COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.317   0.304  -0.066  1.00  0.00           C  
HETATM    2  C   UNL     1       0.218   1.566  -0.351  1.00  0.00           C  
HETATM    3  C   UNL     1       1.582   1.752  -0.414  1.00  0.00           C  
HETATM    4  C   UNL     1       4.593  -0.187  -0.039  1.00  0.00           C  
HETATM    5  C   UNL     1       2.838  -1.716   0.326  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.217   2.128   1.455  1.00  0.00           C  
HETATM    7  C   UNL     1       2.444   0.669  -0.191  1.00  0.00           C  
HETATM    8  C   UNL     1       1.903  -0.604   0.097  1.00  0.00           C  
HETATM    9  C   UNL     1       0.524  -0.781   0.159  1.00  0.00           C  
HETATM   10  N   UNL     1       3.791   0.813  -0.245  1.00  0.00           N  
HETATM   11  N   UNL     1       4.162  -1.445   0.244  1.00  0.00           N  
HETATM   12  O   UNL     1       2.438  -2.838   0.579  1.00  0.00           O  
HETATM   13  C   UNL     1      -1.783   0.125   0.004  1.00  0.00           C  
HETATM   14  S   UNL     1      -2.709  -1.163  -0.764  1.00  0.00           S  
HETATM   15  C   UNL     1      -2.651   0.915   0.672  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.906   0.536   0.580  1.00  0.00           N  
HETATM   17  C   UNL     1      -4.157  -0.516  -0.125  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.530  -1.098  -0.344  1.00  0.00           C  
HETATM   19  O   UNL     1       2.090   2.982  -0.693  1.00  0.00           O  
HETATM   20  H   UNL     1      -0.444   2.402  -0.524  1.00  0.00           H  
HETATM   21  H   UNL     1       5.657  -0.011  -0.096  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.136   2.983   0.785  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.953   2.341   2.231  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.248   1.935   1.916  1.00  0.00           H  
HETATM   25  H   UNL     1       0.110  -1.754   0.379  1.00  0.00           H  
HETATM   26  H   UNL     1       4.808  -2.154   0.388  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.977  -0.651  -1.232  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.449  -2.176  -0.481  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.156  -0.888   0.523  1.00  0.00           H  
HETATM   30  H   UNL     1       2.251   3.527   0.089  1.00  0.00           H  
CONECT    1   13    9    9    2                                       
CONECT    2    1    3    3   20                                       
CONECT    3    2    2    7   19                                       
CONECT    4   11   10   10   21                                       
CONECT    5    8   12   12   11                                       
CONECT    6   15   22   23   24                                       
CONECT    7    8    8    3   10                                       
CONECT    8    9    5    7    7                                       
CONECT    9    1    1    8   25                                       
CONECT   10    7    4    4                                            
CONECT   11    5    4   26                                            
CONECT   12    5    5                                                 
CONECT   13   15   15   14    1                                       
CONECT   14   17   13                                                 
CONECT   15    6   16   13   13                                       
CONECT   16   15   17   17                                            
CONECT   17   16   16   18   14                                       
CONECT   18   17   27   28   29                                       
CONECT   19    3   30                                                 
CONECT   20    2                                                      
CONECT   21    4                                                      
CONECT   22    6                                                      
CONECT   23    6                                                      
CONECT   24    6                                                      
CONECT   25    9                                                      
CONECT   26   11                                                      
CONECT   27   18                                                      
CONECT   28   18                                                      
CONECT   29   18                                                      
CONECT   30   19                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
