COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.409  -1.171  -0.453  1.00  0.00           O  
HETATM    2  S   UNL     1       5.002   0.047   0.154  1.00  0.00           S  
HETATM    3  O   UNL     1       5.800   0.107   1.448  1.00  0.00           O  
HETATM    4  O   UNL     1       5.255   1.298  -0.472  1.00  0.00           O  
HETATM    5  C   UNL     1       3.273  -0.056   0.693  1.00  0.00           C  
HETATM    6  C   UNL     1       2.360  -0.123  -0.533  1.00  0.00           C  
HETATM    7  N   UNL     1       0.960  -0.207  -0.096  1.00  0.00           N  
HETATM    8  C   UNL     1       0.052  -0.272  -1.249  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.372  -0.357  -0.763  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.099   0.799  -0.549  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.405   0.723  -0.103  1.00  0.00           C  
HETATM   12 CL   UNL     1      -4.318   2.176   0.164  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -3.987  -0.516   0.130  1.00  0.00           C  
HETATM   14  O   UNL     1      -5.271  -0.593   0.568  1.00  0.00           O  
HETATM   15  C   UNL     1      -5.804  -1.901   0.787  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.255  -1.674  -0.085  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.952  -1.593  -0.536  1.00  0.00           C  
HETATM   18  H   UNL     1       3.134  -0.952   1.298  1.00  0.00           H  
HETATM   19  H   UNL     1       3.023   0.824   1.285  1.00  0.00           H  
HETATM   20  H   UNL     1       2.498   0.773  -1.138  1.00  0.00           H  
HETATM   21  H   UNL     1       2.609  -1.003  -1.124  1.00  0.00           H  
HETATM   22  H   UNL     1       0.722   0.566   0.508  1.00  0.00           H  
HETATM   23  H   UNL     1       0.174   0.623  -1.859  1.00  0.00           H  
HETATM   24  H   UNL     1       0.285  -1.154  -1.846  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.645   1.762  -0.730  1.00  0.00           H  
HETATM   26  H   UNL     1      -6.834  -1.820   1.134  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.778  -2.464  -0.146  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.206  -2.416   1.539  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.705  -2.639   0.095  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.382  -2.494  -0.704  1.00  0.00           H  
HETATM   31  H   UNL     1       6.757   0.166   1.318  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    5    1    1    4                                       
CONECT    2    4    3                                                 
CONECT    3    2   31                                                 
CONECT    4    2    2                                                 
CONECT    5    6    2   18   19                                       
CONECT    6    7    5   20   21                                       
CONECT    7    8    6   22                                            
CONECT    8    9    7   23   24                                       
CONECT    9   10   10   17    8                                       
CONECT   10   11    9    9   25                                       
CONECT   11   12   13   13   10                                       
CONECT   12   11                                                      
CONECT   13   14   11   11   16                                       
CONECT   14   15   13                                                 
CONECT   15   14   26   27   28                                       
CONECT   16   13   17   17   29                                       
CONECT   17   16   16    9   30                                       
CONECT   18    5                                                      
CONECT   19    5                                                      
CONECT   20    6                                                      
CONECT   21    6                                                      
CONECT   22    7                                                      
CONECT   23    8                                                      
CONECT   24    8                                                      
CONECT   25   10                                                      
CONECT   26   15                                                      
CONECT   27   15                                                      
CONECT   28   15                                                      
CONECT   29   16                                                      
CONECT   30   17                                                      
CONECT   31    3                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
