COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.272  -0.933  -0.474  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.280   0.046   0.133  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.381  -1.077   0.193  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.758  -1.376  -0.342  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.839   1.480  -0.178  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.927   3.600  -0.153  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.857   4.623   0.446  1.00  0.00           C  
HETATM    8  C   UNL     1       0.578   1.695   0.362  1.00  0.00           C  
HETATM    9  C   UNL     1       1.515   0.652  -0.254  1.00  0.00           C  
HETATM   10  C   UNL     1       2.920   0.822   0.325  1.00  0.00           C  
HETATM   11  C   UNL     1       5.116  -0.062   0.050  1.00  0.00           C  
HETATM   12  C   UNL     1       6.122  -0.978  -0.599  1.00  0.00           C  
HETATM   13  N   UNL     1       0.486  -3.565  -0.641  1.00  0.00           N  
HETATM   14  O   UNL     1      -0.692  -2.828   1.357  1.00  0.00           O  
HETATM   15  O   UNL     1      -2.593  -0.192  -0.438  1.00  0.00           O  
HETATM   16  O   UNL     1      -2.986  -1.633   1.191  1.00  0.00           O  
HETATM   17  O   UNL     1      -1.884  -3.034  -0.802  1.00  0.00           O  
HETATM   18  O   UNL     1      -1.749   2.417   0.456  1.00  0.00           O  
HETATM   19  O   UNL     1      -1.341   3.845  -1.181  1.00  0.00           O  
HETATM   20  O   UNL     1       1.028   3.006   0.013  1.00  0.00           O  
HETATM   21  O   UNL     1       1.030  -0.658   0.047  1.00  0.00           O  
HETATM   22  O   UNL     1       3.833  -0.087  -0.344  1.00  0.00           O  
HETATM   23  O   UNL     1       5.464   0.694   0.926  1.00  0.00           O  
HETATM   24  S   UNL     1      -0.747  -2.631  -0.049  1.00  0.00           S  
HETATM   25  H   UNL     1      -0.261  -0.818  -1.558  1.00  0.00           H  
HETATM   26  H   UNL     1       0.458  -4.529  -0.534  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.321  -0.096   1.213  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.029  -2.402  -0.093  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.478  -0.691   0.105  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.762  -1.252  -1.424  1.00  0.00           H  
HETATM   31  H   UNL     1       1.235  -3.149  -1.095  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.846   1.637  -1.257  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.862   4.207   0.511  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.510   4.890   1.444  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.872   5.513  -0.183  1.00  0.00           H  
HETATM   36  H   UNL     1       0.576   1.586   1.446  1.00  0.00           H  
HETATM   37  H   UNL     1       1.921   3.211   0.324  1.00  0.00           H  
HETATM   38  H   UNL     1       1.548   0.788  -1.336  1.00  0.00           H  
HETATM   39  H   UNL     1       3.254   1.849   0.174  1.00  0.00           H  
HETATM   40  H   UNL     1       2.903   0.600   1.392  1.00  0.00           H  
HETATM   41  H   UNL     1       6.171  -0.765  -1.667  1.00  0.00           H  
HETATM   42  H   UNL     1       7.102  -0.816  -0.151  1.00  0.00           H  
HETATM   43  H   UNL     1       5.820  -2.014  -0.449  1.00  0.00           H  
CONECT    1    2   21   24   25                                       
CONECT    2    1   15    5   27                                       
CONECT    3    4   16   16   15                                       
CONECT    4    3   29   30   28                                       
CONECT    5    2   32    8   18                                       
CONECT    6   18   19   19    7                                       
CONECT    7    6   34   33   35                                       
CONECT    8    5    9   36   20                                       
CONECT    9    8   38   21   10                                       
CONECT   10    9   40   39   22                                       
CONECT   11   23   23   12   22                                       
CONECT   12   11   42   43   41                                       
CONECT   13   31   26   24                                            
CONECT   14   24   24                                                 
CONECT   15    2    3                                                 
CONECT   16    3    3                                                 
CONECT   17   24   24                                                 
CONECT   18    5    6                                                 
CONECT   19    6    6                                                 
CONECT   20    8   37                                                 
CONECT   21    1    9                                                 
CONECT   22   10   11                                                 
CONECT   23   11   11                                                 
CONECT   24    1   13   14   14                                       
CONECT   24   17   17                                                 
CONECT   25    1                                                      
CONECT   26   13                                                      
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31   13                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   20                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
