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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050259
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.056
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   19.0368 4.671689   1  1  1    2   19.0432  4.670140    0.0064  0.001549
   31.3071 2.859780   2  2  0    2   31.3062  2.859865   -0.0009 -0.000084
   36.8812 2.438693   3  1  1    2   36.8780  2.438901   -0.0032 -0.000208
   38.5770 2.335147   2  2  2    2   38.5783  2.335070    0.0013  0.000077
   44.8418 2.021967   4  0  0    2   44.8357  2.022230   -0.0061 -0.000262
   55.6772 1.651013   4  2  2    2   55.6724  1.651144   -0.0048 -0.000131
   59.3688 1.556759   5  1  1    2   59.3707  1.556713    0.0019  0.000046
   65.2436 1.429942   4  4  0    2   65.2441  1.429932    0.0005  0.000009
   68.6348 1.367265   5  3  1    2   68.6341  1.367277   -0.0007 -0.000012
   74.1111 1.279113   6  2  0    2   74.1207  1.278970    0.0096  0.000143
   77.3316 1.233643   5  3  3    2   77.3386  1.233549    0.0070  0.000094
   82.6159 1.167554   4  4  4    2   82.6176  1.167535    0.0017  0.000019
   85.7637 1.132548   5  5  1    2   85.7518  1.132675   -0.0119 -0.000127

 rmse = 0.00007636301
 
     A =8.0889(2)              B =8.0889(2)               C =8.0889(2)           
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 529.26(4)