COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.699   2.644   0.670  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.753   0.701  -2.416  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.323   1.686  -1.361  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.591   1.268  -0.068  1.00  0.00           C  
HETATM    5  C   UNL     1       1.447   0.341   0.158  1.00  0.00           C  
HETATM    6  C   UNL     1       2.152  -0.759  -0.321  1.00  0.00           C  
HETATM    7  N   UNL     1       3.447  -0.326  -0.580  1.00  0.00           N  
HETATM    8  C   UNL     1       3.572   0.994  -0.281  1.00  0.00           C  
HETATM    9  C   UNL     1       0.102   0.334   0.527  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.584  -0.888   0.415  1.00  0.00           C  
HETATM   11  C   UNL     1       0.100  -1.980  -0.043  1.00  0.00           C  
HETATM   12  C   UNL     1       1.443  -1.941  -0.418  1.00  0.00           C  
HETATM   13  C   UNL     1       2.274   1.473   0.209  1.00  0.00           C  
HETATM   14  C   UNL     1       0.358   2.651   1.052  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.443   1.542   0.993  1.00  0.00           C  
HETATM   16  O   UNL     1       4.583   1.661  -0.399  1.00  0.00           O  
HETATM   17  C   UNL     1       4.524  -1.172  -1.101  1.00  0.00           C  
HETATM   18  S   UNL     1      -2.286  -1.009   0.855  1.00  0.00           S  
HETATM   19  O   UNL     1      -2.657  -2.366   0.652  1.00  0.00           O  
HETATM   20  O   UNL     1      -2.426  -0.343   2.102  1.00  0.00           O  
HETATM   21  N   UNL     1      -3.142  -0.120  -0.249  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.581  -0.589  -1.576  1.00  0.00           C  
HETATM   23  C   UNL     1       5.282  -1.808   0.066  1.00  0.00           C  
HETATM   24  H   UNL     1       2.286   3.548   0.737  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.463   0.546  -3.229  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.794   1.050  -2.798  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.083   2.716  -1.625  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.400   1.558  -1.256  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.731   1.918   0.097  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.272   1.332   0.781  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.429  -2.918  -0.129  1.00  0.00           H  
HETATM   32  H   UNL     1       1.929  -2.834  -0.782  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.069   3.575   1.413  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.479   1.597   1.293  1.00  0.00           H  
HETATM   35  H   UNL     1       4.099  -1.956  -1.728  1.00  0.00           H  
HETATM   36  H   UNL     1       5.209  -0.565  -1.692  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.530  -1.120  -1.496  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.822  -1.233  -2.021  1.00  0.00           H  
HETATM   39  H   UNL     1       5.707  -1.024   0.693  1.00  0.00           H  
HETATM   40  H   UNL     1       4.597  -2.415   0.658  1.00  0.00           H  
HETATM   41  H   UNL     1       6.084  -2.437  -0.321  1.00  0.00           H  
CONECT    1   13   14   14   24                                       
CONECT    2   22    3   25   26                                       
CONECT    3    4    2   27   28                                       
CONECT    4   21    3   29   30                                       
CONECT    5    6   13   13    9                                       
CONECT    6    7   12   12    5                                       
CONECT    7   17    8    6                                            
CONECT    8    7   16   16   13                                       
CONECT    9    5   10   15   15                                       
CONECT   10   11   11    9   18                                       
CONECT   11   12   10   10   31                                       
CONECT   12    6    6   11   32                                       
CONECT   13    8    5    5    1                                       
CONECT   14    1    1   15   33                                       
CONECT   15    9    9   14   34                                       
CONECT   16    8    8                                                 
CONECT   17   23    7   35   36                                       
CONECT   18   10   19   19   20                                       
CONECT   18   20   21                                                 
CONECT   19   18   18                                                 
CONECT   20   18   18                                                 
CONECT   21   18   22    4                                            
CONECT   22   21    2   37   38                                       
CONECT   23   17   39   40   41                                       
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   22                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
