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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060111
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:    0.008
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   13.9828 6.324827   0  2  0    2   13.9745  6.328565   -0.0083 -0.003738
   41.8879 2.154529  -2  2  2    2   41.8803  2.154901   -0.0076 -0.000372
   21.3701 4.152994   1  2  0    2   21.3641  4.154150   -0.0060 -0.001156
   30.4746 2.930139   1  2  1    2   30.4695  2.930623   -0.0051 -0.000483
   26.5906 3.348536   1  3  0    2   26.5866  3.349035   -0.0040 -0.000499
   51.3280 1.778311   1  6  1    2   51.3249  1.778412   -0.0031 -0.000101
   27.1262 3.283643   0  3  1    2   27.1240  3.283898   -0.0022 -0.000256
   34.2530 2.615143   0  0  2    2   34.2511  2.615282   -0.0019 -0.000139
   23.9445 3.712135  -1  2  1    2   23.9436  3.712274   -0.0009 -0.000139
   28.1711 3.164211   0  4  0    2   28.1704  3.164282   -0.0007 -0.000072
   43.5280 2.077088   2  4  0    2   43.5283  2.077075    0.0003  0.000013
   33.6852 2.657904  -1  1  2    2   33.6855  2.657880    0.0003  0.000024
   34.6541 2.585794  -2  2  1    2   34.6550  2.585728    0.0009  0.000066
   27.8548 3.199409   1  1  1    2   27.8571  3.199155    0.0023  0.000254
   32.3462 2.764782  -2  1  1    2   32.3486  2.764581    0.0024  0.000201
   47.0396 1.929913   2  3  1    2   47.0424  1.929806    0.0028  0.000106
   28.7237 3.104597  -1  3  1    2   28.7271  3.104240    0.0034  0.000357
   20.5796 4.310639  -1  1  1    2   20.5836  4.309803    0.0040  0.000836
   40.6667 2.216353  -1  5  1    2   40.6744  2.215952    0.0077  0.000401
   32.9047 2.719130  -1  0  2    2   32.9126  2.718493    0.0079  0.000637

 rmse = 0.00003826254
 
     A =5.8037(5)              B =12.6571(9)              C =5.5128(4)           
 Alpha =90                  Beta =108.415(6)          Gamma =90                  
 
 Volume = 384.23(3)