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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050139
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.012
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   15.4053 5.751305   0  1  0    2   15.4111  5.749157    0.0058  0.002148
   18.4303 4.812990   1  0  0    2   18.4369  4.811270    0.0066  0.001720
   23.5970 3.769030   0  1  1    2   23.6025  3.768168    0.0055  0.000862
   24.1135 3.689417   1  1  0    2   24.1116  3.689703   -0.0019 -0.000286
   29.9298 2.984090   1  1  1    2   29.9287  2.984200   -0.0011 -0.000110
   30.2904 2.949368  -1  1  1    2   30.2909  2.949318    0.0005  0.000050
   31.0980 2.874562   0  2  0    2   31.0978  2.874579   -0.0002 -0.000017
   37.3595 2.405759   2  0  0    2   37.3615  2.405635    0.0020  0.000124
   40.9139 2.204529  -1  2  1    2   40.9100  2.204727   -0.0039 -0.000199
   44.0400 2.054980  -1  1  2    2   44.0414  2.054919    0.0014  0.000062
   44.9230 2.016607  -2  1  1    2   44.9228  2.016614   -0.0002 -0.000007
   47.4099 1.916436   0  3  0    2   47.4112  1.916386    0.0013  0.000051
   48.2769 1.884017   0  2  2    2   48.2751  1.884084   -0.0018 -0.000067
   51.2890 1.780195   1  3  0    2   51.2841  1.780354   -0.0049 -0.000159
   67.8057 1.381169   0  4  1    2   67.8083  1.381123    0.0026  0.000046

 rmse = 0.00002955357
 
     A =     4.8118(3)         B =     5.7491(1)          C =     4.9899(4)      
 Alpha =    90.             Beta =    89.081(8)       Gamma =    90.             
 
 Volume =    138.02(1)