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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060186
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.022
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   16.0379 5.529098   2  2  0    2   16.0458  5.526396    0.0079  0.002701
   16.7191 5.305032   1  3  0    2   16.7047  5.309590   -0.0144 -0.004558
   20.2189 4.392980   3  2  0    2   20.2238  4.391935    0.0049  0.001045
   22.5535 3.942811   2  0  1    2   22.5600  3.941680    0.0065  0.001131
   23.9766 3.711703   2  1  1    2   23.9704  3.712656   -0.0062 -0.000953
   25.9110 3.438592   5  1  0    2   25.9127  3.438364    0.0017  0.000228
   26.5942 3.351713   3  1  1    2   26.5797  3.353510   -0.0145 -0.001797
   29.7174 3.005927   1  4  1    2   29.7278  3.004903    0.0104  0.001024
   31.9022 2.804737   3  3  1    2   31.9022  2.804741    0.0000 -0.000003
   32.2601 2.774412   2  4  1    2   32.2517  2.775116   -0.0084 -0.000703
   39.8325 2.262411   2  6  1    2   39.8288  2.262615   -0.0037 -0.000204
   41.7571 2.162422   0  0  2    2   41.7510  2.162722   -0.0061 -0.000300
   42.3732 2.132379   4  5  1    2   42.3700  2.132533   -0.0032 -0.000154
   43.9876 2.057751   2  7  1    2   43.9972  2.057322    0.0096  0.000429
   48.3696 1.880986   8  2  1    2   48.3707  1.880947    0.0011  0.000039
   49.7737 1.831139   5  1  2    2   49.7868  1.830688    0.0131  0.000451
   63.5931 1.462343   4  7  2    2   63.5873  1.462463   -0.0058 -0.000120

 rmse = 0.00006855167
 
     A =22.106(2)              B =22.106(2)               C =4.3254(5)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 1830.5(0)