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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R040035
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.077
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   25.0853 3.557757   0  1  2    2   25.0881  3.557361    0.0028  0.000396
   32.5734 2.753009   1  0  4    2   32.5610  2.754032   -0.0124 -0.001023
   38.6922 2.329689   1  1  0    2   38.6913  2.329739   -0.0009 -0.000050
   42.8294 2.113327   1  1  3    2   42.8246  2.113555   -0.0048 -0.000228
   46.6338 1.949109   2  0  2    2   46.6372  1.948973    0.0034  0.000135
   51.3894 1.779073   0  2  4    2   51.4016  1.778680    0.0122  0.000393
   61.0840 1.517530   2  1  1    2   61.0888  1.517423    0.0048  0.000108
   62.1164 1.494733   1  2  2    2   62.1103  1.494866   -0.0061 -0.000133
   68.1040 1.377012   2  0  8    2   68.1038  1.377016   -0.0002 -0.000004
   69.9528 1.345032   3  0  0    2   69.9502  1.345075   -0.0026 -0.000043

 rmse = 0.00007461267
 
     A =     4.6594(2)         B =     4.6594(2)          C =    15.072(2)       
 Alpha =    90.             Beta =    90.             Gamma =   120.             
 
 Volume =    283.38(4)