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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050221
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.153
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   11.9344 7.505437   1  1  0    2   11.9388  7.502644    0.0044  0.002794
   17.3353 5.156476   1  2  0    2   17.3330  5.157151   -0.0023 -0.000675
   18.8901 4.731948   2  0  0    2   18.8807  4.734313   -0.0094 -0.002364
   23.7789 3.762682   1  3  0    2   23.7829  3.762053    0.0040  0.000629
   38.1323 2.367211   4  0  0    2   38.1332  2.367156    0.0009  0.000054
   41.4825 2.182730   2  5  0    2   41.4831  2.182700    0.0006  0.000030
   43.7793 2.072990   3  2  1    2   43.7841  2.072772    0.0048  0.000218
   45.3782 2.003347   1  6  0    2   45.3780  2.003356   -0.0002 -0.000009
   46.9558 1.939428   3  3  1    2   46.9512  1.939607   -0.0046 -0.000179

 rmse = 0.00003587145
 
     A =9.4686(9)              B =12.2986(8)              C =3.0726(5)           
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 357.80(4)