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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050185
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.030
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   15.1070 5.871482  -1  1  1    2   15.1136  5.868946    0.0066  0.002536
   21.0224 4.228406  -2  0  1    2   21.0238  4.228133    0.0014  0.000273
   22.5303 3.948321   1  1  1    2   22.5419  3.946316    0.0116  0.002005
   23.5604 3.777751   1  3  0    2   23.5720  3.775920    0.0116  0.001831
   25.6896 3.468898  -1  1  2    2   25.6908  3.468739    0.0012  0.000158
   26.8899 3.316542   2  2  0    2   26.8925  3.316233    0.0026  0.000309
   32.3475 2.767832  -1  3  2    2   32.3454  2.768011   -0.0021 -0.000179
   34.4267 2.605130  -3  1  2    2   34.4098  2.606371   -0.0169 -0.001241
   35.1466 2.553355   1  1  2    2   35.1569  2.552630    0.0103  0.000726
   38.7245 2.325092  -1  1  3    2   38.7234  2.325154   -0.0011 -0.000062
   41.7184 2.164769   0  6  0    2   41.7116  2.165107   -0.0068 -0.000338
   45.0897 2.010324  -4  2  2    2   45.0910  2.010268    0.0013  0.000055
   45.9829 1.973305   2  2  2    2   45.9865  1.973158    0.0036  0.000147
   46.3986 1.956577  -3  3  3    2   46.4052  1.956315    0.0066  0.000262
   49.1035 1.854870   1  1  3    2   49.0905  1.855331   -0.0130 -0.000460
   71.8235 1.313745  -1  3  5    2   71.8253  1.313716    0.0018  0.000029
   74.1686 1.277883   2  8  2    2   74.1696  1.277868    0.0010  0.000015

 rmse = 0.00007348203
 
     A =8.585(1)               B =12.991(1)               C =7.2006(5)           
 Alpha =90                  Beta =116.035(8)          Gamma =90                  
 
 Volume = 721.5(1)