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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R040027
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.069
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   31.2816 2.863198   2  2  0    2   31.2795  2.863389   -0.0021 -0.000191
   36.8451 2.441821   3  1  1    2   36.8438  2.441907   -0.0013 -0.000086
   44.7876 2.024839   4  0  0    2   44.7903  2.024722    0.0027  0.000117
   49.0497 1.858148   3  3  1    2   49.0535  1.858012    0.0038  0.000136
   55.6120 1.653145   4  2  2    2   55.6108  1.653179   -0.0012 -0.000033
   59.2993 1.558724   5  1  1    2   59.3032  1.558632    0.0039  0.000093
   65.1743 1.431545   4  4  0    2   65.1667  1.431695   -0.0076 -0.000149
   74.0310 1.280489   6  2  0    2   74.0271  1.280547   -0.0039 -0.000058
   77.2330 1.235145   5  3  3    2   77.2386  1.235069    0.0056  0.000076

 rmse = 0.00005647531
 
     A =     8.0988(2)         B =     8.0988(2)          C =     8.0988(2)      
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =    531.22(4)