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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R070713
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:    0.015
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   23.4368 3.790186   3  1  0    2   23.4271  3.791725   -0.0097 -0.001539
   22.4959 3.946433   0  2  1    2   22.4926  3.946999   -0.0033 -0.000566
   21.0729 4.209411   0  0  3    2   21.0707  4.209849   -0.0022 -0.000438
   25.4871 3.489922  -2  2  1    2   25.4852  3.490175   -0.0019 -0.000253
   29.2795 3.046181  -1  1  4    2   29.2785  3.046283   -0.0010 -0.000102
   30.5815 2.919455   4  0  1    2   30.5818  2.919428    0.0003  0.000027
   12.6792 6.967598   1  1  0    2   12.6795  6.967414    0.0003  0.000184
   13.7401 6.432498  -2  0  1    2   13.7414  6.431906    0.0013  0.000592
   31.0166 2.879506   2  2  2    2   31.0192  2.879268    0.0026  0.000237
   21.3483 4.155765   0  2  0    2   21.3516  4.155125    0.0033  0.000639
   24.3205 3.654516  -3  1  2    2   24.3260  3.653710    0.0055  0.000806
   17.0931 5.178609   2  0  1    2   17.1007  5.176313    0.0076  0.002296

 rmse = 0.00002913366
 
     A =13.259(2)              B =8.310(1)                C =13.099(2)           
 Alpha =90                  Beta =105.39(2)           Gamma =90                  
 
 Volume = 1391.6(2)