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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060155
 
 Symmetry constraint is: TRICLINIC   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.038
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   18.9542 4.687393  -1 -2  1    2   18.9422  4.690354   -0.0120 -0.002960
   12.9567 6.846799   0 -1  1    2   12.9510  6.849818   -0.0057 -0.003019
   14.3558 6.180760   0  3  0    2   14.3522  6.182290   -0.0036 -0.001530
   15.8526 5.598997  -1  1  1    2   15.8503  5.599803   -0.0023 -0.000806
   29.2753 3.051968   1  4  1    2   29.2752  3.051979   -0.0001 -0.000011
   22.8406 3.896534   1  2  1    2   22.8405  3.896550   -0.0001 -0.000015
   21.1432 4.205918  -1  4  0    2   21.1437  4.205821    0.0005  0.000097
   22.0768 4.029817  -1 -3  1    2   22.0818  4.028918    0.0050  0.000900
    9.5605 9.279602   0  2  0    2    9.5668  9.273435    0.0063  0.006166
   12.3011 7.211310   0  0  1    2   12.3080  7.207299    0.0069  0.004012
   16.6281 5.338986  -1 -1  1    2   16.6371  5.336112    0.0090  0.002874

 rmse = 0.00003686333
 
     A =7.358(6)               B =18.799(7)               C =7.386(5)            
 Alpha =91.26(5)            Beta =102.22(5)           Gamma =98.83(3)            
 
 Volume = 985.1(0)