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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R070542
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  0.710710
 Wavelength #2 =  0.709270
 Wavelength #3 =  0.713590
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.006
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    6.6318 6.136649   1  0  2    2    6.6622  6.108676    0.0304  0.027972
   10.8868 3.740435   2 -1  3    2   10.8712  3.745787   -0.0156 -0.005352
   12.4022 3.284653   2 -1  4    2   12.3936  3.286927   -0.0086 -0.002275
   14.1086 2.888875   1  1  5    2   14.1149  2.887598    0.0063  0.001277
   22.6782 1.804163   4  1  0    2   22.6814  1.803910    0.0032  0.000253
   27.1276 1.512445   4  2  3    2   27.1260  1.512531   -0.0016 -0.000086
   32.9682 1.250036   1  1 14    2   32.9683  1.250032    0.0001  0.000004

 rmse = 0.00016650902
 
     A =9.545(2)               B =9.545(2)                C =18.133(3)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 1430.9(5)