COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.383   0.400   0.265  1.00  0.00           C  
HETATM    2  O   UNL     1       4.419   1.552  -0.122  1.00  0.00           O  
HETATM    3  C   UNL     1      -2.747   1.008  -0.071  1.00  0.00           C  
HETATM    4  S   UNL     1      -4.060  -0.135   0.438  1.00  0.00           S  
HETATM    5  C   UNL     1      -5.574   0.746  -0.034  1.00  0.00           C  
HETATM    6  C   UNL     1       1.125   0.966   0.003  1.00  0.00           C  
HETATM    7  C   UNL     1       2.899  -0.259   0.463  1.00  0.00           C  
HETATM    8  C   UNL     1       0.311  -2.167  -0.422  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.292   1.350  -0.159  1.00  0.00           C  
HETATM   10  C   UNL     1       3.292   1.116   0.004  1.00  0.00           C  
HETATM   11  C   UNL     1       0.684  -1.387   0.812  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.596   2.499  -0.663  1.00  0.00           N  
HETATM   13  N   UNL     1       2.140   1.760  -0.247  1.00  0.00           N  
HETATM   14  N   UNL     1       1.548  -0.264   0.438  1.00  0.00           N  
HETATM   15  O   UNL     1       3.635  -1.165   0.792  1.00  0.00           O  
HETATM   16  O   UNL     1       0.724  -1.819  -1.503  1.00  0.00           O  
HETATM   17  H   UNL     1      -1.317   0.227   1.339  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.267  -0.546  -0.264  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.863   1.954   0.457  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.813   1.181  -1.145  1.00  0.00           H  
HETATM   21  H   UNL     1      -5.620   1.698   0.493  1.00  0.00           H  
HETATM   22  H   UNL     1      -5.569   0.925  -1.109  1.00  0.00           H  
HETATM   23  H   UNL     1      -6.442   0.142   0.229  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.219  -1.008   1.290  1.00  0.00           H  
HETATM   25  H   UNL     1       1.216  -2.038   1.507  1.00  0.00           H  
HETATM   26  H   UNL     1       0.102   3.080  -1.003  1.00  0.00           H  
HETATM   27  O   UNL     1      -0.479  -3.247  -0.320  1.00  0.00           O  
HETATM   28  H   UNL     1      -0.691  -3.714  -1.140  1.00  0.00           H  
CONECT    1    3    9   17   18                                       
CONECT    2   10   10                                                 
CONECT    3    4    1   19   20                                       
CONECT    4    5    3                                                 
CONECT    5    4   21   22   23                                       
CONECT    6   13   13    9   14                                       
CONECT    7   10   14   15   15                                       
CONECT    8   11   16   16   27                                       
CONECT    9    1    6   12   12                                       
CONECT   10    2    2   13    7                                       
CONECT   11   14    8   24   25                                       
CONECT   12    9    9   26                                            
CONECT   13   10    6    6                                            
CONECT   14    6    7   11                                            
CONECT   15    7    7                                                 
CONECT   16    8    8                                                 
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    3                                                      
CONECT   20    3                                                      
CONECT   21    5                                                      
CONECT   22    5                                                      
CONECT   23    5                                                      
CONECT   24   11                                                      
CONECT   25   11                                                      
CONECT   26   12                                                      
CONECT   27    8   28                                                 
CONECT   28   27                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
