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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060108
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.080
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   15.2852 5.822003   0  4  1    2   15.2748  5.825961   -0.0104 -0.003958
   11.2601 7.907304   0  2  2    2   11.2523  7.912813   -0.0078 -0.005510
   20.4102 4.364471  -1  0  4    2   20.4081  4.364910   -0.0021 -0.000439
   26.8519 3.327160   1  3  4    2   26.8503  3.327357   -0.0016 -0.000197
   18.5730 4.793702   0  2  4    2   18.5714  4.794115   -0.0016 -0.000413
   18.0129 4.942139  -1  1  3    2   18.0125  4.942256   -0.0004 -0.000118
   22.9783 3.880471  -1  4  3    2   22.9783  3.880474    0.0000 -0.000003
   13.3052 6.688825   0  1  3    2   13.3053  6.688763    0.0001  0.000062
   19.6446 4.533496   1  2  2    2   19.6448  4.533443    0.0002  0.000053
   19.1036 4.661181  -1  2  3    2   19.1052  4.660800    0.0016  0.000380
    9.2934 9.590237   0  1  2    2    9.2953  9.588231    0.0019  0.002006
   23.6475 3.771780   0  6  2    2   23.6498  3.771414    0.0023  0.000366
   19.3938 4.591795   1  3  1    2   19.3968  4.591086    0.0030  0.000709
   14.7293 6.041651   0  2  3    2   14.7426  6.036216    0.0133  0.005435

 rmse = 0.00002302834
 
     A =6.180(1)               B =24.268(4)               C =21.217(4)           
 Alpha =90                  Beta =100.31(1)           Gamma =90                  
 
 Volume = 3130.9(6)