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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060129
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.058
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   10.8800 8.168095   0  0  2    2   10.8792  8.168697   -0.0008 -0.000602
   27.2066 3.281839   1  0  0    2   27.2059  3.281923   -0.0007 -0.000084
   27.7770 3.215588   1  0  1    2   27.7590  3.217642   -0.0180 -0.002054
   29.3598 3.045395   1  0  2    2   29.3605  3.045328    0.0007  0.000067
   31.8635 2.811148   1  0  3    2   31.8660  2.810931    0.0025  0.000217
   32.9245 2.722782   0  0  6    2   32.9231  2.722899   -0.0014 -0.000117
   38.9269 2.315018   1  0  5    2   38.9177  2.315546   -0.0092 -0.000528
   44.3689 2.042510   0  0  8    2   44.3766  2.042174    0.0077  0.000336
   52.7957 1.734274   1  0  8    2   52.8079  1.733901    0.0122  0.000373
   57.2669 1.608896   2  0  2    2   57.2698  1.608821    0.0029  0.000075
   69.4629 1.352989   1  0 11    2   69.4558  1.353110   -0.0071 -0.000122

 rmse = 0.00008211171
 
     A =3.7896(4)              B =3.7896(4)               C =16.337(1)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 203.19(4)