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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050112
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.033
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   31.0289 2.882759   4  0  0    2   31.0298  2.882674    0.0009  0.000086
   34.7955 2.578543   4  2  0    2   34.7983  2.578342    0.0028  0.000201
   36.5490 2.458643   3  3  2    2   36.5535  2.458352    0.0045  0.000291
   38.2421 2.353500   4  2  2    2   38.2388  2.353693   -0.0033 -0.000193
   39.8682 2.261096   4  3  1    2   39.8634  2.261355   -0.0048 -0.000260
   42.9600 2.105126   5  2  1    2   42.9583  2.105207   -0.0017 -0.000081
   48.6684 1.870546   6  1  1    2   48.6690  1.870526    0.0006  0.000020
   50.0184 1.823143   6  2  0    2   50.0178  1.823163   -0.0006 -0.000020
   55.1669 1.664452   4  4  4    2   55.1719  1.664312    0.0050  0.000139
   57.6319 1.598942   6  4  0    2   57.6288  1.599020   -0.0031 -0.000077
   60.0192 1.540887   6  4  2    2   60.0206  1.540854    0.0014  0.000033
   64.6425 1.441337   8  0  0    2   64.6425  1.441337    0.0000  0.000000
   73.4159 1.289164   8  4  0    2   73.4154  1.289171   -0.0005 -0.000007
   75.5441 1.258027   8  4  2    2   75.5388  1.258102   -0.0053 -0.000075
   77.6374 1.229238   6  6  4    2   77.6421  1.229176    0.0047  0.000062

 rmse = 0.00003873263
 
     A =    11.5306(1)         B =    11.5306(1)          C =    11.5306(1)      
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =   1533.08(6)