COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.144   0.586   0.034  1.00  0.00           N  
HETATM    2  N   UNL     1      -2.033  -0.126   0.054  1.00  0.00           N  
HETATM    3  C   UNL     1       0.790   0.386   0.085  1.00  0.00           C  
HETATM    4  C   UNL     1       4.318   1.795   0.001  1.00  0.00           C  
HETATM    5  C   UNL     1       2.797   1.893   0.076  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.177  -1.167   0.089  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.477  -0.368  -0.005  1.00  0.00           C  
HETATM    8  C   UNL     1       2.948  -0.499  -0.057  1.00  0.00           C  
HETATM    9  N   UNL     1       2.461  -1.737  -0.097  1.00  0.00           N  
HETATM   10  C   UNL     1       1.168  -1.994  -0.052  1.00  0.00           C  
HETATM   11  C   UNL     1       0.271  -0.928   0.036  1.00  0.00           C  
HETATM   12  S   UNL     1       4.645   0.011  -0.108  1.00  0.00           S  
HETATM   13  O   UNL     1       0.035   1.338   0.172  1.00  0.00           O  
HETATM   14  O   UNL     1      -1.604  -2.304   0.165  1.00  0.00           O  
HETATM   15  C   UNL     1      -4.217   0.971  -0.036  1.00  0.00           C  
HETATM   16  S   UNL     1      -6.005   0.672  -0.108  1.00  0.00           S  
HETATM   17  H   UNL     1      -1.693   0.782   0.067  1.00  0.00           H  
HETATM   18  H   UNL     1       4.690   2.308  -0.886  1.00  0.00           H  
HETATM   19  H   UNL     1       4.772   2.211   0.900  1.00  0.00           H  
HETATM   20  H   UNL     1       2.441   2.491  -0.762  1.00  0.00           H  
HETATM   21  H   UNL     1       2.522   2.394   1.004  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.714  -0.935  -0.905  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.786  -0.934   0.873  1.00  0.00           H  
HETATM   24  H   UNL     1       0.809  -3.012  -0.088  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.980   1.538   0.865  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.907   1.537  -0.914  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.519   1.915  -0.130  1.00  0.00           H  
CONECT    1    5    8    3                                            
CONECT    2    6    7   17                                            
CONECT    3    1   13   13   11                                       
CONECT    4   12    5   18   19                                       
CONECT    5    4    1   20   21                                       
CONECT    6   11   14   14    2                                       
CONECT    7    2   15   22   23                                       
CONECT    8   12    1    9    9                                       
CONECT    9    8    8   10                                            
CONECT   10    9   11   11   24                                       
CONECT   11    3   10   10    6                                       
CONECT   12    4    8                                                 
CONECT   13    3    3                                                 
CONECT   14    6    6                                                 
CONECT   15    7   16   25   26                                       
CONECT   16   15   27                                                 
CONECT   17    2                                                      
CONECT   18    4                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24   10                                                      
CONECT   25   15                                                      
CONECT   26   15                                                      
CONECT   27   16                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
