COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.043  -3.386  -0.054  1.00  0.00           C  
HETATM    2  C   UNL     1       5.118  -2.807   1.199  1.00  0.00           C  
HETATM    3  C   UNL     1       4.375  -1.676   1.482  1.00  0.00           C  
HETATM    4  C   UNL     1       3.558  -1.124   0.513  1.00  0.00           C  
HETATM    5  C   UNL     1       3.484  -1.704  -0.740  1.00  0.00           C  
HETATM    6  C   UNL     1       4.231  -2.832  -1.025  1.00  0.00           C  
HETATM    7  C   UNL     1       2.749   0.108   0.822  1.00  0.00           C  
HETATM    8  C   UNL     1       3.268   1.267   0.010  1.00  0.00           C  
HETATM    9  C   UNL     1       1.303  -0.140   0.475  1.00  0.00           C  
HETATM   10  C   UNL     1       3.117   1.271  -1.364  1.00  0.00           C  
HETATM   11  C   UNL     1       4.220   3.393  -1.479  1.00  0.00           C  
HETATM   12  C   UNL     1       4.366   3.392  -0.104  1.00  0.00           C  
HETATM   13  C   UNL     1       3.890   2.329   0.640  1.00  0.00           C  
HETATM   14  C   UNL     1       3.594   2.334  -2.108  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.797  -0.368   0.601  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.222  -0.440   1.086  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.219   1.852   1.869  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.296   0.804   1.198  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.911   2.198   1.065  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.921  -0.120   0.185  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.710  -1.435  -1.800  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.251  -1.796  -0.636  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.817  -1.069   0.459  1.00  0.00           C  
HETATM   24  N   UNL     1       0.836  -0.449  -0.697  1.00  0.00           N  
HETATM   25  N   UNL     1       0.261  -0.088   1.324  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.848   0.883   0.961  1.00  0.00           N  
HETATM   27  O   UNL     1      -0.369  -0.583  -0.646  1.00  0.00           O  
HETATM   28  S   UNL     1      -4.587  -0.107  -1.542  1.00  0.00           S  
HETATM   29  H   UNL     1       5.623  -4.270  -0.275  1.00  0.00           H  
HETATM   30  H   UNL     1       5.755  -3.238   1.956  1.00  0.00           H  
HETATM   31  H   UNL     1       4.433  -1.223   2.461  1.00  0.00           H  
HETATM   32  H   UNL     1       2.846  -1.273  -1.497  1.00  0.00           H  
HETATM   33  H   UNL     1       4.173  -3.284  -2.004  1.00  0.00           H  
HETATM   34  H   UNL     1       2.833   0.342   1.883  1.00  0.00           H  
HETATM   35  H   UNL     1       2.628   0.444  -1.856  1.00  0.00           H  
HETATM   36  H   UNL     1       4.593   4.223  -2.061  1.00  0.00           H  
HETATM   37  H   UNL     1       4.853   4.221   0.388  1.00  0.00           H  
HETATM   38  H   UNL     1       4.004   2.328   1.714  1.00  0.00           H  
HETATM   39  H   UNL     1       3.477   2.336  -3.182  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.774  -1.162   0.485  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.235  -0.751   2.131  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.478   1.607   2.899  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.136   1.812   1.748  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.574   2.855   1.633  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.480   0.420   2.202  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.728   2.582   0.061  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.986   2.140   1.240  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.459   2.867   1.798  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.929  -1.888  -2.756  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.973  -2.595  -0.554  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.176  -1.257   1.461  1.00  0.00           H  
CONECT    1    6    2    2   29                                       
CONECT    2    1    1    3   30                                       
CONECT    3    4    4    2   31                                       
CONECT    4    5    3    3    7                                       
CONECT    5    6    6    4   32                                       
CONECT    6    5    5    1   33                                       
CONECT    7    9    4    8   34                                       
CONECT    8    7   13   13   10                                       
CONECT    9   24   24    7   25                                       
CONECT   10    8   14   14   35                                       
CONECT   11   12   12   14   36                                       
CONECT   12   13   11   11   37                                       
CONECT   13    8    8   12   38                                       
CONECT   14   10   10   11   39                                       
CONECT   15   27   16   25   25                                       
CONECT   16   26   15   40   41                                       
CONECT   17   26   42   43   44                                       
CONECT   18   20   19   26   45                                       
CONECT   19   18   46   47   48                                       
CONECT   20   28   23   23   18                                       
CONECT   21   22   22   28   49                                       
CONECT   22   21   21   23   50                                       
CONECT   23   22   20   20   51                                       
CONECT   24   27    9    9                                            
CONECT   25   15   15    9                                            
CONECT   26   18   16   17                                            
CONECT   27   24   15                                                 
CONECT   28   21   20                                                 
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
