COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.689   2.710  -0.721  1.00  0.00           C  
HETATM    2  C   UNL     1       2.497   0.541  -0.174  1.00  0.00           C  
HETATM    3  C   UNL     1       3.518  -0.351   0.154  1.00  0.00           C  
HETATM    4  C   UNL     1       3.231  -1.690   0.381  1.00  0.00           C  
HETATM    5  C   UNL     1       1.934  -2.146   0.282  1.00  0.00           C  
HETATM    6  C   UNL     1       0.903  -1.258  -0.047  1.00  0.00           C  
HETATM    7  C   UNL     1       1.195   0.093  -0.274  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.479  -1.741  -0.153  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.513  -0.869  -0.041  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.201   1.090   0.280  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.940  -1.127  -0.266  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.731  -0.083  -0.083  1.00  0.00           N  
HETATM   13  O   UNL     1       2.783   1.853  -0.389  1.00  0.00           O  
HETATM   14  O   UNL     1       4.799   0.093   0.252  1.00  0.00           O  
HETATM   15  O   UNL     1      -3.806   2.126   0.482  1.00  0.00           O  
HETATM   16  O   UNL     1      -3.363  -2.219  -0.597  1.00  0.00           O  
HETATM   17  S   UNL     1      -1.452   0.845   0.418  1.00  0.00           S  
HETATM   18  H   UNL     1       1.218   2.358  -1.639  1.00  0.00           H  
HETATM   19  H   UNL     1       0.960   2.698   0.089  1.00  0.00           H  
HETATM   20  H   UNL     1       2.055   3.726  -0.866  1.00  0.00           H  
HETATM   21  H   UNL     1       4.025  -2.376   0.634  1.00  0.00           H  
HETATM   22  H   UNL     1       1.713  -3.188   0.458  1.00  0.00           H  
HETATM   23  H   UNL     1       0.403   0.783  -0.528  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.673  -2.790  -0.321  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.689  -0.167  -0.215  1.00  0.00           H  
HETATM   26  H   UNL     1       5.044   0.393   1.138  1.00  0.00           H  
CONECT    1   13   18   19   20                                       
CONECT    2   13    7    7    3                                       
CONECT    3    2   14    4    4                                       
CONECT    4    3    3    5   21                                       
CONECT    5    6    6    4   22                                       
CONECT    6    7    8    5    5                                       
CONECT    7    2    2    6   23                                       
CONECT    8    9    9    6   24                                       
CONECT    9   17   11    8    8                                       
CONECT   10   15   15   12   17                                       
CONECT   11   12    9   16   16                                       
CONECT   12   10   11   25                                            
CONECT   13    1    2                                                 
CONECT   14    3   26                                                 
CONECT   15   10   10                                                 
CONECT   16   11   11                                                 
CONECT   17   10    9                                                 
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    1                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25   12                                                      
CONECT   26   14                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
