COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.682  -2.512   0.038  1.00  0.00           C  
HETATM    2  O   UNL     1       6.138   2.656  -1.519  1.00  0.00           O  
HETATM    3  S   UNL     1       6.192   1.759  -0.418  1.00  0.00           S  
HETATM    4  C   UNL     1      -7.498   2.170  -0.940  1.00  0.00           C  
HETATM    5  S   UNL     1      -0.022  -2.103  -0.037  1.00  0.00           S  
HETATM    6  C   UNL     1       0.275  -0.470   0.349  1.00  0.00           C  
HETATM    7  C   UNL     1       1.617  -0.250   0.525  1.00  0.00           C  
HETATM    8  C   UNL     1       2.410  -1.446   0.340  1.00  0.00           C  
HETATM    9  C   UNL     1       2.243  -3.890  -0.204  1.00  0.00           C  
HETATM   10  C   UNL     1       2.983  -4.366   1.048  1.00  0.00           C  
HETATM   11  C   UNL     1       1.100  -4.857  -0.519  1.00  0.00           C  
HETATM   12  C   UNL     1       3.215  -3.845  -1.385  1.00  0.00           C  
HETATM   13  C   UNL     1       2.188   1.057   0.865  1.00  0.00           C  
HETATM   14  C   UNL     1      -8.334  -0.315   0.029  1.00  0.00           C  
HETATM   15  O   UNL     1       1.724   1.702   1.787  1.00  0.00           O  
HETATM   16  C   UNL     1      -9.220   0.553  -0.531  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.705   0.504   0.467  1.00  0.00           N  
HETATM   18  C   UNL     1      -2.000   0.184   0.273  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.803   1.793  -1.014  1.00  0.00           C  
HETATM   20  O   UNL     1      -2.308  -0.959  -0.006  1.00  0.00           O  
HETATM   21  N   UNL     1      -2.952   1.130   0.388  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.303   0.778   0.293  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.730  -0.464   0.776  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.036  -0.833   0.697  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.977   0.040   0.124  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.553   1.300  -0.368  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.198   1.657  -0.274  1.00  0.00           C  
HETATM   28  N   UNL     1       3.226   1.543   0.156  1.00  0.00           N  
HETATM   29  C   UNL     1       3.867   2.791   0.574  1.00  0.00           C  
HETATM   30  C   UNL     1       5.315   2.509   0.985  1.00  0.00           C  
HETATM   31  C   UNL     1       5.132   0.329  -0.780  1.00  0.00           C  
HETATM   32  C   UNL     1       3.701   0.819  -1.023  1.00  0.00           C  
HETATM   33  O   UNL     1       7.455   1.289   0.034  1.00  0.00           O  
HETATM   34  H   UNL     1      -7.188   3.132  -1.322  1.00  0.00           H  
HETATM   35  H   UNL     1       3.485  -1.468   0.439  1.00  0.00           H  
HETATM   36  H   UNL     1       2.291  -4.397   1.890  1.00  0.00           H  
HETATM   37  H   UNL     1       3.388  -5.362   0.874  1.00  0.00           H  
HETATM   38  H   UNL     1       3.797  -3.677   1.273  1.00  0.00           H  
HETATM   39  H   UNL     1       0.573  -4.518  -1.411  1.00  0.00           H  
HETATM   40  H   UNL     1       1.506  -5.854  -0.694  1.00  0.00           H  
HETATM   41  H   UNL     1       0.408  -4.889   0.322  1.00  0.00           H  
HETATM   42  H   UNL     1       4.029  -3.156  -1.160  1.00  0.00           H  
HETATM   43  H   UNL     1       3.620  -4.842  -1.559  1.00  0.00           H  
HETATM   44  H   UNL     1       2.687  -3.507  -2.276  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.672  -1.271   0.400  1.00  0.00           H  
HETATM   46  H   UNL     1     -10.262   0.278  -0.602  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.459   1.416   0.689  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.526   2.463  -1.454  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.702   2.055   0.536  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.012  -1.140   1.218  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.350  -1.795   1.074  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.861   2.614  -0.644  1.00  0.00           H  
HETATM   53  H   UNL     1       3.856   3.500  -0.255  1.00  0.00           H  
HETATM   54  H   UNL     1       3.325   3.213   1.420  1.00  0.00           H  
HETATM   55  H   UNL     1       5.327   1.822   1.832  1.00  0.00           H  
HETATM   56  H   UNL     1       5.804   3.443   1.264  1.00  0.00           H  
HETATM   57  H   UNL     1       5.500  -0.181  -1.671  1.00  0.00           H  
HETATM   58  H   UNL     1       5.144  -0.357   0.066  1.00  0.00           H  
HETATM   59  H   UNL     1       3.052  -0.036  -1.212  1.00  0.00           H  
HETATM   60  H   UNL     1       3.687   1.483  -1.888  1.00  0.00           H  
CONECT    1    5    8    8    9                                       
CONECT    2    3    3                                                 
CONECT    3    2    2   30   31                                       
CONECT    3   33   33                                                 
CONECT    4   19   19   26   34                                       
CONECT    5    1    6                                                 
CONECT    6    5    7    7   17                                       
CONECT    7    6    6    8   13                                       
CONECT    8    1    1    7   35                                       
CONECT    9    1   10   11   12                                       
CONECT   10    9   36   37   38                                       
CONECT   11    9   39   40   41                                       
CONECT   12    9   42   43   44                                       
CONECT   13    7   15   15   28                                       
CONECT   14   16   16   25   45                                       
CONECT   15   13   13                                                 
CONECT   16   14   14   19   46                                       
CONECT   17    6   18   47                                            
CONECT   18   17   20   20   21                                       
CONECT   19    4    4   16   48                                       
CONECT   20   18   18                                                 
CONECT   21   18   22   49                                            
CONECT   22   21   23   23   27                                       
CONECT   23   22   22   24   50                                       
CONECT   24   23   25   25   51                                       
CONECT   25   14   24   24   26                                       
CONECT   26    4   25   27   27                                       
CONECT   27   22   26   26   52                                       
CONECT   28   13   29   32                                            
CONECT   29   28   30   53   54                                       
CONECT   30    3   29   55   56                                       
CONECT   31    3   32   57   58                                       
CONECT   32   28   31   59   60                                       
CONECT   33    3    3                                                 
CONECT   34    4                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   12                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
CONECT   59   32                                                      
CONECT   60   32                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
