COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.059   0.859   0.975  1.00  0.00           C  
HETATM    2  C   UNL     1       4.820   0.334   0.297  1.00  0.00           C  
HETATM    3  C   UNL     1       3.615  -0.060   0.922  1.00  0.00           C  
HETATM    4  N   UNL     1       4.645   0.159  -0.981  1.00  0.00           N  
HETATM    5  O   UNL     1       3.541  -0.271  -1.224  1.00  0.00           O  
HETATM    6  C   UNL     1       2.823  -0.447  -0.106  1.00  0.00           C  
HETATM    7  C   UNL     1       1.411  -0.966  -0.013  1.00  0.00           C  
HETATM    8  S   UNL     1       0.250   0.425  -0.105  1.00  0.00           S  
HETATM    9  C   UNL     1      -1.321  -0.363   0.018  1.00  0.00           C  
HETATM   10  N   UNL     1      -1.538  -1.653   0.146  1.00  0.00           N  
HETATM   11  N   UNL     1      -2.801  -1.889   0.208  1.00  0.00           N  
HETATM   12  C   UNL     1      -3.471  -0.754   0.123  1.00  0.00           C  
HETATM   13  N   UNL     1      -2.538   0.254   0.005  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.937   1.557  -0.101  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.247   1.873  -0.093  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.223   0.866   0.026  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.844  -0.434   0.138  1.00  0.00           C  
HETATM   18  H   UNL     1       6.717   0.026   1.225  1.00  0.00           H  
HETATM   19  H   UNL     1       6.579   1.543   0.304  1.00  0.00           H  
HETATM   20  H   UNL     1       5.779   1.387   1.886  1.00  0.00           H  
HETATM   21  H   UNL     1       3.379  -0.053   1.977  1.00  0.00           H  
HETATM   22  H   UNL     1       1.221  -1.653  -0.837  1.00  0.00           H  
HETATM   23  H   UNL     1       1.278  -1.488   0.934  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.197   2.339  -0.193  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.550   2.906  -0.179  1.00  0.00           H  
HETATM   26  H   UNL     1      -6.271   1.127   0.035  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.585  -1.214   0.230  1.00  0.00           H  
CONECT    1    2   18   19   20                                       
CONECT    2    4    4    3    1                                       
CONECT    3    6    6    2   21                                       
CONECT    4    5    2    2                                            
CONECT    5    4    6                                                 
CONECT    6    5    7    3    3                                       
CONECT    7    8    6   22   23                                       
CONECT    8    9    7                                                 
CONECT    9   13   10   10    8                                       
CONECT   10   11    9    9                                            
CONECT   11   12   12   10                                            
CONECT   12   17   11   11   13                                       
CONECT   13   12   14    9                                            
CONECT   14   15   15   13   24                                       
CONECT   15   16   14   14   25                                       
CONECT   16   17   17   15   26                                       
CONECT   17   16   16   12   27                                       
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    1                                                      
CONECT   21    3                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24   14                                                      
CONECT   25   15                                                      
CONECT   26   16                                                      
CONECT   27   17                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
