COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.431   1.920  -1.281  1.00  0.00           O  
HETATM    2  S   UNL     1       5.395   1.401   0.041  1.00  0.00           S  
HETATM    3  C   UNL     1       4.926   2.719   1.196  1.00  0.00           C  
HETATM    4  C   UNL     1       3.969   0.365   0.022  1.00  0.00           C  
HETATM    5  C   UNL     1       2.961   0.598  -0.897  1.00  0.00           C  
HETATM    6  C   UNL     1       3.865  -0.681   0.921  1.00  0.00           C  
HETATM    7  C   UNL     1       2.751  -1.495   0.909  1.00  0.00           C  
HETATM    8  C   UNL     1       1.730  -1.262  -0.011  1.00  0.00           C  
HETATM    9  C   UNL     1       1.843  -0.209  -0.918  1.00  0.00           C  
HETATM   10  C   UNL     1       0.531  -2.134  -0.029  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.880  -1.705  -0.021  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.633  -2.891  -0.045  1.00  0.00           C  
HETATM   13  O   UNL     1      -0.764  -3.922  -0.064  1.00  0.00           O  
HETATM   14  C   UNL     1       0.506  -3.486  -0.061  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.023  -2.820  -0.045  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.518  -0.470   0.002  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.909  -0.420   0.001  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.650  -1.608  -0.023  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.603   0.885   0.025  1.00  0.00           C  
HETATM   20  O   UNL     1      -4.936   1.082   0.027  1.00  0.00           O  
HETATM   21  C   UNL     1      -5.122   2.413   0.052  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.450   3.126   0.064  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.947   2.976   0.064  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.035   2.068   0.054  1.00  0.00           N  
HETATM   25  H   UNL     1       4.041   3.232   0.821  1.00  0.00           H  
HETATM   26  H   UNL     1       4.709   2.286   2.173  1.00  0.00           H  
HETATM   27  H   UNL     1       5.747   3.430   1.289  1.00  0.00           H  
HETATM   28  H   UNL     1       3.050   1.414  -1.599  1.00  0.00           H  
HETATM   29  H   UNL     1       4.656  -0.860   1.633  1.00  0.00           H  
HETATM   30  H   UNL     1       2.670  -2.312   1.611  1.00  0.00           H  
HETATM   31  H   UNL     1       1.056  -0.026  -1.635  1.00  0.00           H  
HETATM   32  H   UNL     1       1.380  -4.121  -0.079  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.608  -3.728  -0.064  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.940   0.442   0.020  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.729  -1.564  -0.023  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.771   3.278   1.094  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.349   4.091  -0.431  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.191   2.523  -0.462  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   25   26   27                                       
CONECT    4    2    5    5    6                                       
CONECT    5    4    4    9   28                                       
CONECT    6    4    7    7   29                                       
CONECT    7    6    6    8   30                                       
CONECT    8    7    9    9   10                                       
CONECT    9    5    8    8   31                                       
CONECT   10    8   11   14   14                                       
CONECT   11   10   12   12   16                                       
CONECT   12   11   11   13   15                                       
CONECT   13   12   14                                                 
CONECT   14   10   10   13   32                                       
CONECT   15   12   18   18   33                                       
CONECT   16   11   17   17   34                                       
CONECT   17   16   16   18   19                                       
CONECT   18   15   15   17   35                                       
CONECT   19   17   20   24   24                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   23   23                                       
CONECT   22   21   36   37   38                                       
CONECT   23   21   21   24                                            
CONECT   24   19   19   23                                            
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    9                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   18                                                      
CONECT   36   22                                                      
CONECT   37   22                                                      
CONECT   38   22                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
