COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.122  -0.935  -0.386  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.860  -0.122  -0.251  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.639  -0.765  -0.193  1.00  0.00           C  
HETATM    4  C   UNL     1       0.524   0.000  -0.068  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.087  -0.569   0.743  1.00  0.00           C  
HETATM    6  C   UNL     1       0.396   1.390  -0.007  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.864   1.951  -0.072  1.00  0.00           C  
HETATM    8  C   UNL     1       1.857  -0.646  -0.001  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.936   1.193  -0.196  1.00  0.00           N  
HETATM   10  N   UNL     1       1.955  -1.944  -0.059  1.00  0.00           N  
HETATM   11  S   UNL     1       3.308   0.341   0.157  1.00  0.00           S  
HETATM   12  H   UNL     1      -3.590  -0.722  -1.347  1.00  0.00           H  
HETATM   13  H   UNL     1      -2.879  -1.996  -0.327  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.584  -1.842  -0.243  1.00  0.00           H  
HETATM   15  H   UNL     1      -5.000  -1.157   0.646  1.00  0.00           H  
HETATM   16  H   UNL     1      -3.619  -0.781   1.705  1.00  0.00           H  
HETATM   17  H   UNL     1      -4.330   0.492   0.684  1.00  0.00           H  
HETATM   18  H   UNL     1       1.270   2.017   0.090  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.973   3.024  -0.026  1.00  0.00           H  
HETATM   20  H   UNL     1       2.827  -2.367  -0.015  1.00  0.00           H  
HETATM   21  H   UNL     1       4.290  -0.670   0.179  1.00  0.00           H  
CONECT    1    5    2   12   13                                       
CONECT    2    1    9    9    3                                       
CONECT    3    2    4    4   14                                       
CONECT    4    3    3    6    8                                       
CONECT    5    1   15   16   17                                       
CONECT    6    7    7    4   18                                       
CONECT    7    9    6    6   19                                       
CONECT    8    4   10   10   11                                       
CONECT    9    2    2    7                                            
CONECT   10    8    8   20                                            
CONECT   11    8   21                                                 
CONECT   12    1                                                      
CONECT   13    1                                                      
CONECT   14    3                                                      
CONECT   15    5                                                      
CONECT   16    5                                                      
CONECT   17    5                                                      
CONECT   18    6                                                      
CONECT   19    7                                                      
CONECT   20   10                                                      
CONECT   21   11                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
