COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.327   1.724  -0.003  1.00  0.00           O  
HETATM    2  C   UNL     1       3.153   0.395  -0.073  1.00  0.00           C  
HETATM    3  OXT UNL     1       4.076  -0.349   0.165  1.00  0.00           O  
HETATM    4  CA  UNL     1       1.808  -0.171  -0.449  1.00  0.00           C  
HETATM    5  C   UNL     1       0.888  -0.153   0.773  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.497  -0.584   0.366  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.465   0.319   0.054  1.00  0.00           C  
HETATM    8  S   UNL     1      -2.811  -0.704  -0.326  1.00  0.00           S  
HETATM    9  N   UNL     1      -2.078  -2.225  -0.062  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.854  -1.917   0.300  1.00  0.00           C  
HETATM   11  O   UNL     1       0.045  -2.892   0.599  1.00  0.00           O1-
HETATM   12  C   UNL     1      -1.385   1.823   0.036  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.204   2.261  -0.834  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.186   2.340   1.462  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.682   2.397  -0.538  1.00  0.00           C  
HETATM   16  N   UNL     1       1.971  -1.553  -0.919  1.00  0.00           N1+
HETATM   17  H   UNL     1       4.190   2.086   0.238  1.00  0.00           H  
HETATM   18  HA  UNL     1       1.369   0.434  -1.243  1.00  0.00           H  
HETATM   19  H   UNL     1       0.848   0.856   1.184  1.00  0.00           H  
HETATM   20  H   UNL     1       1.274  -0.838   1.528  1.00  0.00           H  
HETATM   21  H   UNL     1       0.729   1.968  -0.353  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.276   1.783  -1.811  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.226   3.344  -0.957  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.238   3.429   1.465  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.968   1.938   2.107  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.211   2.022   1.832  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.823   2.028  -1.554  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.522   2.085   0.081  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.624   3.485  -0.551  1.00  0.00           H  
HETATM   30  H1  UNL     1       1.070  -1.931  -1.171  1.00  0.00           H  
HETATM   31  H2  UNL     1       2.578  -1.564  -1.726  1.00  0.00           H  
HETATM   32  H3  UNL     1       2.378  -2.112  -0.185  1.00  0.00           H  
CONECT    1    2   17                                                 
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   16   18                                       
CONECT    5    4    6   19   20                                       
CONECT    6    5    7    7   10                                       
CONECT    7    6    6    8   12                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   10                                            
CONECT   10    6    9    9   11                                       
CONECT   11   10                                                      
CONECT   12    7   13   14   15                                       
CONECT   13   12   21   22   23                                       
CONECT   14   12   24   25   26                                       
CONECT   15   12   27   28   29                                       
CONECT   16    4   30   31   32                                       
CONECT   17    1                                                      
CONECT   18    4                                                      
CONECT   19    5                                                      
CONECT   20    5                                                      
CONECT   21   13                                                      
CONECT   22   13                                                      
CONECT   23   13                                                      
CONECT   24   14                                                      
CONECT   25   14                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28   15                                                      
CONECT   29   15                                                      
CONECT   30   16                                                      
CONECT   31   16                                                      
CONECT   32   16                                                      
MASTER        0    0    0    0    0    0    0    0   32    0   32    0
END
