COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.083  -2.514  -0.387  1.00  0.00           O  
HETATM    2  S   UNL     1      -2.838  -1.312  -0.458  1.00  0.00           S  
HETATM    3  O   UNL     1      -3.469  -0.861  -1.648  1.00  0.00           O  
HETATM    4  N   UNL     1      -4.030  -1.440   0.684  1.00  0.00           N  
HETATM    5  C   UNL     1      -1.760  -0.017   0.056  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.450  -0.301   0.394  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.222   1.286   0.115  1.00  0.00           C  
HETATM    8 CL   UNL     1      -3.865   1.644  -0.316  1.00  0.00          Cl  
HETATM    9  C   UNL     1      -1.375   2.302   0.519  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.067   2.016   0.862  1.00  0.00           C  
HETATM   11  C   UNL     1       0.396   0.715   0.797  1.00  0.00           C  
HETATM   12  C   UNL     1       1.824   0.405   1.166  1.00  0.00           C  
HETATM   13  O   UNL     1       2.246   1.244   2.243  1.00  0.00           O  
HETATM   14  C   UNL     1       2.723   0.603  -0.029  1.00  0.00           C  
HETATM   15  C   UNL     1       3.020   1.693  -0.814  1.00  0.00           C  
HETATM   16  C   UNL     1       3.908   1.564  -1.869  1.00  0.00           C  
HETATM   17  C   UNL     1       4.497   0.341  -2.137  1.00  0.00           C  
HETATM   18  C   UNL     1       4.205  -0.759  -1.356  1.00  0.00           C  
HETATM   19  C   UNL     1       3.312  -0.636  -0.290  1.00  0.00           C  
HETATM   20  C   UNL     1       2.811  -1.605   0.703  1.00  0.00           C  
HETATM   21  O   UNL     1       3.130  -2.777   0.753  1.00  0.00           O  
HETATM   22  N   UNL     1       1.951  -1.006   1.547  1.00  0.00           N  
HETATM   23  H   UNL     1      -4.028  -0.851   1.455  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.730  -2.104   0.583  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.088  -1.317   0.343  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.735   3.319   0.565  1.00  0.00           H  
HETATM   27  H   UNL     1       0.595   2.810   1.177  1.00  0.00           H  
HETATM   28  H   UNL     1       1.714   1.152   3.045  1.00  0.00           H  
HETATM   29  H   UNL     1       2.562   2.649  -0.608  1.00  0.00           H  
HETATM   30  H   UNL     1       4.141   2.420  -2.485  1.00  0.00           H  
HETATM   31  H   UNL     1       5.188   0.246  -2.961  1.00  0.00           H  
HETATM   32  H   UNL     1       4.667  -1.712  -1.568  1.00  0.00           H  
HETATM   33  H   UNL     1       1.490  -1.436   2.285  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    3                                       
CONECT    2    4    5                                                 
CONECT    3    2    2                                                 
CONECT    4    2   23   24                                            
CONECT    5    2    6    6    7                                       
CONECT    6    5    5   11   25                                       
CONECT    7    5    8    9    9                                       
CONECT    8    7                                                      
CONECT    9    7    7   10   26                                       
CONECT   10    9   11   11   27                                       
CONECT   11    6   10   10   12                                       
CONECT   12   11   13   14   22                                       
CONECT   13   12   28                                                 
CONECT   14   12   15   15   19                                       
CONECT   15   14   14   16   29                                       
CONECT   16   15   17   17   30                                       
CONECT   17   16   16   18   31                                       
CONECT   18   17   19   19   32                                       
CONECT   19   14   18   18   20                                       
CONECT   20   19   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   12   20   33                                            
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    6                                                      
CONECT   26    9                                                      
CONECT   27   10                                                      
CONECT   28   13                                                      
CONECT   29   15                                                      
CONECT   30   16                                                      
CONECT   31   17                                                      
CONECT   32   18                                                      
CONECT   33   22                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
