COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.731  -0.804  -0.684  1.00  0.00           O  
HETATM    2  S   UNL     1      -5.661   0.361   0.126  1.00  0.00           S  
HETATM    3  O   UNL     1      -5.531  -0.139   1.558  1.00  0.00           O  
HETATM    4  O   UNL     1      -6.634   1.396   0.165  1.00  0.00           O  
HETATM    5  N   UNL     1      -4.233   1.100  -0.271  1.00  0.00           N  
HETATM    6  C   UNL     1      -3.055   0.353  -0.342  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.046  -0.877  -0.988  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.889   0.832   0.233  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.717   0.094   0.166  1.00  0.00           C  
HETATM   10  C   UNL     1       0.510   0.662   0.835  1.00  0.00           C  
HETATM   11  N   UNL     1       1.691  -0.116   0.445  1.00  0.00           N  
HETATM   12  C   UNL     1       2.844   0.488   0.096  1.00  0.00           C  
HETATM   13  O   UNL     1       3.772  -0.172  -0.328  1.00  0.00           O  
HETATM   14  O   UNL     1       2.968   1.823   0.218  1.00  0.00           O  
HETATM   15  C   UNL     1       4.211   2.474  -0.157  1.00  0.00           C  
HETATM   16  C   UNL     1       4.499   2.210  -1.637  1.00  0.00           C  
HETATM   17  C   UNL     1       4.088   3.981   0.077  1.00  0.00           C  
HETATM   18  C   UNL     1       5.355   1.918   0.692  1.00  0.00           C  
HETATM   19  C   UNL     1       1.566  -1.583   0.448  1.00  0.00           C  
HETATM   20  C   UNL     1       2.895  -2.209   0.114  1.00  0.00           C  
HETATM   21  O   UNL     1       3.155  -2.504  -1.033  1.00  0.00           O  
HETATM   22  N   UNL     1       3.795  -2.442   1.090  1.00  0.00           N  
HETATM   23  C   UNL     1       5.087  -3.051   0.765  1.00  0.00           C  
HETATM   24  C   UNL     1       0.532  -1.969  -0.608  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.706  -1.121  -0.483  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.878  -1.604  -1.056  1.00  0.00           C  
HETATM   27  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.215   2.053  -0.454  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.950  -1.261  -1.436  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.892   1.788   0.735  1.00  0.00           H  
HETATM   31  H   UNL     1       0.642   1.699   0.529  1.00  0.00           H  
HETATM   32  H   UNL     1       0.388   0.615   1.917  1.00  0.00           H  
HETATM   33  H   UNL     1       3.683   2.606  -2.242  1.00  0.00           H  
HETATM   34  H   UNL     1       5.431   2.699  -1.918  1.00  0.00           H  
HETATM   35  H   UNL     1       4.586   1.136  -1.803  1.00  0.00           H  
HETATM   36  H   UNL     1       3.883   4.170   1.131  1.00  0.00           H  
HETATM   37  H   UNL     1       5.021   4.470  -0.205  1.00  0.00           H  
HETATM   38  H   UNL     1       3.273   4.378  -0.528  1.00  0.00           H  
HETATM   39  H   UNL     1       5.443   0.844   0.525  1.00  0.00           H  
HETATM   40  H   UNL     1       6.288   2.406   0.410  1.00  0.00           H  
HETATM   41  H   UNL     1       5.150   2.106   1.746  1.00  0.00           H  
HETATM   42  H   UNL     1       1.235  -1.922   1.430  1.00  0.00           H  
HETATM   43  H   UNL     1       3.587  -2.206   2.008  1.00  0.00           H  
HETATM   44  H   UNL     1       5.622  -2.414   0.061  1.00  0.00           H  
HETATM   45  H   UNL     1       5.676  -3.160   1.676  1.00  0.00           H  
HETATM   46  H   UNL     1       4.925  -4.031   0.318  1.00  0.00           H  
HETATM   47  H   UNL     1       0.963  -1.830  -1.600  1.00  0.00           H  
HETATM   48  H   UNL     1       0.263  -3.018  -0.480  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.871  -2.560  -1.560  1.00  0.00           H  
CONECT    1    2   27                                                 
CONECT    2    1    3    3    4                                       
CONECT    2    4    5                                                 
CONECT    3    2    2                                                 
CONECT    4    2    2                                                 
CONECT    5    2    6   28                                            
CONECT    6    5    7    8    8                                       
CONECT    7    6   26   26   29                                       
CONECT    8    6    6    9   30                                       
CONECT    9    8   10   25   25                                       
CONECT   10    9   11   31   32                                       
CONECT   11   10   12   19                                            
CONECT   12   11   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15                                                 
CONECT   15   14   16   17   18                                       
CONECT   16   15   33   34   35                                       
CONECT   17   15   36   37   38                                       
CONECT   18   15   39   40   41                                       
CONECT   19   11   20   24   42                                       
CONECT   20   19   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   43                                            
CONECT   23   22   44   45   46                                       
CONECT   24   19   25   47   48                                       
CONECT   25    9    9   24   26                                       
CONECT   26    7    7   25   49                                       
CONECT   27    1                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31   10                                                      
CONECT   32   10                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
