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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050380
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.321
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   11.4335 7.955713   2  0  0    2   11.4790  7.923376    0.0455  0.032337
   13.6863 6.619345   0  0  1    2   13.6877  6.618659    0.0014  0.000686
   18.7345 4.814386   0  1  1    2   18.7286  4.815922   -0.0059 -0.001535
   21.0161 4.288467  -2  1  1    2   21.0010  4.291562   -0.0151 -0.003095
   22.7566 3.959554   4  0  0    2   22.7444  3.961688   -0.0122 -0.002134
   25.0013 3.604274  -4  0  1    2   25.0122  3.602704    0.0109  0.001571
   25.6825 3.508987   0  2  0    2   25.6729  3.510291   -0.0096 -0.001304
   28.0882 3.210194   2  2  0    2   28.0950  3.209427    0.0068  0.000767
   30.1512 2.992711   0  1  2    2   30.1438  2.993435   -0.0074 -0.000724
   33.4586 2.701179   2  1  2    2   33.4550  2.701468   -0.0036 -0.000288
   40.0116 2.269003   4  1  2    2   40.0193  2.268579    0.0077  0.000424
   47.8662 1.910865   0  3  2    2   47.8700  1.910721    0.0038  0.000144
   71.2088 1.328290   8  3  2    2   71.2072  1.328316   -0.0016 -0.000026

 rmse = 0.00007443660
 
     A =    15.971(5)          B =     7.020(1)           C =     6.670(2)       
 Alpha =    90.             Beta =    97.15(2)        Gamma =    90.             
 
 Volume =    742.1(3)