5.969  -0.587  -1.885  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    4    1    3    5                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    2    6    7    8                                       
CONECT    6    5                                                      
CONECT    7    5                                                      
CONECT    8    5    9   10   11                                       
CONECT    9    8                                                      
CONECT   10    8                                                      
CONECT   11    8   13   14   12                                       
CONECT   12   11                                                      
CONECT   13   11                                                      
CONECT   14   16   11   17   15                                       
CONECT   15   14                                                      
CONECT   16   14                                                      
CONECT   17   18   18   14   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   34                                            
CONECT   20   19   21   24   35                                       
CONECT   21   20   22   22   23                                       
CONECT   22   21   21                                                 
CONECT   23   21   36                                                 
CONECT   24   20   25   37   38                                       
CONECT   25   24   33   33   26                                       
CONECT   26   25   27   31   31                                       
CONECT   27   26   28   28   39                                       
CONECT   28   27   27   29   40                                       
CONECT   29   28   30   30   41                                       
CONECT   30   31   29   29   42                                       
CONECT   31   26   26   32   30                                       
CONECT   32   33   31   43                                            
CONECT   33   25   25   32   44                                       
CONECT   34   19                                                      
CONECT   35   20                                                      
CONECT   36   23                                                      
CONECT   37   24                                                      
CONECT   38   24                                                      
CONECT   39   27                                                      
CONECT   40   28                                                      
CONECT   41   29                                                      
CONECT   42   30                                                      
CONECT   43   32                                                      
CONECT   44   33                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
