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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060211
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.066
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
     8.802 10.11357   0  0  1    2     8.803  10.11184     0.001   0.00172
     8.824 10.11328   0  0  1    3     8.825  10.11184     0.001   0.00144
    26.497  3.36933   0  0  3    2    26.487   3.37061    -0.010  -0.00128
    26.564  3.36932   0  0  3    3    26.554   3.37061    -0.010  -0.00130
    30.409  2.94326  -1  1  3    2    30.413   2.94285     0.004   0.00041
    30.487  2.94319  -1  1  3    3    30.491   2.94285     0.004   0.00034
    33.877  2.64888  -1  3  1    2    33.878   2.64882     0.001   0.00006
    33.964  2.64885  -1  3  1    3    33.964   2.64882     0.000   0.00003
    35.542  2.52828   0  0  4    2    35.547   2.52796     0.005   0.00032
    35.633  2.52829   0  0  4    3    35.638   2.52796     0.005   0.00033
    44.859  2.02166  -2  0  4    2    44.858   2.02169    -0.001  -0.00003
    44.976  2.02167  -2  0  4    3    44.976   2.02169     0.000  -0.00002
    54.489  1.68449  -1  3  5    2    54.489   1.68451     0.000  -0.00001
    54.636  1.68448  -1  3  5    3    54.635   1.68451    -0.001  -0.00003

 rmse = 0.00003787555
 
     A =     5.4654(15)        B =     9.28064(99)        C =    10.25954(55)    
 Alpha =    90.             Beta =    99.733(16)      Gamma =    90.             
 
 Volume =    512.90(17)