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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060593
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.037
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   14.8094 5.991813   1  1  0    2   14.8295  5.983702    0.0201  0.008110
   20.9441 4.245442   1  1  1    2   20.9512  4.244008    0.0071  0.001433
   23.4277 3.799978   1  2  0    2   23.4020  3.804107   -0.0257 -0.004129
   34.8794 2.572811   0  3  1    2   34.8840  2.572485    0.0046  0.000326
   38.2911 2.350834   2  1  2    2   38.2863  2.351115   -0.0048 -0.000281
   45.1546 2.007873   1  3  2    2   45.1588  2.007698    0.0042  0.000176
   48.0459 1.893482   3  3  1    2   48.0492  1.893362    0.0033  0.000121
   49.1128 1.854785   2  3  2    2   49.1148  1.854712    0.0020  0.000072
   53.2123 1.721047   4  0  2    2   53.2149  1.720970    0.0026  0.000077
   55.2411 1.662501   3  3  2    2   55.2344  1.662687   -0.0067 -0.000186

 rmse = 0.00007942490
 
     A =8.390(2)               B =8.536(2)                C =6.020(2)            
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 431.18(7)