COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.847  -0.420   0.340  1.00  0.00           O  
HETATM    2  S   UNL     1      -5.971   0.634  -0.034  1.00  0.00           S  
HETATM    3  O   UNL     1      -6.130   1.390  -1.226  1.00  0.00           O  
HETATM    4  N   UNL     1      -5.986   1.721   1.215  1.00  0.00           N  
HETATM    5  C   UNL     1      -4.354  -0.063  -0.099  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.066  -1.205   0.628  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.802  -1.756   0.581  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.379   0.530  -0.881  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.111  -0.011  -0.937  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.813  -1.159  -0.202  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.456  -1.745  -0.257  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.310  -2.949  -0.182  1.00  0.00           O  
HETATM   13  N   UNL     1       0.619  -0.942  -0.390  1.00  0.00           N  
HETATM   14  C   UNL     1       0.470   0.519  -0.362  1.00  0.00           C  
HETATM   15  C   UNL     1       1.389   1.086   0.727  1.00  0.00           C  
HETATM   16  C   UNL     1       1.962  -1.514  -0.559  1.00  0.00           C  
HETATM   17  C   UNL     1       2.878  -0.944   0.530  1.00  0.00           C  
HETATM   18  N   UNL     1       2.731   0.514   0.552  1.00  0.00           N  
HETATM   19  C   UNL     1       3.808   1.314   0.419  1.00  0.00           C  
HETATM   20  O   UNL     1       3.685   2.519   0.518  1.00  0.00           O  
HETATM   21  C   UNL     1       5.138   0.725   0.153  1.00  0.00           C  
HETATM   22  C   UNL     1       5.972   1.287  -0.814  1.00  0.00           C  
HETATM   23  C   UNL     1       5.567  -0.391   0.873  1.00  0.00           C  
HETATM   24  C   UNL     1       6.809  -0.935   0.620  1.00  0.00           C  
HETATM   25  C   UNL     1       7.630  -0.376  -0.344  1.00  0.00           C  
HETATM   26  C   UNL     1       7.212   0.734  -1.057  1.00  0.00           C  
HETATM   27  H   UNL     1      -5.186   1.862   1.745  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.795   2.216   1.418  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.833  -1.666   1.233  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.579  -2.647   1.149  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.611   1.419  -1.449  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.351   0.453  -1.548  1.00  0.00           H  
HETATM   33  H   UNL     1       0.751   0.934  -1.330  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.566   0.777  -0.138  1.00  0.00           H  
HETATM   35  H   UNL     1       1.439   2.171   0.636  1.00  0.00           H  
HETATM   36  H   UNL     1       1.000   0.818   1.709  1.00  0.00           H  
HETATM   37  H   UNL     1       1.911  -2.599  -0.463  1.00  0.00           H  
HETATM   38  H   UNL     1       2.353  -1.249  -1.541  1.00  0.00           H  
HETATM   39  H   UNL     1       2.595  -1.355   1.499  1.00  0.00           H  
HETATM   40  H   UNL     1       3.914  -1.202   0.310  1.00  0.00           H  
HETATM   41  H   UNL     1       5.648   2.153  -1.372  1.00  0.00           H  
HETATM   42  H   UNL     1       4.928  -0.828   1.626  1.00  0.00           H  
HETATM   43  H   UNL     1       7.143  -1.799   1.176  1.00  0.00           H  
HETATM   44  H   UNL     1       8.602  -0.805  -0.537  1.00  0.00           H  
HETATM   45  H   UNL     1       7.857   1.165  -1.808  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   27   28                                            
CONECT    5    6    6    8    2                                       
CONECT    6    7    5    5   29                                       
CONECT    7   10   10    6   30                                       
CONECT    8    9    9    5   31                                       
CONECT    9   10    8    8   32                                       
CONECT   10   11    7    7    9                                       
CONECT   11   12   12   13   10                                       
CONECT   12   11   11                                                 
CONECT   13   16   11   14                                            
CONECT   14   13   15   33   34                                       
CONECT   15   18   14   35   36                                       
CONECT   16   17   13   37   38                                       
CONECT   17   16   18   39   40                                       
CONECT   18   17   19   15                                            
CONECT   19   21   18   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   23   23   22   19                                       
CONECT   22   26   26   21   41                                       
CONECT   23   24   21   21   42                                       
CONECT   24   25   25   23   43                                       
CONECT   25   24   24   26   44                                       
CONECT   26   25   22   22   45                                       
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
