COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.936   0.427  -0.439  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.818   0.215   0.793  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.514   0.055  -0.108  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.514   0.996  -0.214  1.00  0.00           C  
HETATM    5  N   UNL     1       3.054  -1.545  -0.821  1.00  0.00           N  
HETATM    6  C   UNL     1      -1.199   0.651   0.091  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.889  -0.649   0.506  1.00  0.00           C  
HETATM    8  C   UNL     1       1.182   0.226   0.590  1.00  0.00           C  
HETATM    9  C   UNL     1       2.670   0.226   0.826  1.00  0.00           C  
HETATM   10  CA  UNL     1       3.391  -0.160  -0.467  1.00  0.00           C  
HETATM   11  C   UNL     1       4.880  -0.042  -0.266  1.00  0.00           C  
HETATM   12  S   UNL     1       0.293   1.586   0.066  1.00  0.00           S  
HETATM   13  N   UNL     1       0.426  -0.793   0.756  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.933  -1.590   0.605  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.213  -1.235   0.307  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.440  -0.453  -1.584  1.00  0.00           C  
HETATM   17  O   UNL     1       5.541  -1.029  -0.044  1.00  0.00           O  
HETATM   18  H   UNL     1      -4.977   1.474  -0.739  1.00  0.00           H  
HETATM   19  H   UNL     1      -5.777  -0.832   1.094  1.00  0.00           H  
HETATM   20  H   UNL     1      -5.459   0.842   1.610  1.00  0.00           H  
HETATM   21  H   UNL     1      -6.847   0.484   0.554  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.749   2.000  -0.534  1.00  0.00           H  
HETATM   23  H1  UNL     1       3.467  -1.803  -1.705  1.00  0.00           H  
HETATM   24  H   UNL     1       2.989   1.221   1.136  1.00  0.00           H  
HETATM   25  H   UNL     1       2.914  -0.494   1.607  1.00  0.00           H  
HETATM   26  HA  UNL     1       3.079   0.507  -1.271  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.716  -2.600   0.922  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.003  -1.967   0.388  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.469  -0.184  -1.823  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.812  -0.302  -2.462  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.399  -1.500  -1.284  1.00  0.00           H  
HETATM   32  OXT UNL     1       5.473   1.161  -0.334  1.00  0.00           O  
HETATM   33  HXT UNL     1       6.430   1.187  -0.199  1.00  0.00           H  
HETATM   34  H2  UNL     1       3.334  -2.184  -0.092  1.00  0.00           H  
CONECT    1    3    2   16   18                                       
CONECT    2    1   19   20   21                                       
CONECT    3   15   15    4    1                                       
CONECT    4    6    6    3   22                                       
CONECT    5   10   23   34                                            
CONECT    6    7   12    4    4                                       
CONECT    7   13   14   14    6                                       
CONECT    8    9   13   13   12                                       
CONECT    9   10    8   24   25                                       
CONECT   10   11    5    9   26                                       
CONECT   11   10   17   17   32                                       
CONECT   12    8    6                                                 
CONECT   13    8    8    7                                            
CONECT   14    7    7   15   27                                       
CONECT   15   14    3    3   28                                       
CONECT   16    1   29   30   31                                       
CONECT   17   11   11                                                 
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    2                                                      
CONECT   21    2                                                      
CONECT   22    4                                                      
CONECT   23    5                                                      
CONECT   24    9                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   14                                                      
CONECT   28   15                                                      
CONECT   29   16                                                      
CONECT   30   16                                                      
CONECT   31   16                                                      
CONECT   32   11   33                                                 
CONECT   33   32                                                      
CONECT   34    5                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
