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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R061105
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.033
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    9.9685 8.894925   0  2  0    2    9.9829  8.882119    0.0144  0.012807
   10.5175 8.430375   0  0  1    2   10.5252  8.424206    0.0077  0.006169
   12.8470 6.902584   1  1  0    2   12.8517  6.900069    0.0047  0.002515
   18.0524 4.918640  -1  1  2    2   18.0571  4.917365    0.0047  0.001276
   20.4774 4.340373   1  1  1    2   20.4810  4.339608    0.0036  0.000765
   22.6534 3.927531   0  4  1    2   22.6473  3.928577   -0.0061 -0.001046
   22.9809 3.872215  -1  3  2    2   22.9833  3.871819    0.0024  0.000397
   24.9622 3.568774   1  3  1    2   24.9517  3.570253   -0.0105 -0.001479
   25.8384 3.449553   2  2  0    2   25.8347  3.450035   -0.0037 -0.000482
   26.7734 3.331022  -2  0  3    2   26.7730  3.331076   -0.0004 -0.000054
   27.7983 3.210349   1  5  0    2   27.8026  3.209866    0.0043  0.000484
   29.1336 3.066008  -2  4  2    2   29.1340  3.065969    0.0004  0.000039
   30.6389 2.918556  -1  5  2    2   30.6402  2.918430    0.0013  0.000125
   31.2528 2.862552   2  4  0    2   31.2532  2.862511    0.0004  0.000040
   33.2105 2.697980  -3  3  2    2   33.2081  2.698170   -0.0024 -0.000190
   35.0740 2.558651  -2  0  4    2   35.0738  2.558665   -0.0002 -0.000014
   48.6263 1.872051   4  0  0    2   48.6275  1.872006    0.0012  0.000045

 rmse = 0.00002842928
 
     A =9.0975(9)              B =17.764(2)               C =10.2349(8)          
 Alpha =90                  Beta =124.605(9)          Gamma =90                  
 
 Volume = 1361.4(2)