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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050438
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.021
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   21.2790 4.176096   2  1  1    2   21.2918  4.173615    0.0128  0.002481
   24.6234 3.615460   2  2  0    2   24.6303  3.614457    0.0069  0.001003
   30.2851 2.950752   2  2  2    2   30.2805  2.951192   -0.0046 -0.000440
   32.7697 2.732335   3  2  1    2   32.7705  2.732272    0.0008  0.000062
   35.0949 2.556339   4  0  0    2   35.1024  2.555807    0.0075  0.000532
   37.3115 2.409320   3  3  0    2   37.3064  2.409638   -0.0051 -0.000318
   45.2012 2.005225   4  3  1    2   45.2080  2.004940    0.0068  0.000285
   48.7738 1.866306   5  2  1    2   48.7685  1.866497   -0.0053 -0.000192
   50.4813 1.807084   4  4  0    2   50.4770  1.807228   -0.0043 -0.000145
   55.3790 1.658235   6  1  1    2   55.3721  1.658426   -0.0069 -0.000191
   59.9902 1.541276   6  2  2    2   59.9931  1.541210    0.0029  0.000067
   62.9557 1.475596   4  4  4    2   62.9557  1.475596    0.0000  0.000000
   82.1392 1.172711   6  6  2    2   82.1414  1.172685    0.0022  0.000026

 rmse = 0.00005331683
 
     A =    10.2232(2)         B =    10.2232(2)          C =    10.2232(2)      
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =   1068.47(7)