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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
 ******************************************************************************
 
 R060299

 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.022
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   25.4830 3.495419   2  1  1    2   25.4772  3.496200   -0.0058 -0.000780
   35.9418 2.498038   1  2  4    2   35.9367  2.498381   -0.0051 -0.000344
   27.7405 3.215657   2  1  2    2   27.7374  3.216012   -0.0031 -0.000356
   21.7255 4.091326   1  0  3    2   21.7236  4.091682   -0.0019 -0.000355
   31.6941 2.822692   1  2  3    2   31.6926  2.822824   -0.0015 -0.000132
   29.7465 3.003054   1  1  4    2   29.7462  3.003088   -0.0003 -0.000034
   46.5609 1.949788   4  1  1    2   46.5607  1.949795   -0.0002 -0.000007
   41.7048 2.165015  -2  3  1    2   41.7048  2.165016    0.0000 -0.000001
   54.8687 1.672471  -1  4  4    2   54.8688  1.672470    0.0001  0.000002
   44.2556 2.045905   2  0  6    2   44.2570  2.045841    0.0014  0.000064
   15.7457 5.631191   1  1  0    2   15.7479  5.630426    0.0022  0.000766
   34.2547 2.617188   2  2  2    2   34.2569  2.617022    0.0022  0.000166
   20.1290 4.412424  -1  1  2    2   20.1322  4.411724    0.0032  0.000700
   31.1629 2.869619  -2  1  3    2   31.1685  2.869118    0.0056  0.000501
   22.8018 3.900398   0  2  0    2   22.8077  3.899407    0.0059  0.000991

 rmse = 0.00002551394
 
     A =8.1372(4)              B =7.7988(3)               C =14.2010(9)          
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 901.20(6)