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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R061000
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.050
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    9.7219 9.136990   0  2  0    2    9.7141  9.144341   -0.0078 -0.007351
   10.5990 8.379183   1  1  0    2   10.5885  8.387517   -0.0105 -0.008334
   18.8345 4.720061   2  0  0    2   18.8374  4.719334    0.0029  0.000727
   24.0705 3.701723   1  3  1    2   24.0773  3.700686    0.0068  0.001037
   27.1744 3.284762   2  4  0    2   27.1824  3.283807    0.0080  0.000955
   28.8261 3.099867   3  1  0    2   28.8184  3.100675   -0.0077 -0.000808
   31.1244 2.875637   1  5  1    2   31.1146  2.876522   -0.0098 -0.000885
   32.0380 2.795561   3  3  0    2   32.0347  2.795839   -0.0033 -0.000278
   34.5065 2.600723   3  2  1    2   34.5091  2.600531    0.0026  0.000192
   35.2898 2.544689   2  5  1    2   35.3016  2.543867    0.0118  0.000822
   38.6877 2.328361   2  0  2    2   38.6862  2.328450   -0.0015 -0.000089
   39.5702 2.278378   1  7  1    2   39.5668  2.278566   -0.0034 -0.000189

 rmse = 0.00005447906
 
     A =9.439(1)               B =18.289(3)               C =5.354(1)            
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 924.2(2)