COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.452   1.804  -0.877  1.00  0.00           O  
HETATM    2  S   UNL     1      -0.174   1.152   0.354  1.00  0.00           S  
HETATM    3  O   UNL     1      -0.128   1.810   1.612  1.00  0.00           O  
HETATM    4  C   UNL     1       1.351   0.271   0.158  1.00  0.00           C  
HETATM    5  C   UNL     1       2.654   0.648  -0.010  1.00  0.00           C  
HETATM    6  C   UNL     1       3.639  -0.321  -0.137  1.00  0.00           C  
HETATM    7  S   UNL     1       5.323   0.150  -0.355  1.00  0.00           S  
HETATM    8  O   UNL     1       5.305   1.461  -0.903  1.00  0.00           O  
HETATM    9  N   UNL     1       5.994   0.283   1.153  1.00  0.00           N  
HETATM   10  O   UNL     1       5.968  -0.948  -0.986  1.00  0.00           O  
HETATM   11  C   UNL     1       3.290  -1.659  -0.090  1.00  0.00           C  
HETATM   12  C   UNL     1       1.979  -2.042   0.079  1.00  0.00           C  
HETATM   13  C   UNL     1       0.968  -1.075   0.209  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.237  -0.131   0.495  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.480  -1.241   0.395  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.981  -2.346   0.460  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.687  -0.058   0.686  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.386  -0.159  -0.671  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.878  -0.084  -0.475  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.518   1.141  -0.497  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.886   1.210  -0.317  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.616   0.054  -0.115  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.977  -1.172  -0.093  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.609  -1.241  -0.278  1.00  0.00           C  
HETATM   25  H   UNL     1       2.915   1.695  -0.045  1.00  0.00           H  
HETATM   26  H   UNL     1       5.456   0.108   1.941  1.00  0.00           H  
HETATM   27  H   UNL     1       6.926   0.536   1.249  1.00  0.00           H  
HETATM   28  H   UNL     1       4.057  -2.413  -0.189  1.00  0.00           H  
HETATM   29  H   UNL     1       1.726  -3.092   0.112  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.012  -0.879   1.324  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.945   0.891   1.157  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.062   0.663  -1.309  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.129  -1.108  -1.142  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.948   2.045  -0.655  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.386   2.168  -0.334  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.686   0.108   0.026  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.547  -2.075   0.065  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.110  -2.199  -0.265  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    3    4   14                                       
CONECT    2    1    1                                                 
CONECT    3    2    2                                                 
CONECT    4   13    5    5    2                                       
CONECT    5    6    4    4   25                                       
CONECT    6    7   11   11    5                                       
CONECT    7    9    6    8    8                                       
CONECT    7   10   10                                                 
CONECT    8    7    7                                                 
CONECT    9    7   26   27                                            
CONECT   10    7    7                                                 
CONECT   11    6    6   12   28                                       
CONECT   12   11   13   13   29                                       
CONECT   13   12   12    4   15                                       
CONECT   14   15    2   17                                            
CONECT   15   13   16   16   14                                       
CONECT   16   15   15                                                 
CONECT   17   18   14   30   31                                       
CONECT   18   19   17   32   33                                       
CONECT   19   18   20   20   24                                       
CONECT   20   19   19   21   34                                       
CONECT   21   20   22   22   35                                       
CONECT   22   21   21   23   36                                       
CONECT   23   24   24   22   37                                       
CONECT   24   19   23   23   38                                       
CONECT   25    5                                                      
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   17                                                      
CONECT   31   17                                                      
CONECT   32   18                                                      
CONECT   33   18                                                      
CONECT   34   20                                                      
CONECT   35   21                                                      
CONECT   36   22                                                      
CONECT   37   23                                                      
CONECT   38   24                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
