COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.684  -0.415   1.576  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.942  -1.842  -0.335  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.124  -2.951  -0.407  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.766  -2.829  -0.183  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.217  -1.589   0.117  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.032  -0.470   0.191  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.400  -0.594  -0.035  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.277   0.601   0.037  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.899   1.857   0.312  1.00  0.00           N  
HETATM   10  N   UNL     1      -3.958   2.593   0.276  1.00  0.00           N  
HETATM   11  N   UNL     1      -4.972   1.853  -0.008  1.00  0.00           N  
HETATM   12  N   UNL     1      -4.580   0.635  -0.164  1.00  0.00           N  
HETATM   13  N   UNL     1       1.159  -1.469   0.344  1.00  0.00           N  
HETATM   14  C   UNL     1       1.813  -0.359  -0.052  1.00  0.00           C  
HETATM   15  O   UNL     1       1.197   0.570  -0.529  1.00  0.00           O  
HETATM   16  C   UNL     1       3.310  -0.273   0.099  1.00  0.00           C  
HETATM   17  C   UNL     1       3.798   1.080  -0.423  1.00  0.00           C  
HETATM   18  S   UNL     1       5.611   1.127  -0.380  1.00  0.00           S  
HETATM   19  H   UNL     1       3.214   0.386   2.148  1.00  0.00           H  
HETATM   20  H   UNL     1       3.336  -1.379   1.947  1.00  0.00           H  
HETATM   21  H   UNL     1       4.766  -0.352   1.684  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.003  -1.941  -0.516  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.546  -3.918  -0.640  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.130  -3.700  -0.240  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.607   0.495   0.425  1.00  0.00           H  
HETATM   26  H   UNL     1       1.642  -2.184   0.787  1.00  0.00           H  
HETATM   27  H   UNL     1       3.780  -1.073  -0.473  1.00  0.00           H  
HETATM   28  H   UNL     1       3.455   1.219  -1.448  1.00  0.00           H  
HETATM   29  H   UNL     1       3.399   1.877   0.205  1.00  0.00           H  
HETATM   30  H   UNL     1       5.893   2.352  -0.857  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.886   2.163  -0.095  1.00  0.00           H  
CONECT    1   16   19   20   21                                       
CONECT    2    3    3    7   22                                       
CONECT    3    4    2    2   23                                       
CONECT    4    5    5    3   24                                       
CONECT    5   13    4    4    6                                       
CONECT    6    5    7    7   25                                       
CONECT    7    6    6    2    8                                       
CONECT    8    7    9   12   12                                       
CONECT    9    8   10   10                                            
CONECT   10    9    9   11                                            
CONECT   11   12   10   31                                            
CONECT   12    8    8   11                                            
CONECT   13   14    5   26                                            
CONECT   14   16   13   15   15                                       
CONECT   15   14   14                                                 
CONECT   16    1   14   17   27                                       
CONECT   17   16   18   28   29                                       
CONECT   18   17   30                                                 
CONECT   19    1                                                      
CONECT   20    1                                                      
CONECT   21    1                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    4                                                      
CONECT   25    6                                                      
CONECT   26   13                                                      
CONECT   27   16                                                      
CONECT   28   17                                                      
CONECT   29   17                                                      
CONECT   30   18                                                      
CONECT   31   11                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
