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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050033
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.035
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   14.8603 5.970658   0  1  1    2   14.8606  5.970542    0.0003  0.000116
   18.3707 4.834689   1  0  0    2   18.3729  4.834104    0.0022  0.000585
   26.1607 3.408077   1  0  2    2   26.1633  3.407744    0.0026  0.000332
   37.3516 2.407728   0  0  4    2   37.3426  2.408290   -0.0090 -0.000562
   39.2410 2.295936   0  1  4    2   39.2398  2.296005   -0.0012 -0.000069
   47.8152 1.902020   0  4  0    2   47.8155  1.902010    0.0003  0.000010
   53.2844 1.718835   0  2  5    2   53.2869  1.718759    0.0025  0.000076
   53.6443 1.708141  -2  0  4    2   53.6440  1.708151   -0.0003 -0.000010
   55.2300 1.662761   2  1  4    2   55.2327  1.662685    0.0027  0.000076
   57.1480 1.611392   3  0  0    2   57.1489  1.611368    0.0009  0.000024
   59.2833 1.558310  -2  2  4    2   59.2854  1.558260    0.0021  0.000050
   69.0319 1.360005   3  3  0    2   69.0295  1.360046   -0.0024 -0.000041
   85.4289 1.135910   3  0  6    2   85.4285  1.135915   -0.0004 -0.000005

 rmse = 0.00003486954
 
     A =     4.8341(1)         B =     7.6080(4)          C =     9.6331(3)      
 Alpha =    90.             Beta =    90.143(2)       Gamma =    90.             
 
 Volume =    354.29(2)