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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050377
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.036
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   20.8199 4.270219   2  2  0    2   20.8114  4.271946   -0.0085 -0.001727
   29.5829 3.020696   4  0  0    2   29.5826  3.020722   -0.0003 -0.000026
   33.1557 2.702549   4  2  0    2   33.1650  2.701816    0.0093  0.000734
   34.8357 2.575832   3  3  2    2   34.8322  2.576080   -0.0035 -0.000249
   36.4362 2.466162   4  2  2    2   36.4324  2.466409   -0.0038 -0.000247
   37.9809 2.369244   4  3  1    2   37.9742  2.369649   -0.0067 -0.000405
   40.9133 2.205797   5  2  1    2   40.9089  2.206023   -0.0044 -0.000226
   46.3190 1.959970   6  1  1    2   46.3157  1.960103   -0.0033 -0.000133
   54.7726 1.675574   6  4  0    2   54.7719  1.675595   -0.0007 -0.000021
   57.0225 1.614647   6  4  2    2   57.0226  1.614644    0.0001  0.000004
   71.5270 1.318548   8  4  2    2   71.5393  1.318351    0.0123  0.000197
   73.4835 1.288181   6  6  4    2   73.4928  1.288040    0.0093  0.000141
   86.7678 1.121783   8  6  4    2   86.7596  1.121868   -0.0082 -0.000085
   88.6282 1.102971  10  4  2    2   88.6241  1.103012   -0.0041 -0.000040

 rmse = 0.00007899747
 
     A =    12.0828(3)         B =    12.0828(3)          C =    12.0828(3)      
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =   1764.0(1)