COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.046   0.211   0.293  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.414   0.653  -0.501  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.831   0.619  -0.127  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.689   1.681  -0.176  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.965   1.369   0.231  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.147   0.096   0.601  1.00  0.00           C  
HETATM    7  O   UNL     1       0.054   1.648  -1.024  1.00  0.00           O  
HETATM    8  N   UNL     1       0.371  -0.416  -0.264  1.00  0.00           N  
HETATM    9  C   UNL     1       1.799  -0.362  -0.586  1.00  0.00           C  
HETATM   10  C   UNL     1       2.577   0.155   0.625  1.00  0.00           C  
HETATM   11  O   UNL     1       4.926   0.638   1.212  1.00  0.00           O  
HETATM   12  O   UNL     1       4.432  -0.133  -0.799  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.203  -1.633   0.316  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.851  -2.468  -0.790  1.00  0.00           C  
HETATM   15  S   UNL     1      -2.700  -0.796   0.449  1.00  0.00           S  
HETATM   16  H   UNL     1      -2.395   2.668  -0.502  1.00  0.00           H  
HETATM   17  H   UNL     1      -4.762   2.098   0.251  1.00  0.00           H  
HETATM   18  H   UNL     1      -5.085  -0.313   0.946  1.00  0.00           H  
HETATM   19  H   UNL     1       2.151  -1.361  -0.844  1.00  0.00           H  
HETATM   20  H   UNL     1       1.956   0.308  -1.432  1.00  0.00           H  
HETATM   21  H   UNL     1       2.420  -0.515   1.471  1.00  0.00           H  
HETATM   22  H   UNL     1       2.225   1.154   0.883  1.00  0.00           H  
HETATM   23  H   UNL     1       5.857   0.656   0.953  1.00  0.00           H  
HETATM   24  H   UNL     1       0.585  -2.213   0.797  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.957  -1.362   1.056  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.097  -2.739  -1.529  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.278  -3.373  -0.358  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.638  -1.888  -1.270  1.00  0.00           H  
CONECT    1   12   12   10   11                                       
CONECT    2    8    7    7    3                                       
CONECT    3    2   15    4    4                                       
CONECT    4    3    3    5   16                                       
CONECT    5    4    6    6   17                                       
CONECT    6   15    5    5   18                                       
CONECT    7    2    2                                                 
CONECT    8   13    9    2                                            
CONECT    9   10    8   19   20                                       
CONECT   10    1    9   21   22                                       
CONECT   11    1   23                                                 
CONECT   12    1    1                                                 
CONECT   13   14    8   24   25                                       
CONECT   14   13   26   27   28                                       
CONECT   15    3    6                                                 
CONECT   16    4                                                      
CONECT   17    5                                                      
CONECT   18    6                                                      
CONECT   19    9                                                      
CONECT   20    9                                                      
CONECT   21   10                                                      
CONECT   22   10                                                      
CONECT   23   11                                                      
CONECT   24   13                                                      
CONECT   25   13                                                      
CONECT   26   14                                                      
CONECT   27   14                                                      
CONECT   28   14                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
