COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.560  -1.991  -0.768  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.128  -1.383   0.450  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.883  -0.083   0.649  1.00  0.00           C  
HETATM    4  N   UNL     1      -4.741   0.791  -0.499  1.00  0.00           N  
HETATM    5  C   UNL     1      -3.616   1.471  -0.803  1.00  0.00           C  
HETATM    6  N   UNL     1      -2.418   1.067  -0.637  1.00  0.00           N  
HETATM    7  C   UNL     1      -1.970  -0.089  -0.096  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.643  -1.160   0.388  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.738  -2.055   0.832  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.535  -1.599   0.637  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.622  -0.377   0.055  1.00  0.00           N  
HETATM   12  C   UNL     1       0.499   0.479  -0.341  1.00  0.00           C  
HETATM   13  C   UNL     1       0.822   1.506   0.774  1.00  0.00           C  
HETATM   14  O   UNL     1       0.011   2.675   0.641  1.00  0.00           O  
HETATM   15  O   UNL     1       1.714  -0.293  -0.450  1.00  0.00           O  
HETATM   16  C   UNL     1       2.810   0.630  -0.331  1.00  0.00           C  
HETATM   17  C   UNL     1       2.310   1.831   0.495  1.00  0.00           C  
HETATM   18  O   UNL     1       2.425   3.039  -0.259  1.00  0.00           O  
HETATM   19  C   UNL     1       3.982  -0.043   0.386  1.00  0.00           C  
HETATM   20  S   UNL     1       4.643  -1.375  -0.653  1.00  0.00           S  
HETATM   21  C   UNL     1       5.999  -2.040   0.351  1.00  0.00           C  
HETATM   22  H   UNL     1      -5.510  -2.167  -0.805  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.352  -2.053   1.281  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.939  -0.303   0.800  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.495   0.424   1.533  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.505   0.893  -1.088  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.743   2.455  -1.229  1.00  0.00           H  
HETATM   28  H   UNL     1       0.381  -2.109   0.896  1.00  0.00           H  
HETATM   29  H   UNL     1       0.279   0.988  -1.280  1.00  0.00           H  
HETATM   30  H   UNL     1       0.700   1.060   1.761  1.00  0.00           H  
HETATM   31  H   UNL     1       0.176   3.348   1.316  1.00  0.00           H  
HETATM   32  H   UNL     1       3.122   0.965  -1.321  1.00  0.00           H  
HETATM   33  H   UNL     1       2.865   1.909   1.429  1.00  0.00           H  
HETATM   34  H   UNL     1       2.071   3.819   0.190  1.00  0.00           H  
HETATM   35  H   UNL     1       4.763   0.693   0.575  1.00  0.00           H  
HETATM   36  H   UNL     1       3.637  -0.458   1.334  1.00  0.00           H  
HETATM   37  H   UNL     1       6.478  -2.861  -0.184  1.00  0.00           H  
HETATM   38  H   UNL     1       6.731  -1.254   0.540  1.00  0.00           H  
HETATM   39  H   UNL     1       5.605  -2.405   1.299  1.00  0.00           H  
CONECT    1    2   22                                                 
CONECT    2    1    3    8   23                                       
CONECT    3    2    4   24   25                                       
CONECT    4    3    5   26                                            
CONECT    5    4    6    6   27                                       
CONECT    6    5    5    7                                            
CONECT    7    6    8    8   11                                       
CONECT    8    2    7    7    9                                       
CONECT    9    8   10   10                                            
CONECT   10    9    9   11   28                                       
CONECT   11    7   10   12                                            
CONECT   12   11   15   13   29                                       
CONECT   13   12   17   14   30                                       
CONECT   14   13   31                                                 
CONECT   15   12   16                                                 
CONECT   16   15   19   17   32                                       
CONECT   17   13   16   18   33                                       
CONECT   18   17   34                                                 
CONECT   19   16   20   35   36                                       
CONECT   20   19   21                                                 
CONECT   21   20   37   38   39                                       
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28   10                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   14                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
CONECT   37   21                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
