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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R070266
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.013
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   15.9736 5.548228   0  2  0    2   15.9692  5.549753   -0.0044 -0.001525
   21.1874 4.192397   0  2  1    2   21.1864  4.192586   -0.0010 -0.000189
   30.3468 2.944131   1  3  0    2   30.3466  2.944146   -0.0002 -0.000015
   33.4860 2.674850   1  3  1    2   33.4889  2.674628    0.0029  0.000222
   34.4958 2.598795   1  1  2    2   34.5023  2.598321    0.0065  0.000474
   36.9664 2.430522   2  0  0    2   36.9641  2.430670   -0.0023 -0.000148
   37.8706 2.374523   2  1  0    2   37.8726  2.374403    0.0020  0.000120
   40.5019 2.226071   2  1  1    2   40.5015  2.226091   -0.0004 -0.000021
   41.6726 2.166180   1  3  2    2   41.6667  2.166473   -0.0059 -0.000293
   61.4696 1.507492   1  7  0    2   61.4701  1.507480    0.0005  0.000012

 rmse = 0.00003368248
 
     A =4.8613(3)              B =11.0995(5)              C =6.3989(8)           
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 345.28(4)