COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.919  -0.458  -0.032  1.00  0.00           C  
HETATM    2  O   UNL     1       4.924  -1.673  -0.043  1.00  0.00           O  
HETATM    3  C   UNL     1       3.637   0.275  -0.005  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.067  -1.857   0.000  1.00  0.00           C  
HETATM    5  C   UNL     1       1.235   1.668   0.045  1.00  0.00           C  
HETATM    6  C   UNL     1       2.432   2.358   0.038  1.00  0.00           C  
HETATM    7  C   UNL     1       3.630   1.672   0.013  1.00  0.00           C  
HETATM    8  C   UNL     1       2.431  -0.424  -0.004  1.00  0.00           C  
HETATM    9  C   UNL     1       1.229   0.274   0.021  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.059  -0.463   0.023  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.264   0.235   0.048  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.459  -0.456   0.049  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.396   0.682  -1.667  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.462  -1.839   0.026  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.268  -2.537  -0.004  1.00  0.00           C  
HETATM   16  O   UNL     1      -4.900  -0.481   0.681  1.00  0.00           O  
HETATM   17  O   UNL     1      -3.662   1.661   0.704  1.00  0.00           O  
HETATM   18  O   UNL     1       6.083   0.219  -0.039  1.00  0.00           O  
HETATM   19  S   UNL     1      -3.985   0.425   0.081  1.00  0.00           S  
HETATM   20  H   UNL     1       0.864  -2.403  -0.020  1.00  0.00           H  
HETATM   21  H   UNL     1       0.302   2.211   0.064  1.00  0.00           H  
HETATM   22  H   UNL     1       2.431   3.438   0.052  1.00  0.00           H  
HETATM   23  H   UNL     1       4.563   2.216   0.009  1.00  0.00           H  
HETATM   24  H   UNL     1       2.431  -1.504  -0.023  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.264   1.315   0.066  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.603   1.257  -2.146  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.494  -0.284  -2.163  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.337   1.227  -1.743  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.399  -2.375   0.027  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.275  -3.617  -0.022  1.00  0.00           H  
HETATM   31  H   UNL     1       6.896  -0.304  -0.057  1.00  0.00           H  
CONECT    1    2    2    3   18                                       
CONECT    2    1    1                                                 
CONECT    3    8    1    7    7                                       
CONECT    4   15   15   10   20                                       
CONECT    5    9    6    6   21                                       
CONECT    6    5    5    7   22                                       
CONECT    7    3    3    6   23                                       
CONECT    8    9    9    3   24                                       
CONECT    9   10    8    8    5                                       
CONECT   10   11   11    4    9                                       
CONECT   11   12   10   10   25                                       
CONECT   12   19   14   14   11                                       
CONECT   13   19   26   27   28                                       
CONECT   14   12   12   15   29                                       
CONECT   15   14    4    4   30                                       
CONECT   16   19   19                                                 
CONECT   17   19   19                                                 
CONECT   18    1   31                                                 
CONECT   19   13   17   17   12                                       
CONECT   19   16   16                                                 
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    6                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25   11                                                      
CONECT   26   13                                                      
CONECT   27   13                                                      
CONECT   28   13                                                      
CONECT   29   14                                                      
CONECT   30   15                                                      
CONECT   31   18                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
