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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050674
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.006
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   13.4816 6.565474   1  0  1    2   13.4745  6.568918   -0.0071 -0.003444
   21.2746 4.174132   1  0  2    2   21.2749  4.174070    0.0003  0.000061
   30.2097 2.956560   1  0  3    2   30.2139  2.956158    0.0042  0.000402
   43.3266 2.086916   2  0  4    2   43.3240  2.087035   -0.0026 -0.000119
   45.8857 1.976286   3  1  2    2   45.8850  1.976314   -0.0007 -0.000028
   51.0651 1.787303   3  1  3    2   51.0669  1.787243    0.0018  0.000060
   59.7409 1.546772   0  2  0    2   59.7407  1.546778   -0.0002 -0.000006
   61.7932 1.500227   5  1  2    2   61.7931  1.500229   -0.0001 -0.000002

 rmse = 0.00002347758
 
     A =     9.2184(4)         B =     3.09355(9)         C =     9.3629(5)      
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =    267.01(1)