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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R040124
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.051
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    8.8969 9.987943   0  0  2    2    8.9041  9.979810    0.0072  0.008133
   17.8136 4.989170   0  0  4    2   17.8110  4.989905   -0.0026 -0.000734
   22.9266 3.884292  -1  1  3    2   22.9387  3.882259    0.0121  0.002033
   23.8472 3.736066   0  2  3    2   23.8469  3.736112   -0.0003 -0.000047
   25.5489 3.490454  -1  1  4    2   25.5326  3.492644   -0.0163 -0.002190
   26.8265 3.326736   0  0  6    2   26.8276  3.326603    0.0011  0.000133
   27.8888 3.202154   1  1  4    2   27.8876  3.202292   -0.0012 -0.000137
   29.9009 2.990730   0  2  5    2   29.9011  2.990706    0.0002  0.000024
   31.2715 2.862490   1  1  5    2   31.2725  2.862404    0.0010  0.000086
   32.0777 2.792250  -1  1  6    2   32.0821  2.791875    0.0044  0.000375
   45.4528 1.995945   0  0 10    2   45.4524  1.995962   -0.0004 -0.000017

 rmse = 0.00004957157
 
     A =     5.202(2)          B =     9.030(3)           C =    20.060(2)       
 Alpha =    90.             Beta =    95.75(1)        Gamma =    90.             
 
 Volume =    937.7(4)