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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060400
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.020
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   15.0582 5.886556   1  0  1    2   15.0582  5.886546    0.0000  0.000011
   15.4836 5.725560   0  0  3    2   15.4739  5.729121   -0.0097 -0.003562
   17.5121 5.065878   0  1  2    2   17.5229  5.062764    0.0108  0.003114
   24.6073 3.617706   1  1  0    2   24.6096  3.617376    0.0023  0.000331
   29.2009 3.057815   1  1  3    2   29.1923  3.058696   -0.0086 -0.000881
   30.3880 2.940932   2  0  2    2   30.3633  2.943273   -0.0247 -0.002341
   31.2205 2.864332   0  0  6    2   31.2179  2.864561   -0.0026 -0.000228
   35.4357 2.532476   0  2  4    2   35.4515  2.531382    0.0158  0.001094
   38.3435 2.346745   2  1  1    2   38.3567  2.345965    0.0132  0.000780
   60.0050 1.540918   0  4  2    2   60.0023  1.540981   -0.0027 -0.000063

 rmse = 0.00009737707
 
     A =7.2348(8)              B =7.2348(8)               C =17.187(6)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 779.1(0)