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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060744
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.060
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   26.9391 3.314154   1  2  1    2   26.9469  3.313210    0.0078  0.000944
   30.3521 2.948075   3  2  1    2   30.3542  2.947878    0.0021  0.000197
   31.0989 2.878826   6  1  0    2   31.0999  2.878738    0.0010  0.000088
   31.6264 2.831912   5  1  1    2   31.6316  2.831455    0.0052  0.000457
   33.0690 2.711370   4  2  1    2   33.0727  2.711072    0.0037  0.000298
   35.3675 2.539950   1  3  1    2   35.3583  2.540591   -0.0092 -0.000641
   35.9690 2.498772   2  0  2    2   35.9653  2.499022   -0.0037 -0.000250
   36.3050 2.476374   5  2  1    2   36.3009  2.476646   -0.0041 -0.000272
   42.7234 2.117501   5  0  2    2   42.7278  2.117292    0.0044  0.000209
   43.1077 2.099484   5  3  1    2   43.1071  2.099510   -0.0006 -0.000026
   46.3045 1.961518   6  3  1    2   46.2977  1.961789   -0.0068 -0.000272
   52.6804 1.737870   2  5  0    2   52.6840  1.737759    0.0036  0.000111
   62.4118 1.487979  10  3  1    2   62.4123  1.487969    0.0005  0.000010

 rmse = 0.00004784614
 
     A =18.266(1)              B =8.8505(6)               C =5.1964(6)           
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 840.04(9)