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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R080129
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:    0.053
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   18.6793 4.733119   1  0  0    2   18.6696  4.735539   -0.0097 -0.002419
   21.3373 4.150598   0  1  2    2   21.3511  4.147945    0.0138  0.002653
   25.2977 3.510433   0  2  1    2   25.2900  3.511478   -0.0077 -0.001045
   25.8687 3.434386  -1  0  2    2   25.8708  3.434118    0.0021  0.000268
   28.5073 3.122807  -1  1  2    2   28.5077  3.122763    0.0004  0.000044
   29.3584 3.034348   0  1  3    2   29.3546  3.034727   -0.0038 -0.000379
   30.3080 2.941571   1  2  0    2   30.3122  2.941177    0.0042  0.000394
   31.6532 2.819770   1  2  1    2   31.6541  2.819692    0.0009  0.000078
   35.0102 2.557107  -1  1  3    2   35.0092  2.557177   -0.0010 -0.000071

 rmse = 0.00004884378
 
     A =4.736(2)               B =7.505(2)                C =9.954(2)            
 Alpha =90                  Beta =90.11(3)            Gamma =90                  
 
 Volume = 353.8(1)