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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060366
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.001
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   25.2719 3.521321   0  1  2    2   25.2661  3.522120   -0.0058 -0.000799
   32.8738 2.722307   1  0  4    2   32.8811  2.721723    0.0073  0.000584
   38.9650 2.309609   1  1  0    2   38.9631  2.309717   -0.0019 -0.000108
   43.1773 2.093536   1  1  3    2   43.1849  2.093187    0.0076  0.000349
   47.0114 1.931337   2  0  2    2   47.0084  1.931455   -0.0030 -0.000118
   51.8841 1.760825   0  2  4    2   51.8766  1.761060   -0.0075 -0.000235
   62.6446 1.481752   1  2  2    2   62.6484  1.481672    0.0038  0.000080
   66.7400 1.400417   2  1  4    2   66.7393  1.400430   -0.0007 -0.000013

 rmse = 0.00006029019
 
     A =4.6194(3)              B =4.6194(3)               C =14.855(5)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 274.52(7)