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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060353
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.061
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   14.7400 6.029802   1  1  0    2   14.7321  6.033033   -0.0079 -0.003231
   18.6021 4.781567   0  0  1    2   18.6120  4.779038    0.0099  0.002529
   21.9582 4.055699   0  1  1    2   21.9532  4.056610   -0.0050 -0.000912
   23.2168 3.838022   0  2  0    2   23.2249  3.836696    0.0081  0.001326
   29.6513 3.016437   2  2  0    2   29.6505  3.016516   -0.0008 -0.000080
   29.9004 2.991820   0  2  1    2   29.9002  2.991840   -0.0002 -0.000020
   36.8528 2.440854   4  0  0    2   36.8537  2.440796    0.0009  0.000058
   38.7408 2.325946   4  1  0    2   38.7405  2.325962   -0.0003 -0.000016
   40.5954 2.223700  -1  1  2    2   40.5945  2.223746   -0.0009 -0.000046
   42.0475 2.150089  -2  0  2    2   42.0483  2.150051    0.0008  0.000038
   43.2057 2.095015  -4  1  1    2   43.2064  2.094981    0.0007  0.000034
   44.2294 2.048804  -2  3  1    2   44.2273  2.048897   -0.0021 -0.000093
   45.1135 2.010631   3  3  0    2   45.1045  2.011011   -0.0090 -0.000380
   47.4047 1.918530   0  4  0    2   47.4095  1.918348    0.0048  0.000182
   52.6026 1.740308   5  2  0    2   52.6053  1.740226    0.0027  0.000082
   76.8016 1.240909   6  4  0    2   76.8015  1.240910   -0.0001 -0.000001

 rmse = 0.00003989670
 
     A =     9.7632(4)         B =     7.6733(4)          C =     4.7790(5)      
 Alpha =    90.             Beta =    90.26(1)        Gamma =    90.             
 
 Volume =    358.03(4)