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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060450
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.046
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   31.0979 2.877702   4  0  0    2   31.0982  2.877676    0.0003  0.000026
   34.8738 2.573868   4  2  0    2   34.8738  2.573871    0.0000 -0.000003
   36.6342 2.453966   3  3  2    2   36.6323  2.454090   -0.0019 -0.000124
   38.3213 2.349590   4  2  2    2   38.3209  2.349612   -0.0004 -0.000022
   39.9471 2.257521   4  3  1    2   39.9487  2.257435    0.0016  0.000087
   43.0499 2.101547   5  2  1    2   43.0497  2.101557   -0.0002 -0.000010
   48.7725 1.867267   6  1  1    2   48.7721  1.867283   -0.0004 -0.000016
   55.2892 1.661421   4  4  4    2   55.2890  1.661427   -0.0002 -0.000006
   57.7499 1.596286   6  4  0    2   57.7514  1.596247    0.0015  0.000039
   60.1471 1.538219   6  4  2    2   60.1487  1.538182    0.0016  0.000037
   64.7853 1.438763   8  0  0    2   64.7815  1.438838   -0.0038 -0.000075
   73.5773 1.286930   8  4  0    2   73.5769  1.286936   -0.0004 -0.000005
   75.6968 1.256053   8  4  2    2   75.7062  1.255921    0.0094  0.000132
   77.8227 1.226947   6  6  4    2   77.8153  1.227045   -0.0074 -0.000098

 rmse = 0.00005028314
 
     A =    11.5107(2)         B =    11.5107(2)          C =    11.5107(2)      
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =   1525.12(8)