COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.182   1.490   0.604  1.00  0.00           N  
HETATM    2  CA  UNL     1       2.717   0.136   0.407  1.00  0.00           C  
HETATM    3  C   UNL     1       1.986  -0.536  -0.757  1.00  0.00           C  
HETATM    4  C   UNL     1       0.535  -0.728  -0.396  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.006  -1.837   0.129  1.00  0.00           N1+
HETATM    6  C   UNL     1      -1.284  -1.648   0.313  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.599  -0.399  -0.094  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.444   0.186  -0.538  1.00  0.00           C  
HETATM    9  C   UNL     1       4.189   0.217   0.096  1.00  0.00           C  
HETATM   10  OXT UNL     1       4.665   1.251  -0.310  1.00  0.00           O  
HETATM   11  O   UNL     1      -3.091   1.325  -1.038  1.00  0.00           O  
HETATM   12  S   UNL     1      -3.101   0.297  -0.057  1.00  0.00           S  
HETATM   13  O   UNL     1      -4.038  -0.771  -0.060  1.00  0.00           O  
HETATM   14  O   UNL     1      -3.244   0.989   1.291  1.00  0.00           O  
HETATM   15  O   UNL     1       4.972  -0.859   0.269  1.00  0.00           O  
HETATM   16  H1  UNL     1       2.307   2.053  -0.225  1.00  0.00           H  
HETATM   17  H2  UNL     1       1.212   1.460   0.877  1.00  0.00           H  
HETATM   18  HA  UNL     1       2.569  -0.448   1.315  1.00  0.00           H  
HETATM   19  H   UNL     1       2.059   0.093  -1.644  1.00  0.00           H  
HETATM   20  H   UNL     1       2.441  -1.505  -0.961  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.338   1.187  -0.929  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.094   1.432   1.417  1.00  0.00           H  
HETATM   23  H   UNL     1       5.910  -0.759   0.056  1.00  0.00           H  
HETATM   24  H   UNL     1       0.477  -2.652   0.339  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.975  -2.370   0.722  1.00  0.00           H  
CONECT    1    2   16   17                                            
CONECT    2    1    3   18    9                                       
CONECT    3    2    4   19   20                                       
CONECT    4    3    8    8    5                                       
CONECT    5    4    6    6   24                                       
CONECT    6    5    5    7   25                                       
CONECT    7    6   12    8                                            
CONECT    8    4    4    7   21                                       
CONECT    9    2   15   10   10                                       
CONECT   10    9    9                                                 
CONECT   11   12   12                                                 
CONECT   12    7   11   11   14                                       
CONECT   12   13   13                                                 
CONECT   13   12   12                                                 
CONECT   14   12   22                                                 
CONECT   15    9   23                                                 
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    3                                                      
CONECT   20    3                                                      
CONECT   21    8                                                      
CONECT   22   14                                                      
CONECT   23   15                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
