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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060060
 
 Symmetry constraint is: TETRAGONAL  
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.040
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   11.0274 8.045922   0  0  2    2   11.0346  8.040689    0.0072  0.005233
   20.0429 4.435253   1  1  2    2   20.0485  4.434029    0.0056  0.001224
   22.1333 4.020099   0  0  4    2   22.1319  4.020345   -0.0014 -0.000245
   25.1360 3.545487   1  0  4    2   25.1385  3.545142    0.0025  0.000346
   26.1868 3.405334   2  0  2    2   26.1906  3.404849    0.0038  0.000484
   27.8391 3.206569   1  1  4    2   27.8403  3.206431    0.0012  0.000137
   28.8065 3.100895   2  1  2    2   28.8007  3.101511   -0.0058 -0.000616
   32.6263 2.745598   2  0  4    2   32.6269  2.745546    0.0006  0.000052
   33.4510 2.679688   0  0  6    2   33.4440  2.680230   -0.0070 -0.000542
   33.7353 2.657725   2  2  0    2   33.7366  2.657626    0.0013  0.000100
   37.5947 2.392989   1  1  6    2   37.5915  2.393186   -0.0032 -0.000197
   45.0966 2.010448   0  0  8    2   45.1031  2.010172    0.0065  0.000275
   46.7813 1.941834   1  0  8    2   46.7788  1.941934   -0.0025 -0.000100

 rmse = 0.00003482360
 
     A =7.5169(7)              B =7.5169(7)               C =16.0814(7)          
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 908.7(2)