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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050555
 
 Symmetry constraint is: TRICLINIC   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.054
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   10.5463 8.424687   0  2  0    2   10.5539  8.418635    0.0076  0.006052
   21.1454 4.208807   0  4  0    2   21.1428  4.209318   -0.0026 -0.000511
   21.6113 4.118885   0 -4  1    2   21.6118  4.118785    0.0005  0.000100
   23.1761 3.843551   1 -2  1    2   23.1748  3.843756   -0.0013 -0.000205
   28.0715 3.182100   1 -4  1    2   28.0722  3.182023    0.0007  0.000078
   28.7215 3.111410   2  0  0    2   28.7218  3.111383    0.0003  0.000027
   34.3422 2.613135  -2  2  1    2   34.3421  2.613146   -0.0001 -0.000011
   40.4752 2.229669   0 -8  1    2   40.4751  2.229674   -0.0001 -0.000004
   50.8119 1.797202   0  8  1    2   50.8120  1.797197    0.0001  0.000004

 rmse = 0.00001516144
 
     A =     6.3644(6)         B =    17.9888(9)          C =     6.287(2)       
 Alpha =   110.332(8)       Beta =   101.61(1)        Gamma =    82.79(2)        
 
 Volume =    659.9(2)