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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060355

 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.035
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   14.1127 6.285779   1  1  0    2   14.1196  6.282713    0.0069  0.003066
   20.0027 4.442945   2  0  0    2   20.0045  4.442549    0.0018  0.000396
   24.5538 3.627598   2  1  1    2   24.5557  3.627326    0.0019  0.000272
   31.8557 2.809870   3  1  0    2   31.8575  2.809715    0.0018  0.000155
   34.9887 2.564855   2  2  2    2   34.9880  2.564907   -0.0007 -0.000052
   37.8918 2.374571   3  2  1    2   37.8906  2.374642   -0.0012 -0.000071
   40.6112 2.221482   4  0  0    2   40.6152  2.221275    0.0040  0.000208
   43.1959 2.094246   3  3  0    2   43.1961  2.094238    0.0002  0.000008
   45.6580 1.986788   4  2  0    2   45.6585  1.986768    0.0005  0.000020
   48.0216 1.894300   3  3  2    2   48.0214  1.894309   -0.0002 -0.000009
   50.3015 1.813596   4  2  2    2   50.2995  1.813663   -0.0020 -0.000068
   52.5105 1.742331   4  3  1    2   52.5047  1.742511   -0.0058 -0.000180
   56.7338 1.622163   5  2  1    2   56.7328  1.622190   -0.0010 -0.000027
   58.7690 1.570711   4  4  0    2   58.7703  1.570678    0.0013  0.000032
   60.7652 1.523772   5  3  0    2   60.7648  1.523782   -0.0004 -0.000010
   62.7204 1.480863   6  0  0    2   62.7210  1.480850    0.0006  0.000014
   64.6446 1.441329   5  3  2    2   64.6434  1.441353   -0.0012 -0.000024
   68.3992 1.371031   5  4  1    2   68.4010  1.371000    0.0018  0.000031
   70.2411 1.339503   6  2  2    2   70.2426  1.339479    0.0015  0.000024

 rmse = 0.00002306159
 
     A =8.88510(7)             B =8.88510(7)              C =8.88510(7)          
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 701.43(2)