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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050486
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.043
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    8.837510.046955   0  0  1    2    8.8510 10.031590    0.0135  0.015365
   17.7150 5.014730   0  0  2    2   17.7112  5.015795   -0.0038 -0.001065
   20.4959 4.338730  -1  1  1    2   20.4998  4.337919    0.0039  0.000811
   21.7302 4.094501   0  2  1    2   21.7280  4.094917   -0.0022 -0.000415
   24.4149 3.649201  -1  1  2    2   24.4124  3.649563   -0.0025 -0.000362
   29.1726 3.063091   1  1  2    2   29.1719  3.063162   -0.0007 -0.000071
   33.4369 2.681042   0  2  3    2   33.4384  2.680925    0.0015  0.000117

 rmse = 0.00002672151
 
     A =     5.192(1)          B =     8.971(2)           C =    10.240(2)       
 Alpha =    90.             Beta =   101.58(1)        Gamma =    90.             
 
 Volume =    467.2(1)