COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.586   0.088  -0.141  1.00  0.00           C  
HETATM    2  O   UNL     1       5.707   0.729   0.222  1.00  0.00           O  
HETATM    3  C   UNL     1       3.273   0.437   0.510  1.00  0.00           C  
HETATM    4  O   UNL     1       4.628  -0.767  -0.995  1.00  0.00           O  
HETATM    5  C   UNL     1       2.161  -0.429  -0.085  1.00  0.00           C  
HETATM    6  C   UNL     1       0.828  -0.074   0.577  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.284  -0.940  -0.018  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.617  -0.585   0.644  1.00  0.00           C  
HETATM    9  S   UNL     1      -2.092   1.123   0.189  1.00  0.00           S  
HETATM   10  C   UNL     1      -2.701  -1.550   0.162  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.121  -0.951   0.211  1.00  0.00           C  
HETATM   12  S   UNL     1      -3.941   0.676  -0.635  1.00  0.00           S  
HETATM   13  H   UNL     1       6.524   0.473  -0.227  1.00  0.00           H  
HETATM   14  H   UNL     1       3.340   0.256   1.583  1.00  0.00           H  
HETATM   15  H   UNL     1       3.048   1.489   0.333  1.00  0.00           H  
HETATM   16  H   UNL     1       2.094  -0.247  -1.158  1.00  0.00           H  
HETATM   17  H   UNL     1       2.386  -1.481   0.092  1.00  0.00           H  
HETATM   18  H   UNL     1       0.895  -0.256   1.650  1.00  0.00           H  
HETATM   19  H   UNL     1       0.603   0.978   0.400  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.351  -0.759  -1.091  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.059  -1.992   0.159  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.519  -0.661   1.727  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.480  -1.841  -0.865  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.680  -2.442   0.789  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.824  -1.587  -0.328  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.443  -0.812   1.243  1.00  0.00           H  
CONECT    1    3    4    4    2                                       
CONECT    2    1   13                                                 
CONECT    3    1    5   14   15                                       
CONECT    4    1    1                                                 
CONECT    5    3    6   16   17                                       
CONECT    6    5    7   18   19                                       
CONECT    7    6    8   20   21                                       
CONECT    8    7   10    9   22                                       
CONECT    9    8   12                                                 
CONECT   10    8   11   23   24                                       
CONECT   11   10   12   25   26                                       
CONECT   12    9   11                                                 
CONECT   13    2                                                      
CONECT   14    3                                                      
CONECT   15    3                                                      
CONECT   16    5                                                      
CONECT   17    5                                                      
CONECT   18    6                                                      
CONECT   19    6                                                      
CONECT   20    7                                                      
CONECT   21    7                                                      
CONECT   22    8                                                      
CONECT   23   10                                                      
CONECT   24   10                                                      
CONECT   25   11                                                      
CONECT   26   11                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
