COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.908   1.383   0.014  1.00  0.00           O  
HETATM    2  C   UNL     1       6.021   0.369   0.004  1.00  0.00           C  
HETATM    3  O   UNL     1       6.412  -0.780  -0.008  1.00  0.00           O  
HETATM    4  C   UNL     1       4.574   0.655   0.007  1.00  0.00           C  
HETATM    5  N   UNL     1       3.722  -0.317  -0.003  1.00  0.00           N  
HETATM    6  O   UNL     1       2.333  -0.043   0.000  1.00  0.00           O  
HETATM    7  C   UNL     1       1.510  -1.211  -0.013  1.00  0.00           C  
HETATM    8  C   UNL     1       0.059  -0.802  -0.008  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.606  -0.603  -1.204  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.937  -0.228  -1.200  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.602  -0.054  -0.001  1.00  0.00           C  
HETATM   12  S   UNL     1      -4.298   0.424   0.004  1.00  0.00           S  
HETATM   13  N   UNL     1      -5.199  -0.965  -0.011  1.00  0.00           N  
HETATM   14  O   UNL     1      -4.537   1.044   1.261  1.00  0.00           O  
HETATM   15  O   UNL     1      -4.536   1.071  -1.238  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.937  -0.255   1.195  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.608  -0.633   1.191  1.00  0.00           C  
HETATM   18  H   UNL     1      -0.086  -0.739  -2.140  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.457  -0.071  -2.133  1.00  0.00           H  
HETATM   20  H   UNL     1      -4.758  -1.829  -0.020  1.00  0.00           H  
HETATM   21  H   UNL     1      -6.168  -0.915  -0.010  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.457  -0.119   2.131  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.089  -0.793   2.124  1.00  0.00           H  
HETATM   24  H   UNL     1       7.846   1.146   0.012  1.00  0.00           H  
HETATM   25  H   UNL     1       4.226   1.678   0.017  1.00  0.00           H  
HETATM   26  H   UNL     1       1.720  -1.794  -0.909  1.00  0.00           H  
HETATM   27  H   UNL     1       1.720  -1.813   0.871  1.00  0.00           H  
CONECT    1    2   24                                                 
CONECT    2    1    4    3    3                                       
CONECT    3    2    2                                                 
CONECT    4    5    5    2   25                                       
CONECT    5    6    4    4                                            
CONECT    6    7    5                                                 
CONECT    7    8    6   26   27                                       
CONECT    8    7    9    9   17                                       
CONECT    9    8    8   10   18                                       
CONECT   10    9   11   11   19                                       
CONECT   11   10   10   16   12                                       
CONECT   12   11   13   14   14                                       
CONECT   12   15   15                                                 
CONECT   13   12   20   21                                            
CONECT   14   12   12                                                 
CONECT   15   12   12                                                 
CONECT   16   17   17   11   22                                       
CONECT   17    8   16   16   23                                       
CONECT   18    9                                                      
CONECT   19   10                                                      
CONECT   20   13                                                      
CONECT   21   13                                                      
CONECT   22   16                                                      
CONECT   23   17                                                      
CONECT   24    1                                                      
CONECT   25    4                                                      
CONECT   26    7                                                      
CONECT   27    7                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
