COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.722   1.109  -1.053  1.00  0.00           O  
HETATM    2  C   UNL     1       5.328   0.281  -0.073  1.00  0.00           C  
HETATM    3  OXT UNL     1       5.962   0.214   0.953  1.00  0.00           O  
HETATM    4  CA  UNL     1       4.093  -0.564  -0.252  1.00  0.00           C  
HETATM    5  N   UNL     1       4.130  -1.691   0.690  1.00  0.00           N  
HETATM    6  C   UNL     1       2.850   0.285   0.017  1.00  0.00           C  
HETATM    7  C   UNL     1       1.595  -0.536  -0.286  1.00  0.00           C  
HETATM    8  C   UNL     1       0.352   0.313  -0.017  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.850  -0.474  -0.307  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.090   0.082  -0.139  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.201   1.302   0.276  1.00  0.00           N  
HETATM   12  C   UNL     1      -3.326  -0.727  -0.437  1.00  0.00           C  
HETATM   13  S   UNL     1      -4.800   0.280  -0.118  1.00  0.00           S  
HETATM   14  O   UNL     1      -4.858   0.612   1.263  1.00  0.00           O  
HETATM   15  C   UNL     1      -6.161  -0.847  -0.527  1.00  0.00           C  
HETATM   16  H   UNL     1       6.520   1.631  -0.892  1.00  0.00           H  
HETATM   17  HA  UNL     1       4.059  -0.946  -1.273  1.00  0.00           H  
HETATM   18  H1  UNL     1       4.162  -1.363   1.644  1.00  0.00           H  
HETATM   19  H2  UNL     1       3.345  -2.308   0.546  1.00  0.00           H  
HETATM   20  H   UNL     1       2.839   0.593   1.062  1.00  0.00           H  
HETATM   21  H   UNL     1       2.868   1.169  -0.622  1.00  0.00           H  
HETATM   22  H   UNL     1       1.606  -0.844  -1.332  1.00  0.00           H  
HETATM   23  H   UNL     1       1.577  -1.420   0.352  1.00  0.00           H  
HETATM   24  H   UNL     1       0.341   0.621   1.028  1.00  0.00           H  
HETATM   25  H   UNL     1       0.370   1.196  -0.656  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.079   1.696   0.396  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.315  -1.035  -1.482  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.344  -1.610   0.202  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.080  -1.152  -1.570  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.109  -1.727   0.114  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.113  -0.340  -0.370  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.767  -1.389  -0.618  1.00  0.00           H  
CONECT    1    2   16                                                 
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5    6   17                                       
CONECT    5    4   18   19                                            
CONECT    6    4    7   20   21                                       
CONECT    7    6    8   22   23                                       
CONECT    8    7    9   24   25                                       
CONECT    9    8   10   32                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10   26                                            
CONECT   12   10   13   27   28                                       
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   30   31   29                                       
CONECT   16    1                                                      
CONECT   17    4                                                      
CONECT   18    5                                                      
CONECT   19    5                                                      
CONECT   20    6                                                      
CONECT   21    6                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25    8                                                      
CONECT   26   11                                                      
CONECT   27   12                                                      
CONECT   28   12                                                      
CONECT   29   15                                                      
CONECT   30   15                                                      
CONECT   31   15                                                      
CONECT   32    9                                                      
MASTER        0    0    0    0    0    0    0    0   32    0   32    0
END
