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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R070240
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:    0.010
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   33.1828 2.696771   1  0  4    2   33.1852  2.696584    0.0024  0.000187
   35.6418 2.516203   1  1  0    2   35.6430  2.516123    0.0012  0.000079
   40.8904 2.204609   1  1  3    2   40.8849  2.204894   -0.0055 -0.000285
   49.4956 1.839667   0  2  4    2   49.4958  1.839659    0.0002  0.000008
   54.1142 1.693080   1  1  6    2   54.1191  1.692938    0.0049  0.000142
   62.4877 1.484855   2  1  4    2   62.4783  1.485056   -0.0094 -0.000202
   64.0273 1.452819   3  0  0    2   64.0339  1.452684    0.0066  0.000134

 rmse = 0.00007686016
 
     A =5.0322(3)              B =5.0322(3)               C =13.730(3)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 301.12(5)