COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.912   2.641   0.378  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.611  -0.203   0.068  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.321  -0.470  -1.043  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.530   0.256  -0.940  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.486   0.923   0.227  1.00  0.00           C  
HETATM    6  C   UNL     1       3.334   1.235   0.035  1.00  0.00           C  
HETATM    7  C   UNL     1       4.664   0.872   0.121  1.00  0.00           C  
HETATM    8  C   UNL     1       5.052  -0.417  -0.194  1.00  0.00           C  
HETATM    9  C   UNL     1       4.110  -1.347  -0.595  1.00  0.00           C  
HETATM   10  C   UNL     1       2.779  -0.991  -0.682  1.00  0.00           C  
HETATM   11  C   UNL     1       2.385   0.302  -0.361  1.00  0.00           C  
HETATM   12  C   UNL     1       0.087  -0.159   0.044  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.248  -0.757   0.397  1.00  0.00           C  
HETATM   14  N   UNL     1       1.037   0.664  -0.443  1.00  0.00           N  
HETATM   15  N   UNL     1      -1.216   0.137  -0.132  1.00  0.00           N  
HETATM   16  O   UNL     1      -4.319   0.646   0.831  1.00  0.00           O  
HETATM   17  S   UNL     1       0.536  -1.579   0.887  1.00  0.00           S  
HETATM   18  H   UNL     1       2.950   3.260  -0.518  1.00  0.00           H  
HETATM   19  H   UNL     1       1.895   2.630   0.769  1.00  0.00           H  
HETATM   20  H   UNL     1       3.586   3.049   1.130  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.024  -1.115  -1.857  1.00  0.00           H  
HETATM   22  H   UNL     1      -6.334   0.272  -1.661  1.00  0.00           H  
HETATM   23  H   UNL     1      -6.255   1.577   0.610  1.00  0.00           H  
HETATM   24  H   UNL     1       5.402   1.597   0.433  1.00  0.00           H  
HETATM   25  H   UNL     1       6.093  -0.698  -0.126  1.00  0.00           H  
HETATM   26  H   UNL     1       4.417  -2.353  -0.840  1.00  0.00           H  
HETATM   27  H   UNL     1       2.044  -1.718  -0.996  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.140  -0.836   1.479  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.139  -1.744  -0.052  1.00  0.00           H  
HETATM   30  H   UNL     1       0.785   1.508  -0.850  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.470   0.942  -0.609  1.00  0.00           H  
CONECT    1    6   18   19   20                                       
CONECT    2   16    3    3   13                                       
CONECT    3    4    2    2   21                                       
CONECT    4    5    5    3   22                                       
CONECT    5   16    4    4   23                                       
CONECT    6    1   11   11    7                                       
CONECT    7    6    8    8   24                                       
CONECT    8    7    7    9   25                                       
CONECT    9   10   10    8   26                                       
CONECT   10   11    9    9   27                                       
CONECT   11   14    6    6   10                                       
CONECT   12   15   17   17   14                                       
CONECT   13    2   15   28   29                                       
CONECT   14   12   11   30                                            
CONECT   15   13   12   31                                            
CONECT   16    5    2                                                 
CONECT   17   12   12                                                 
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    1                                                      
CONECT   21    3                                                      
CONECT   22    4                                                      
CONECT   23    5                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    9                                                      
CONECT   27   10                                                      
CONECT   28   13                                                      
CONECT   29   13                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
