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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060416
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.072
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   14.1622 6.280294   1  1  0    2   14.1636  6.279656    0.0014  0.000637
   20.0475 4.441260   2  0  0    2   20.0515  4.440388    0.0040  0.000872
   22.4320 3.972736   2  1  0    2   22.4385  3.971603    0.0065  0.001133
   24.6064 3.625348   2  1  1    2   24.6049  3.625561   -0.0015 -0.000213
   31.9129 2.808146   3  1  0    2   31.9105  2.808348   -0.0024 -0.000202
   35.0445 2.563529   2  2  2    2   35.0427  2.563659   -0.0018 -0.000130
   37.9474 2.373457   3  2  1    2   37.9469  2.373487   -0.0005 -0.000031
   40.6698 2.220358   4  0  0    2   40.6729  2.220194    0.0031  0.000164
   43.2565 2.093162   4  1  1    2   43.2553  2.093219   -0.0012 -0.000056
   45.7193 1.985793   4  2  0    2   45.7191  1.985802   -0.0002 -0.000009
   48.0851 1.893322   3  3  2    2   48.0833  1.893388   -0.0018 -0.000066
   50.3661 1.812670   4  2  2    2   50.3628  1.812781   -0.0033 -0.000111
   52.5691 1.741669   4  3  1    2   52.5693  1.741663    0.0002  0.000006
   56.7988 1.621432   5  2  1    2   56.8000  1.621400    0.0012  0.000032
   58.8387 1.569918   4  4  0    2   58.8389  1.569914    0.0002  0.000004
   60.8325 1.523088   5  3  0    2   60.8346  1.523040    0.0021  0.000048
   62.7912 1.480150   6  0  0    2   62.7922  1.480129    0.0010  0.000020
   64.7177 1.440614   5  3  2    2   64.7158  1.440652   -0.0019 -0.000038
   68.4761 1.370332   5  4  1    2   68.4760  1.370333   -0.0001 -0.000002
   70.3198 1.338813   6  2  2    2   70.3189  1.338827   -0.0009 -0.000015
   72.1388 1.309430   6  3  1    2   72.1408  1.309399    0.0020  0.000031
   73.9430 1.281846   4  4  4    2   73.9441  1.281830    0.0011  0.000016
   79.2660 1.208505   7  2  1    2   79.2648  1.208520   -0.0012 -0.000016
   82.7566 1.166110   7  3  0    2   82.7572  1.166103    0.0006  0.000007
   86.2228 1.127856   6  5  1    2   86.2225  1.127860   -0.0003 -0.000003
   89.6741 1.093144   7  4  1    2   89.6737  1.093148   -0.0004 -0.000004

 rmse = 0.00001853188
 
     A =     8.88077(4)        B =     8.88077(4)         C =     8.88077(4)     
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =    700.410(9)