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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050082
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.089
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   10.4672 8.516840   1  1  0    2   10.4958  8.493536    0.0286  0.023304
   18.5075 4.813067   2  0  0    2   18.5234  4.808948    0.0159  0.004119
   26.0234 3.432744   1  3  1    2   26.0199  3.433201   -0.0035 -0.000458
   28.3606 3.154046   3  1  0    2   28.3350  3.156841   -0.0256 -0.002795
   31.6572 2.831788   3  3  0    2   31.6642  2.831179    0.0070  0.000609
   32.7957 2.735768  -3  3  1    2   32.8019  2.735267    0.0062  0.000501
   35.3011 2.546640  -2  0  2    2   35.2993  2.546763   -0.0018 -0.000124
   41.3332 2.187045   2  6  1    2   41.3345  2.186980    0.0013  0.000065
   50.4566 1.810200   0 10  0    2   50.4550  1.810254   -0.0016 -0.000054
   54.9452 1.672218   4  6  1    2   54.9470  1.672169    0.0018  0.000050

 rmse = 0.00009112284
 
     A =9.895(3)               B =18.103(3)               C =5.338(2)            
 Alpha =90                  Beta =103.59(2)           Gamma =90                  
 
 Volume = 929.3(0)