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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050307
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.016
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   23.0845 3.852298   0  1  2    2   23.0833  3.852503   -0.0012 -0.000206
   29.4370 3.033376   1  0  4    2   29.4323  3.033855   -0.0047 -0.000479
   31.4743 2.841420   0  0  6    2   31.4670  2.842063   -0.0073 -0.000643
   36.0092 2.493137   1  1  0    2   36.0071  2.493275   -0.0021 -0.000138
   39.4511 2.283101   1  1  3    2   39.4479  2.283277   -0.0032 -0.000175
   43.2057 2.092922   2  0  2    2   43.2005  2.093161   -0.0052 -0.000239
   47.1501 1.926560   0  2  4    2   47.1581  1.926252    0.0080  0.000308
   47.5543 1.911118   0  1  8    2   47.5471  1.911391   -0.0072 -0.000273
   48.5526 1.874117   1  1  6    2   48.5485  1.874265   -0.0041 -0.000147
   56.6052 1.625048   2  1  1    2   56.6144  1.624805    0.0092  0.000242
   57.4642 1.602774   1  2  2    2   57.4506  1.603120   -0.0136 -0.000346
   60.7196 1.524379   2  1  4    2   60.7221  1.524323    0.0025  0.000056
   61.4197 1.508667   1  1  9    2   61.4251  1.508548    0.0054  0.000119
   64.7043 1.439768   3  0  0    2   64.7182  1.439493    0.0139  0.000275
   65.6540 1.421217   0  0 12    2   65.6636  1.421032    0.0096  0.000185
   72.9563 1.295888   1  2  8    2   72.9540  1.295923   -0.0023 -0.000035
   77.2190 1.234622   1  1 12    2   77.2215  1.234589    0.0025  0.000034
   81.6053 1.178972   2  1 10    2   81.5923  1.179127   -0.0130 -0.000155

 rmse = 0.00009986760
 
     A =4.9866(3)              B =4.9866(3)               C =17.052(1)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 367.21(3)