COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.891  -2.055   0.002  1.00  0.00           O  
HETATM    2  C   UNL     1       3.131  -0.864   0.001  1.00  0.00           C  
HETATM    3  O   UNL     1       4.408  -0.435  -0.005  1.00  0.00           O  
HETATM    4  S   UNL     1      -2.326  -1.413   0.001  1.00  0.00           S  
HETATM    5  C   UNL     1      -3.993  -0.855   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.022   0.481  -0.001  1.00  0.00           C  
HETATM    7  C   UNL     1       2.023   0.113  -0.001  1.00  0.00           C  
HETATM    8  C   UNL     1       0.695  -0.321   0.000  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.315   0.646  -0.001  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.738   0.244  -0.001  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.786   1.092  -0.001  1.00  0.00           C  
HETATM   12  C   UNL     1       2.288   1.485   0.004  1.00  0.00           C  
HETATM   13  N   UNL     1       1.306   2.362   0.003  1.00  0.00           N  
HETATM   14  C   UNL     1       0.041   1.996  -0.002  1.00  0.00           C  
HETATM   15  H   UNL     1       5.099  -1.112  -0.007  1.00  0.00           H  
HETATM   16  H   UNL     1      -4.863  -1.496   0.001  1.00  0.00           H  
HETATM   17  H   UNL     1      -4.946   1.040  -0.001  1.00  0.00           H  
HETATM   18  H   UNL     1       0.454  -1.374   0.000  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.666   2.165  -0.002  1.00  0.00           H  
HETATM   20  H   UNL     1       3.312   1.830   0.008  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.732   2.750  -0.004  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    7    3                                       
CONECT    3    2   15                                                 
CONECT    4    5   10                                                 
CONECT    5    4    6    6   16                                       
CONECT    6    5    5   11   17                                       
CONECT    7    2    8    8   12                                       
CONECT    8    7    7    9   18                                       
CONECT    9    8   10   14   14                                       
CONECT   10    4    9   11   11                                       
CONECT   11    6   10   10   19                                       
CONECT   12    7   13   13   20                                       
CONECT   13   12   12   14                                            
CONECT   14    9    9   13   21                                       
CONECT   15    3                                                      
CONECT   16    5                                                      
CONECT   17    6                                                      
CONECT   18    8                                                      
CONECT   19   11                                                      
CONECT   20   12                                                      
CONECT   21   14                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
