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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060135
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.066
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   13.8650 6.412082   1  0  1    2   13.8595  6.414639   -0.0055 -0.002557
   17.5182 5.077240   1  0  2    2   17.5312  5.073483    0.0130  0.003757
   27.8421 3.209143   1  0  4    2   27.8329  3.210187   -0.0092 -0.001044
   38.2012 2.357872   2  1  3    2   38.1953  2.358220   -0.0059 -0.000348
   41.7876 2.163102   3 -1  4    2   41.7917  2.162901    0.0041  0.000201
   46.0695 1.971235   2  1  5    2   46.0744  1.971038    0.0049  0.000197
   68.2076 1.374966   2  1  9    2   68.2070  1.374977   -0.0006 -0.000010
   69.7097 1.348938   6 -2  1    2   69.7092  1.348946   -0.0005 -0.000008

 rmse = 0.00004971787
 
     A =     8.2788(4)         B =     8.2788(4)          C =    14.3606(9)      
 Alpha =    90.             Beta =    90.             Gamma =   120.             
 
 Volume =    852.39(7)