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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050191
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.026
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   17.6758 5.020846  -1  0  2    2   17.6767  5.020606    0.0009  0.000240
   22.1129 4.021208   2  0  0    2   22.1186  4.020192    0.0057  0.001016
   22.2920 3.989266  -2  0  2    2   22.2909  3.989452   -0.0011 -0.000186
   25.5009 3.493575  -2  1  1    2   25.5043  3.493112    0.0034  0.000462
   26.1596 3.406994   1  0  2    2   26.1620  3.406690    0.0024  0.000304
   30.8200 2.901171  -1  1  3    2   30.8223  2.900959    0.0023  0.000212
   31.7466 2.818507   0  2  0    2   31.7439  2.818738   -0.0027 -0.000231
   34.4657 2.601947  -3  1  1    2   34.4616  2.602246   -0.0041 -0.000299
   35.4248 2.533616   2  0  2    2   35.4290  2.533328    0.0042  0.000288
   36.5585 2.457551  -1  2  2    2   36.5537  2.457862   -0.0048 -0.000311
   42.8611 2.109416  -2  2  3    2   42.8632  2.109318    0.0021  0.000098
   43.6455 2.073284   0  2  3    2   43.6441  2.073347   -0.0014 -0.000064
   44.2107 2.048065   2  0  3    2   44.2082  2.048175   -0.0025 -0.000110
   66.2852 1.409388   0  4  0    2   66.2862  1.409369    0.0010  0.000019

 rmse = 0.00002846391
 
     A =     8.9012(8)         B =     5.6374(1)          C =    10.1643(9)      
 Alpha =    90.             Beta =   115.406(6)       Gamma =    90.             
 
 Volume =    460.72(4)