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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050360
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.063
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   27.5195 3.245776   1  1  1    2   27.5238  3.245281    0.0043  0.000495
   31.8745 2.810664   2  0  0    2   31.8765  2.810495    0.0020  0.000169
   45.6725 1.987346   2  2  0    2   45.6731  1.987320    0.0006  0.000026
   54.1258 1.694864   3  1  1    2   54.1283  1.694793    0.0025  0.000072
   56.7453 1.622597   2  2  2    2   56.7436  1.622640   -0.0017 -0.000044
   66.5469 1.405170   4  0  0    2   66.5427  1.405248   -0.0042 -0.000078
   75.6574 1.256844   4  2  0    2   75.6540  1.256892   -0.0034 -0.000048
   84.3994 1.147430   4  2  2    2   84.4039  1.147380    0.0045  0.000050

 rmse = 0.00004172262
 
     A =5.62099(9)             B =5.62099(9)              C =5.62099(9)          
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 177.598(9)