COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.947  -1.413  -0.636  1.00  0.00           O  
HETATM    2  S   UNL     1      -4.701  -0.130  -0.076  1.00  0.00           S  
HETATM    3  O   UNL     1      -5.244   1.069  -0.613  1.00  0.00           O  
HETATM    4  N   UNL     1      -5.201  -0.205   1.501  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.952   0.079  -0.060  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.126  -1.031  -0.065  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.755  -0.875  -0.053  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.202   0.408  -0.036  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.043   1.525  -0.031  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.411   1.353  -0.049  1.00  0.00           C  
HETATM   11  N   UNL     1       1.155   0.571  -0.018  1.00  0.00           N  
HETATM   12  N   UNL     1       1.929  -0.462  -0.022  1.00  0.00           N  
HETATM   13  C   UNL     1       3.283  -0.300  -0.005  1.00  0.00           C  
HETATM   14  C   UNL     1       4.124  -1.418  -0.009  1.00  0.00           C  
HETATM   15  C   UNL     1       5.490  -1.251   0.009  1.00  0.00           C  
HETATM   16  C   UNL     1       6.035   0.030   0.031  1.00  0.00           C  
HETATM   17  N   UNL     1       7.418   0.195   0.049  1.00  0.00           N  
HETATM   18  C   UNL     1       5.203   1.145   0.035  1.00  0.00           C  
HETATM   19  C   UNL     1       3.836   0.986   0.012  1.00  0.00           C  
HETATM   20  H   UNL     1      -4.552  -0.134   2.219  1.00  0.00           H  
HETATM   21  H   UNL     1      -6.141  -0.320   1.707  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.555  -2.022  -0.079  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.112  -1.742  -0.056  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.622   2.519  -0.018  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.062   2.215  -0.045  1.00  0.00           H  
HETATM   26  H   UNL     1       3.701  -2.412  -0.026  1.00  0.00           H  
HETATM   27  H   UNL     1       6.139  -2.114   0.005  1.00  0.00           H  
HETATM   28  H   UNL     1       7.999  -0.581   0.046  1.00  0.00           H  
HETATM   29  H   UNL     1       7.799   1.087   0.065  1.00  0.00           H  
HETATM   30  H   UNL     1       5.630   2.137   0.049  1.00  0.00           H  
HETATM   31  H   UNL     1       3.190   1.852   0.015  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    5    4    1    1                                       
CONECT    2    3    3                                                 
CONECT    3    2    2                                                 
CONECT    4    2   20   21                                            
CONECT    5   10   10    6    2                                       
CONECT    6    7    7    5   22                                       
CONECT    7    8    6    6   23                                       
CONECT    8   11    9    9    7                                       
CONECT    9    8    8   10   24                                       
CONECT   10    9    5    5   25                                       
CONECT   11   12   12    8                                            
CONECT   12   13   11   11                                            
CONECT   13   19   12   14   14                                       
CONECT   14   13   13   15   26                                       
CONECT   15   16   16   14   27                                       
CONECT   16   18   17   15   15                                       
CONECT   17   16   28   29                                            
CONECT   18   19   19   16   30                                       
CONECT   19   18   18   13   31                                       
CONECT   20    4                                                      
CONECT   21    4                                                      
CONECT   22    6                                                      
CONECT   23    7                                                      
CONECT   24    9                                                      
CONECT   25   10                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28   17                                                      
CONECT   29   17                                                      
CONECT   30   18                                                      
CONECT   31   19                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
