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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050641
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.054
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   15.6619 5.673022   1  1  0    2   15.6605  5.673517   -0.0014 -0.000495
   26.3921 3.381083   2  0  0    2   26.3859  3.381862   -0.0062 -0.000779
   26.8963 3.318706   1  2  1    2   26.8952  3.318836   -0.0011 -0.000130
   28.9205 3.090422   1  3  0    2   28.9240  3.090053    0.0035  0.000369
   34.4483 2.605324   0  4  0    2   34.4483  2.605323    0.0000  0.000001
   35.8816 2.504313   1  1  2    2   35.8826  2.504245    0.0010  0.000068
   41.9873 2.152702   2  0  2    2   41.9910  2.152520    0.0037  0.000182
   46.5235 1.952573   0  5  1    2   46.5236  1.952569    0.0001  0.000004
   55.3734 1.659318   2  4  2    2   55.3698  1.659418   -0.0036 -0.000100
   60.4899 1.530500   3  5  0    2   60.4914  1.530467    0.0015  0.000034

 rmse = 0.00002928071
 
     A =     6.7637(5)         B =    10.4212(5)          C =     5.5816(4)      
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =    393.43(3)