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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050406
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:    0.010
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   19.8670 4.462986   0  2  0    2   19.8749  4.461229    0.0079  0.001757
   26.6113 3.345662   0  2  1    2   26.6126  3.345497    0.0013  0.000165
   27.5518 3.233596   2  2  0    2   27.5575  3.232939    0.0057  0.000657
   29.8458 2.990158  -2  2  1    2   29.8348  2.991238   -0.0110 -0.001080
   30.2538 2.950769   3  1  0    2   30.2447  2.951633   -0.0091 -0.000864
   30.8598 2.894211  -3  1  1    2   30.8570  2.894465   -0.0028 -0.000254
   34.9373 2.565301  -1  3  1    2   34.9426  2.564921    0.0053  0.000380
   39.0598 2.303589   3  1  1    2   39.0555  2.303832   -0.0043 -0.000244
   40.6371 2.217764   1  1  2    2   40.6400  2.217614    0.0029  0.000150
   41.8735 2.155110   3  3  0    2   41.8698  2.155293   -0.0037 -0.000182
   42.3305 2.132900  -3  3  1    2   42.3340  2.132730    0.0035  0.000170
   44.3301 2.041243   0  4  1    2   44.3380  2.040897    0.0079  0.000346
   46.0364 1.969495  -1  3  2    2   46.0361  1.969507   -0.0003 -0.000012
   52.1173 1.753143   1  5  0    2   52.1196  1.753071    0.0023  0.000073
   54.8326 1.672590   0  4  2    2   54.8270  1.672748   -0.0056 -0.000158
   55.3040 1.659447  -3  1  3    2   55.3033  1.659466   -0.0007 -0.000020
   56.9018 1.616593   4  4  0    2   56.9065  1.616469    0.0047  0.000124
   59.0035 1.563933   6  0  0    2   59.0063  1.563866    0.0028  0.000068
   59.5960 1.549795   3  5  0    2   59.5887  1.549966   -0.0073 -0.000172
   61.5811 1.504520  -1  3  3    2   61.5830  1.504477    0.0019  0.000043
   65.5201 1.423291   5  3  1    2   65.5198  1.423296   -0.0003 -0.000005

 rmse = 0.00005281076
 
     A =9.7538(6)              B =8.9225(4)               C =5.2568(3)           
 Alpha =90                  Beta =105.845(7)          Gamma =90                  
 
 Volume = 440.11(3)