COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.677  -0.756  -0.036  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.128  -0.352  -0.023  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.894  -0.134  -1.107  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.835   0.443  -0.029  1.00  0.00           N  
HETATM    5  C   UNL     1      -6.179   0.222  -0.637  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.121   0.201   0.707  1.00  0.00           C  
HETATM    7  C   UNL     1       0.355   1.456  -0.031  1.00  0.00           C  
HETATM    8  C   UNL     1       1.731   1.331  -0.041  1.00  0.00           C  
HETATM    9  N   UNL     1       4.565  -0.146   1.501  1.00  0.00           N  
HETATM   10  C   UNL     1       2.312   0.076  -0.064  1.00  0.00           C  
HETATM   11  O   UNL     1       4.574   1.139  -0.606  1.00  0.00           O  
HETATM   12  C   UNL     1       1.519  -1.057  -0.077  1.00  0.00           C  
HETATM   13  C   UNL     1       0.143  -0.939  -0.066  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.444   0.320  -0.039  1.00  0.00           C  
HETATM   15  O   UNL     1       4.354  -1.350  -0.642  1.00  0.00           O  
HETATM   16  O   UNL     1      -4.878  -0.153   1.073  1.00  0.00           O  
HETATM   17  S   UNL     1       4.067  -0.079  -0.077  1.00  0.00           S  
HETATM   18  H   UNL     1      -2.459  -1.358   0.846  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.470  -1.339  -0.934  1.00  0.00           H  
HETATM   20  H   UNL     1      -4.587  -0.215  -2.139  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.244   1.322  -0.017  1.00  0.00           H  
HETATM   22  H   UNL     1      -7.041   0.465  -1.240  1.00  0.00           H  
HETATM   23  H   UNL     1      -6.937   0.427   1.378  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.098   2.436  -0.014  1.00  0.00           H  
HETATM   25  H   UNL     1       2.353   2.214  -0.032  1.00  0.00           H  
HETATM   26  H   UNL     1       5.365  -0.642   1.737  1.00  0.00           H  
HETATM   27  H   UNL     1       4.057   0.311   2.190  1.00  0.00           H  
HETATM   28  H   UNL     1       1.977  -2.035  -0.095  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.475  -1.824  -0.076  1.00  0.00           H  
CONECT    1    2    4   18   19                                       
CONECT    2    3    3    1   16                                       
CONECT    3    5    2    2   20                                       
CONECT    4    1   14   21                                            
CONECT    5    3    6    6   22                                       
CONECT    6    5    5   16   23                                       
CONECT    7   14   14    8   24                                       
CONECT    8    7   10   10   25                                       
CONECT    9   17   26   27                                            
CONECT   10    8    8   12   17                                       
CONECT   11   17   17                                                 
CONECT   12   13   13   10   28                                       
CONECT   13   14   12   12   29                                       
CONECT   14    4    7    7   13                                       
CONECT   15   17   17                                                 
CONECT   16    2    6                                                 
CONECT   17   10    9   11   11                                       
CONECT   17   15   15                                                 
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28   12                                                      
CONECT   29   13                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
