COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.418   0.396  -0.042  1.00  0.00           C  
HETATM    2  C   UNL     1       2.195  -2.363   0.078  1.00  0.00           C  
HETATM    3  C   UNL     1       1.172  -0.193   0.084  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.312   1.263   0.434  1.00  0.00           C  
HETATM    5  S   UNL     1      -2.599  -0.348   0.004  1.00  0.00           S  
HETATM    6  O   UNL     1      -2.280  -1.081   1.179  1.00  0.00           O  
HETATM    7  O   UNL     1      -3.326  -0.948  -1.059  1.00  0.00           O  
HETATM    8  N   UNL     1      -1.128   0.016  -0.663  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.085   0.637   0.158  1.00  0.00           C  
HETATM   10  C   UNL     1       0.199   2.049  -0.360  1.00  0.00           C  
HETATM   11  C   UNL     1       1.478   2.561   0.313  1.00  0.00           C  
HETATM   12  O   UNL     1       2.570   1.744  -0.112  1.00  0.00           O  
HETATM   13  C   UNL     1       3.555  -0.404  -0.105  1.00  0.00           C  
HETATM   14  C   UNL     1       3.441  -1.778  -0.045  1.00  0.00           C  
HETATM   15  C   UNL     1       1.064  -1.572   0.145  1.00  0.00           C  
HETATM   16  H   UNL     1       2.105  -3.438   0.125  1.00  0.00           H  
HETATM   17  H   UNL     1      -4.294   1.118   0.884  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.659   1.773   1.142  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.413   1.868  -0.468  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.956  -0.181  -1.597  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.423   0.692   1.193  1.00  0.00           H  
HETATM   22  H   UNL     1       0.338   2.022  -1.441  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.635   2.705  -0.113  1.00  0.00           H  
HETATM   24  H   UNL     1       1.658   3.595   0.021  1.00  0.00           H  
HETATM   25  H   UNL     1       1.373   2.499   1.396  1.00  0.00           H  
HETATM   26  H   UNL     1       4.529   0.052  -0.200  1.00  0.00           H  
HETATM   27  H   UNL     1       4.326  -2.396  -0.094  1.00  0.00           H  
HETATM   28  H   UNL     1       0.092  -2.032   0.241  1.00  0.00           H  
CONECT    1   12   13   13    3                                       
CONECT    2   14   14   15   16                                       
CONECT    3    1    9   15   15                                       
CONECT    4    5   17   18   19                                       
CONECT    5    8    4    7    7                                       
CONECT    5    6    6                                                 
CONECT    6    5    5                                                 
CONECT    7    5    5                                                 
CONECT    8    9    5   20                                            
CONECT    9   10    3    8   21                                       
CONECT   10   11    9   22   23                                       
CONECT   11   12   10   24   25                                       
CONECT   12   11    1                                                 
CONECT   13    1    1   14   26                                       
CONECT   14   13    2    2   27                                       
CONECT   15    3    3    2   28                                       
CONECT   16    2                                                      
CONECT   17    4                                                      
CONECT   18    4                                                      
CONECT   19    4                                                      
CONECT   20    8                                                      
CONECT   21    9                                                      
CONECT   22   10                                                      
CONECT   23   10                                                      
CONECT   24   11                                                      
CONECT   25   11                                                      
CONECT   26   13                                                      
CONECT   27   14                                                      
CONECT   28   15                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
