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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060090
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.060
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   12.4645 7.129838   1  0  0    2   12.4653  7.129378    0.0008  0.000460
   15.8329 5.613959   0  0  2    2   15.8285  5.615532   -0.0044 -0.001572
   16.7196 5.317097   0  1  1    2   16.7261  5.315048    0.0065  0.002049
   25.0189 3.564674   2  0  0    2   25.0188  3.564689   -0.0001 -0.000014
   30.8113 2.905139   1  1  3    2   30.8113  2.905139    0.0000  0.000000
   33.7592 2.657439   0  2  2    2   33.7581  2.657524   -0.0011 -0.000085
   57.9920 1.590541   0  2  6    2   57.9922  1.590537    0.0002  0.000004

 rmse = 0.00001960564
 
     A =7.1294(9)              B =6.0334(6)               C =11.2311(6)          
 Alpha =90                  Beta =89.99(2)            Gamma =90                  
 
 Volume = 483.10(7)