COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.311  -0.188  -0.632  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.206  -0.314  -1.115  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.013  -0.216  -0.259  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.737  -0.361  -0.812  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.150   0.028   1.111  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.027   0.119   1.907  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.768  -0.031   1.353  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.624  -0.268  -0.003  1.00  0.00           C  
HETATM    9  C   UNL     1       0.752  -0.424  -0.597  1.00  0.00           C  
HETATM   10  C   UNL     1       1.501  -1.590   0.079  1.00  0.00           C  
HETATM   11  C   UNL     1       2.978  -1.258   0.133  1.00  0.00           C  
HETATM   12  O   UNL     1       3.887  -1.985  -0.190  1.00  0.00           O  
HETATM   13  C   UNL     1       3.104   0.166   0.669  1.00  0.00           C  
HETATM   14  S   UNL     1       1.775   1.050  -0.234  1.00  0.00           S  
HETATM   15  O   UNL     1       2.296   1.574  -1.448  1.00  0.00           O  
HETATM   16  O   UNL     1       1.077   1.900   0.665  1.00  0.00           O  
HETATM   17  H   UNL     1      -1.623  -0.546  -1.870  1.00  0.00           H  
HETATM   18  H   UNL     1      -4.132   0.145   1.545  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.131   0.307   2.966  1.00  0.00           H  
HETATM   20  H   UNL     1       0.107   0.041   1.982  1.00  0.00           H  
HETATM   21  H   UNL     1       0.685  -0.587  -1.673  1.00  0.00           H  
HETATM   22  H   UNL     1       1.121  -1.732   1.091  1.00  0.00           H  
HETATM   23  H   UNL     1       1.352  -2.504  -0.496  1.00  0.00           H  
HETATM   24  H   UNL     1       2.924   0.192   1.743  1.00  0.00           H  
HETATM   25  H   UNL     1       4.081   0.586   0.428  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.097  -0.502  -2.173  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   26                                       
CONECT    3    2    4    5    5                                       
CONECT    4    3    8    8   17                                       
CONECT    5    3    3    6   18                                       
CONECT    6    5    7    7   19                                       
CONECT    7    6    6    8   20                                       
CONECT    8    4    4    7    9                                       
CONECT    9    8   10   14   21                                       
CONECT   10    9   11   22   23                                       
CONECT   11   10   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   24   25                                       
CONECT   14    9   13   15   15                                       
CONECT   14   16   16                                                 
CONECT   15   14   14                                                 
CONECT   16   14   14                                                 
CONECT   17    4                                                      
CONECT   18    5                                                      
CONECT   19    6                                                      
CONECT   20    7                                                      
CONECT   21    9                                                      
CONECT   22   10                                                      
CONECT   23   10                                                      
CONECT   24   13                                                      
CONECT   25   13                                                      
CONECT   26    2                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
