COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   0      -0.659  -1.441   0.560  1.00  0.00           N  
HETATM    2  N   UNK A   0      -4.159   0.470  -0.175  1.00  0.00           N  
HETATM    3  C   UNK A   0      -0.689  -0.143   0.271  1.00  0.00           C  
HETATM    4  C   UNK A   0      -1.770  -2.152   0.618  1.00  0.00           C  
HETATM    5  C   UNK A   0      -3.092  -0.342   0.099  1.00  0.00           C  
HETATM    6  C   UNK A   0      -3.726   1.748  -0.418  1.00  0.00           C  
HETATM    7  C   UNK A   0      -2.388   1.803  -0.310  1.00  0.00           C  
ATOM      8  C   VAL A   1       2.276  -0.679  -0.801  1.00  0.00           C  
ATOM      9  O   VAL A   1       1.626  -0.600  -1.816  1.00  0.00           O  
ATOM     10  OXT VAL A   1       3.449  -1.330  -0.803  1.00  0.00           O  
ATOM     11  CA  VAL A   1       1.768  -0.046   0.469  1.00  0.00           C  
ATOM     12  CB  VAL A   1       2.772   1.001   0.955  1.00  0.00           C  
ATOM     13  CG2 VAL A   1       4.120   0.329   1.224  1.00  0.00           C  
ATOM     14  CG1 VAL A   1       2.944   2.078  -0.118  1.00  0.00           C  
ATOM     15  N   VAL A   1       0.477   0.598   0.212  1.00  0.00           N  
HETATM   16  C   UNK A   0      -1.935   0.455   0.027  1.00  0.00           C  
HETATM   17  N   UNK A   0      -2.959  -1.633   0.396  1.00  0.00           N  
HETATM   18  H   UNK A   0      -5.085   0.183  -0.195  1.00  0.00           H  
HETATM   19  H   UNK A   0      -1.701  -3.203   0.856  1.00  0.00           H  
HETATM   20  H   UNK A   0      -4.365   2.584  -0.660  1.00  0.00           H  
HETATM   21  H   UNK A   0      -1.767   2.676  -0.448  1.00  0.00           H  
ATOM     22  HXT VAL A   1       3.734  -1.719  -1.641  1.00  0.00           H  
ATOM     23  HA  VAL A   1       1.645  -0.813   1.234  1.00  0.00           H  
ATOM     24  HB  VAL A   1       2.405   1.459   1.873  1.00  0.00           H  
ATOM     25 HG21 VAL A   1       4.487  -0.129   0.305  1.00  0.00           H  
ATOM     26 HG22 VAL A   1       4.835   1.075   1.569  1.00  0.00           H  
ATOM     27 HG23 VAL A   1       3.997  -0.438   1.988  1.00  0.00           H  
ATOM     28 HG11 VAL A   1       1.984   2.557  -0.310  1.00  0.00           H  
ATOM     29 HG12 VAL A   1       3.660   2.824   0.227  1.00  0.00           H  
ATOM     30 HG13 VAL A   1       3.312   1.621  -1.037  1.00  0.00           H  
ATOM     31  H   VAL A   1       0.440   1.544   0.000  1.00  0.00           H  
CONECT    1    3    3    4                                            
CONECT    2    5    6   18                                            
CONECT    3   15    1    1   16                                       
CONECT    4    1   17   17   19                                       
CONECT    5   17    2   16   16                                       
CONECT    6    2    7    7   20                                       
CONECT    7    6    6   16   21                                       
CONECT    8   11    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   22                                                 
CONECT   11   12   15    8   23                                       
CONECT   12   14   13   11   24                                       
CONECT   13   12   25   26   27                                       
CONECT   14   12   28   29   30                                       
CONECT   15   11    3   31                                            
CONECT   16    7    3    5    5                                       
CONECT   17    4    4    5                                            
CONECT   18    2                                                      
CONECT   19    4                                                      
CONECT   20    6                                                      
CONECT   21    7                                                      
CONECT   22   10                                                      
CONECT   23   11                                                      
CONECT   24   12                                                      
CONECT   25   13                                                      
CONECT   26   13                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29   14                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
