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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050495
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:    0.007
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   13.9314 6.348304   1  0  1    2   13.9266  6.350477   -0.0048 -0.002173
   17.8272 4.969364   0  2  1    2   17.8308  4.968357    0.0036  0.001007
   19.2348 4.608898   3  0  0    2   19.2488  4.605585    0.0140  0.003313
   21.0375 4.217989   2  1  1    2   21.0411  4.217272    0.0036  0.000717
   22.2565 3.989720   2  2  0    2   22.2631  3.988553    0.0066  0.001167
   25.7097 3.461281   0  1  2    2   25.7099  3.461254    0.0002  0.000026
   29.5992 3.014813   4  1  0    2   29.5967  3.015063   -0.0025 -0.000250
   30.2651 2.949995   1  2  2    2   30.2638  2.950121   -0.0013 -0.000125
   34.7680 2.577628   0  5  1    2   34.7688  2.577569    0.0008  0.000058
   41.2640 2.185676   5  0  2    2   41.2496  2.186405   -0.0144 -0.000728
   41.6772 2.164961   4  3  1    2   41.6793  2.164857    0.0021  0.000104
   47.3680 1.917321   3  4  2    2   47.3700  1.917242    0.0020  0.000078
   49.1813 1.850798   6  2  1    2   49.1827  1.850747    0.0014  0.000051
   55.4300 1.656060   0  6  3    2   55.4279  1.656119   -0.0021 -0.000058
   61.7438 1.501015   0  5  4    2   61.7470  1.500944    0.0032  0.000071

 rmse = 0.00004834628
 
     A =    15.9542(9)         B =    15.9542(9)          C =     7.1505(5)      
 Alpha =    90.             Beta =    90.             Gamma =   120.             
 
 Volume =   1576.2(2)