COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  S   UNL     1       0.410   0.784   0.481  1.00  0.00           S  
HETATM    2  C   UNL     1      -3.947   1.078   0.191  1.00  0.00           C  
HETATM    3  O   UNL     1      -4.392   2.331  -0.331  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.678   3.460   0.177  1.00  0.00           C  
HETATM    5  O   UNL     1      -2.605   0.833  -0.237  1.00  0.00           O  
HETATM    6  C   UNL     1      -2.050  -0.389   0.253  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.884  -1.567  -0.257  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.366  -2.786   0.278  1.00  0.00           O  
HETATM    9  C   UNL     1      -4.337  -1.387   0.193  1.00  0.00           C  
HETATM   10  O   UNL     1      -5.137  -2.444  -0.341  1.00  0.00           O  
HETATM   11  C   UNL     1      -4.857  -0.041  -0.322  1.00  0.00           C  
HETATM   12  O   UNL     1      -6.188   0.170   0.153  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.610  -0.530  -0.242  1.00  0.00           C  
HETATM   14  C   UNL     1       3.019   1.564   0.209  1.00  0.00           C  
HETATM   15  C   UNL     1       4.417   1.247  -0.330  1.00  0.00           C  
HETATM   16  C   UNL     1       4.852  -0.127   0.186  1.00  0.00           C  
HETATM   17  C   UNL     1       3.816  -1.173  -0.235  1.00  0.00           C  
HETATM   18  C   UNL     1       4.212  -2.539   0.328  1.00  0.00           C  
HETATM   19  C   UNL     1       2.053   0.454  -0.213  1.00  0.00           C  
HETATM   20  O   UNL     1       2.573   2.813  -0.325  1.00  0.00           O  
HETATM   21  O   UNL     1       5.340   2.241   0.121  1.00  0.00           O  
HETATM   22  O   UNL     1       6.124  -0.466  -0.369  1.00  0.00           O  
HETATM   23  O   UNL     1       2.532  -0.802   0.273  1.00  0.00           O  
HETATM   24  O   UNL     1       3.310  -3.535  -0.159  1.00  0.00           O  
HETATM   25  H   UNL     1      -3.982   1.104   1.280  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.076   4.372  -0.267  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.792   3.504   1.260  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.622   3.364  -0.073  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.061  -0.382   1.343  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.840  -1.600  -1.346  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.847  -3.576  -0.004  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.387  -1.407   1.281  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.071  -2.393  -0.096  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.853  -0.043  -1.412  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.578   1.007  -0.132  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.590  -0.449  -1.329  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.216  -1.502   0.057  1.00  0.00           H  
HETATM   38  H   UNL     1       3.052   1.625   1.297  1.00  0.00           H  
HETATM   39  H   UNL     1       4.395   1.238  -1.420  1.00  0.00           H  
HETATM   40  H   UNL     1       4.922  -0.102   1.273  1.00  0.00           H  
HETATM   41  H   UNL     1       3.774  -1.226  -1.323  1.00  0.00           H  
HETATM   42  H   UNL     1       5.226  -2.782   0.012  1.00  0.00           H  
HETATM   43  H   UNL     1       4.167  -2.510   1.417  1.00  0.00           H  
HETATM   44  H   UNL     1       1.989   0.422  -1.301  1.00  0.00           H  
HETATM   45  H   UNL     1       1.691   3.075  -0.027  1.00  0.00           H  
HETATM   46  H   UNL     1       5.125   3.138  -0.170  1.00  0.00           H  
HETATM   47  H   UNL     1       6.830   0.156  -0.142  1.00  0.00           H  
HETATM   48  H   UNL     1       3.501  -4.428   0.158  1.00  0.00           H  
CONECT    1   19   13                                                 
CONECT    2    3   11    5   25                                       
CONECT    3    4    2                                                 
CONECT    4    3   26   27   28                                       
CONECT    5    2    6                                                 
CONECT    6    5    7   13   29                                       
CONECT    7    9    6    8   30                                       
CONECT    8    7   31                                                 
CONECT    9   11   10    7   32                                       
CONECT   10    9   33                                                 
CONECT   11   12    2    9   34                                       
CONECT   12   11   35                                                 
CONECT   13    6    1   36   37                                       
CONECT   14   19   15   20   38                                       
CONECT   15   16   21   14   39                                       
CONECT   16   17   22   15   40                                       
CONECT   17   18   23   16   41                                       
CONECT   18   24   17   42   43                                       
CONECT   19   23    1   14   44                                       
CONECT   20   14   45                                                 
CONECT   21   15   46                                                 
CONECT   22   16   47                                                 
CONECT   23   17   19                                                 
CONECT   24   18   48                                                 
CONECT   25    2                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   24                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
