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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050089
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.026
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   16.2279 5.466195   1  1  1    2   16.2210  5.468515   -0.0069 -0.002320
   26.6211 3.348936   2  2  0    2   26.6225  3.348768    0.0014  0.000168
   31.3258 2.855450   3  1  1    2   31.3214  2.855839   -0.0044 -0.000389
   37.9860 2.368363   4  0  0    2   37.9931  2.367937    0.0071  0.000427
   46.9886 1.933197   4  2  2    2   46.9831  1.933412   -0.0055 -0.000215
   50.0139 1.823055   5  1  1    2   50.0202  1.822838    0.0063  0.000216
   54.8082 1.674300   4  4  0    2   54.8052  1.674384   -0.0030 -0.000084

 rmse = 0.00005172819
 
     A =     9.4717(4)         B =     9.4717(4)          C =     9.4717(4)      
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =    849.7(1)