COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.750   0.718   0.000  1.00  0.00           C  
HETATM    2  C   UNL     1       1.459  -0.498  -0.002  1.00  0.00           C  
HETATM    3  C   UNL     1       2.855  -0.486   0.000  1.00  0.00           C  
HETATM    4  C   UNL     1       3.522   0.720   0.003  1.00  0.00           C  
HETATM    5  C   UNL     1       2.821   1.918   0.005  1.00  0.00           C  
HETATM    6  C   UNL     1       1.443   1.927  -0.003  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.941   1.446  -0.004  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.668   1.795  -0.004  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.732   0.686   0.000  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.366  -0.537   0.003  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.642  -1.718   0.007  1.00  0.00           N  
HETATM   12  S   UNL     1      -3.112  -0.299   0.002  1.00  0.00           S  
HETATM   13  C   UNL     1       0.699  -1.753  -0.004  1.00  0.00           C  
HETATM   14  O   UNL     1       1.283  -2.822  -0.006  1.00  0.00           O  
HETATM   15  H   UNL     1       0.904   2.863  -0.006  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.348   2.827  -0.007  1.00  0.00           H  
HETATM   17  H   UNL     1      -3.767   2.142  -0.006  1.00  0.00           H  
HETATM   18  H   UNL     1       3.361   2.854   0.007  1.00  0.00           H  
HETATM   19  H   UNL     1       4.602   0.733   0.004  1.00  0.00           H  
HETATM   20  H   UNL     1       3.408  -1.413  -0.001  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.127  -2.558   0.009  1.00  0.00           H  
CONECT    1    9    6    2    2                                       
CONECT    2    1    1    3   13                                       
CONECT    3    4    4    2   20                                       
CONECT    4    5    3    3   19                                       
CONECT    5    6    6    4   18                                       
CONECT    6    1    5    5   15                                       
CONECT    7    8    8   12   17                                       
CONECT    8    9    7    7   16                                       
CONECT    9    1    8   10   10                                       
CONECT   10    9    9   11   12                                       
CONECT   11   13   10   21                                            
CONECT   12    7   10                                                 
CONECT   13    2   14   14   11                                       
CONECT   14   13   13                                                 
CONECT   15    6                                                      
CONECT   16    8                                                      
CONECT   17    7                                                      
CONECT   18    5                                                      
CONECT   19    4                                                      
CONECT   20    3                                                      
CONECT   21   11                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
