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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060473
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.066
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   58.4080 1.580324  -1  3  2    2   58.4171  1.580100    0.0091  0.000224
   49.6229 1.837886   2 -1  6    2   49.6165  1.838110   -0.0064 -0.000223
   48.8271 1.866004   0  1  8    2   48.8290  1.865936    0.0019  0.000068
   43.9350 2.062065   2  0  2    2   43.9263  2.062456   -0.0087 -0.000391
   40.1790 2.246054   2 -1  3    2   40.1629  2.246922   -0.0161 -0.000867
   36.5834 2.458527   1  1  0    2   36.5827  2.458570   -0.0007 -0.000043
   30.0834 2.974429   1  0  4    2   30.1015  2.972676    0.0181  0.001753
   23.5073 3.791832   0  1  2    2   23.5243  3.789123    0.0170  0.002709

 rmse = 0.00011369909
 
     A =4.9171(6)              B =4.9171(6)               C =16.607(4)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 347.73(9)