COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.144  -1.789   0.316  1.00  0.00           N  
HETATM    2  CA  UNL     1       1.036  -2.137   1.066  1.00  0.00           C  
HETATM    3  C   UNL     1       1.484  -0.975   1.962  1.00  0.00           C  
HETATM    4  C   UNL     1       2.940  -1.060   2.353  1.00  0.00           C  
HETATM    5  C   UNL     1       3.295  -1.737   3.508  1.00  0.00           C  
HETATM    6  C   UNL     1       4.640  -1.816   3.869  1.00  0.00           C  
HETATM    7  C   UNL     1       3.895  -0.458   1.549  1.00  0.00           C  
HETATM    8  C   UNL     1       5.240  -0.536   1.909  1.00  0.00           C  
HETATM    9  C   UNL     1       5.612  -1.215   3.070  1.00  0.00           C  
HETATM   10  C   UNL     1       7.051  -1.300   3.455  1.00  0.00           C  
HETATM   11  S   UNL     1       7.726  -2.751   2.714  1.00  0.00           S  
HETATM   12  O   UNL     1       7.592  -2.650   1.272  1.00  0.00           O  
HETATM   13  O   UNL     1       7.249  -3.914   3.440  1.00  0.00           O  
HETATM   14  O   UNL     1       9.286  -2.488   3.114  1.00  0.00           O  
HETATM   15  C   UNL     1       0.803  -3.383   1.908  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.276  -3.645   2.428  1.00  0.00           O  
HETATM   17  OXT UNL     1       1.882  -4.192   2.036  1.00  0.00           O  
HETATM   18  H1  UNL     1      -0.247  -2.138  -0.622  1.00  0.00           H  
HETATM   19  H2  UNL     1      -0.738  -1.051   0.655  1.00  0.00           H  
HETATM   20  HA  UNL     1       1.804  -2.390   0.327  1.00  0.00           H  
HETATM   21  H   UNL     1       1.324  -0.015   1.454  1.00  0.00           H  
HETATM   22  H   UNL     1       0.860  -0.931   2.865  1.00  0.00           H  
HETATM   23  H   UNL     1       2.544  -2.209   4.137  1.00  0.00           H  
HETATM   24  H   UNL     1       4.921  -2.346   4.775  1.00  0.00           H  
HETATM   25  H   UNL     1       3.614   0.073   0.643  1.00  0.00           H  
HETATM   26  H   UNL     1       5.991  -0.066   1.281  1.00  0.00           H  
HETATM   27  H   UNL     1       7.187  -1.381   4.539  1.00  0.00           H  
HETATM   28  H   UNL     1       7.628  -0.439   3.099  1.00  0.00           H  
HETATM   29  H   UNL     1       9.729  -1.753   2.628  1.00  0.00           H  
HETATM   30  HXT UNL     1       1.731  -4.998   2.574  1.00  0.00           H  
CONECT    1    2   18   19                                            
CONECT    2    1    3   15   20                                       
CONECT    3    2    4   21   22                                       
CONECT    4    3    5    5    7                                       
CONECT    5    4    4    6   23                                       
CONECT    6    5    9    9   24                                       
CONECT    7    4    8    8   25                                       
CONECT    8    7    7    9   26                                       
CONECT    9    6    6    8   10                                       
CONECT   10    9   11   27   28                                       
CONECT   11   10   12   12   13                                       
CONECT   11   13   14                                                 
CONECT   12   11   11                                                 
CONECT   13   11   11                                                 
CONECT   14   11   29                                                 
CONECT   15    2   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   30                                                 
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    2                                                      
CONECT   21    3                                                      
CONECT   22    3                                                      
CONECT   23    5                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    8                                                      
CONECT   27   10                                                      
CONECT   28   10                                                      
CONECT   29   14                                                      
CONECT   30   17                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
