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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050133
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.067
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   17.9193 4.964402   0  4  0    2   17.9307  4.961260    0.0114  0.003143
   24.4834 3.642606   2  0  1    2   24.4787  3.643293   -0.0047 -0.000687
   25.4697 3.503367   2  4  0    2   25.4647  3.504052   -0.0050 -0.000685
   26.9978 3.307947   0  6  0    2   27.0015  3.307506    0.0037  0.000441
   30.4933 2.935407   2  4  1    2   30.4812  2.936548   -0.0121 -0.001140
   32.1665 2.786113   3  1  1    2   32.1757  2.785333    0.0092  0.000780
   38.0732 2.365590   0  4  2    2   38.0745  2.365514    0.0013  0.000077
   56.5612 1.627556   6  2  0    2   56.5611  1.627559   -0.0001 -0.000003

 rmse = 0.00006087242
 
     A =     9.8994(8)         B =    19.845(5)           C =     5.382(1)       
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =   1057.3(3)