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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050427
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.083
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    8.582310.395204   0  0  2    2    8.5909 10.384661    0.0086  0.010544
   16.5416 5.381600   4  0  2    2   16.5395  5.382287   -0.0021 -0.000687
   17.1421 5.193486   0  0  4    2   17.1459  5.192330    0.0038  0.001156
   18.4228 4.833595  -4  0  4    2   18.4170  4.835102   -0.0058 -0.001507
   23.4095 3.810321   4  0  4    2   23.4064  3.810817   -0.0031 -0.000496
   24.4267 3.653359   8  0  0    2   24.4233  3.653862   -0.0034 -0.000503
   27.2520 3.279515   2  1  3    2   27.2520  3.279515    0.0000  0.000000
   27.8738 3.207534   8  0  2    2   27.8766  3.207211    0.0028  0.000322
   31.2611 2.866342   4  0  6    2   31.2651  2.865987    0.0040  0.000355
   42.2318 2.142184  -4  0 10    2   42.2346  2.142049    0.0028  0.000136
   43.6259 2.076774   0  0 10    2   43.6224  2.076932   -0.0035 -0.000158

 rmse = 0.00002792552
 
     A =    30.169(5)          B =     3.9986(9)          C =    21.435(1)       
 Alpha =    90.             Beta =   104.32(1)        Gamma =    90.             
 
 Volume =   2505.5(7)