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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050657
 
 Symmetry constraint is: TRICLINIC   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.053
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   13.1338 6.762453   0  0  1    2   13.1471  6.755616    0.0133  0.006837
   14.2885 6.216421   0  1  0    2   14.2961  6.213125    0.0076  0.003296
   16.9749 5.235124   0 -1  1    2   16.9832  5.232570    0.0083  0.002555
   23.3819 3.809850   1 -1  1    2   23.3856  3.809256    0.0037  0.000594
   25.2495 3.531533   1  0  1    2   25.2436  3.532350   -0.0059 -0.000817
   26.4228 3.377003   0  0  2    2   26.4164  3.377808   -0.0064 -0.000805
   26.9215 3.315445   0 -1  2    2   26.9201  3.315612   -0.0014 -0.000168
   33.9473 2.642553   1  1  1    2   33.9447  2.642747   -0.0026 -0.000194
   42.8741 2.110070  -1 -2  2    2   42.8767  2.109946    0.0026  0.000124
   50.0631 1.822289  -1 -2  3    2   50.0628  1.822297   -0.0003 -0.000009
   53.9465 1.699785   1 -4  1    2   53.9448  1.699834   -0.0017 -0.000049
   63.8675 1.457355  -1  3  3    2   63.8687  1.457331    0.0012  0.000024
   64.8423 1.437763   3 -2  2    2   64.8431  1.437747    0.0008  0.000016
   67.1893 1.393090  -3  1  3    2   67.1886  1.393102   -0.0007 -0.000012

 rmse = 0.00003472540
 
     A =     4.9358(2)         B =     6.8086(3)          C =     6.9775(7)      
 Alpha =   101.158(4)       Beta =    94.736(3)       Gamma =   110.067(7)       
 
 Volume =    213.25(1)