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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R061069
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.038
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   15.9780 5.555391   0  0  4    2   15.9745  5.556617   -0.0035 -0.001226
   19.9628 4.452440   1  0  2    2   19.9721  4.450378    0.0093  0.002062
   24.0433 3.704039   0  0  6    2   24.0409  3.704411   -0.0024 -0.000372
   31.9200 2.804617   1  1  0    2   31.9262  2.804086    0.0062  0.000531
   32.2491 2.776710   0  0  8    2   32.2301  2.778308   -0.0190 -0.001599
   32.9538 2.718855   1  1  2    2   32.9536  2.718873   -0.0002 -0.000018
   33.7376 2.657389   1  0  7    2   33.7341  2.657655   -0.0035 -0.000266
   35.8778 2.503455   1  1  4    2   35.8788  2.503388    0.0010  0.000066
   37.9201 2.373051   2  0  2    2   37.9304  2.372430    0.0103  0.000621
   39.0406 2.307416   2  0  3    2   39.0372  2.307612   -0.0034 -0.000196
   42.4190 2.130967   2  0  5    2   42.4153  2.131143   -0.0037 -0.000176
   44.6197 2.030751   2  0  6    2   44.6157  2.030923   -0.0040 -0.000172
   49.8655 1.828545   2  0  8    2   49.8693  1.828416    0.0038  0.000129
   60.4223 1.531673   2  1  8    2   60.4262  1.531584    0.0039  0.000089
   66.6844 1.402139   2  2  0    2   66.6896  1.402043    0.0052  0.000096
   70.8873 1.328914   2  0 14    2   70.8926  1.328827    0.0053  0.000087
   76.8497 1.239933   3  1  7    2   76.8402  1.240063   -0.0095 -0.000130

 rmse = 0.00007012283
 
     A =5.6082(2)              B =5.6082(2)               C =22.226(2)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 605.40(5)