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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R070551
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.057
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   30.0961 2.972359   4  0  0    2   30.0984  2.972133    0.0023  0.000226
   33.7435 2.658399   4  2  0    2   33.7440  2.658357    0.0005  0.000042
   35.4429 2.534526   3  3  2    2   35.4412  2.534644   -0.0017 -0.000118
   37.0680 2.426884   4  2  2    2   37.0703  2.426737    0.0023  0.000147
   38.6399 2.331550   4  3  1    2   38.6402  2.331533    0.0003  0.000017
   41.6297 2.170517   5  2  1    2   41.6293  2.170539   -0.0004 -0.000022
   43.0595 2.101602   4  4  0    2   43.0592  2.101615   -0.0003 -0.000014
   47.1369 1.928654   6  1  1    2   47.1390  1.928575    0.0021  0.000080
   48.4421 1.879633   6  2  0    2   48.4391  1.879742   -0.0030 -0.000109
   53.4001 1.716026   4  4  4    2   53.4023  1.715962    0.0022  0.000065
   55.7649 1.648652   6  4  0    2   55.7652  1.648643    0.0003  0.000009
   58.0614 1.588724   6  4  2    2   58.0635  1.588672    0.0021  0.000052
   62.4986 1.486062   8  0  0    2   62.4984  1.486067   -0.0002 -0.000004
   63.5833 1.463276   7  4  1    2   63.5784  1.463377   -0.0049 -0.000101
   70.8916 1.329155   8  4  0    2   70.8902  1.329178   -0.0014 -0.000023
   72.9166 1.297125   8  4  2    2   72.9153  1.297145   -0.0013 -0.000020
   74.9185 1.267323   6  6  4    2   74.9186  1.267322    0.0001  0.000001
   79.8476 1.200963   9  4  1    2   79.8508  1.200923    0.0032  0.000040
   88.5634 1.103823   8  6  4    2   88.5635  1.103823    0.0001  0.000001

 rmse = 0.00002458316
 
     A =11.88854(8)            B =11.88854(8)             C =11.88854(8)         
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 1680.29(3)