******************************************************************************
       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
 ******************************************************************************
 
 Kaolinite__R140004-1__Powder__Xray_Data_XY_RAW__12614[1]
 
 Symmetry constraint is: TRICLINIC   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.038
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   12.3992 7.154805   0  0  1    2   12.4053  7.151307    0.0061  0.003498
   20.4050 4.356846  -1  1  0    2   20.4033  4.357214   -0.0017 -0.000369
   21.2936 4.176667  -1 -1  1    2   21.3019  4.175057    0.0083  0.001610
   23.1727 3.841489   0 -2  1    2   23.1804  3.840236    0.0077  0.001253
   23.8131 3.739444   0  2  1    2   23.8086  3.740134   -0.0045 -0.000690
   24.9261 3.574676   0  0  2    2   24.9192  3.575654   -0.0069 -0.000977
   26.4279 3.374553   1  1  1    2   26.4239  3.375060   -0.0040 -0.000507
   35.4701 2.531349  -1 -3  1    2   35.4711  2.531280    0.0010  0.000069
   37.7498 2.383400   0  0  3    2   37.7437  2.383769   -0.0061 -0.000369
   39.2940 2.293127   1  3  1    2   39.2937  2.293144   -0.0003 -0.000017
   51.0754 1.788014   0  0  4    2   51.0811  1.787827    0.0057  0.000187
   58.2053 1.584670  -1 -3  4    2   58.2060  1.584651    0.0007  0.000019
   70.2343 1.339675  -1 -3  5    2   70.2326  1.339704   -0.0017 -0.000029

 rmse = 0.00004720039
 
     A =5.149(2)               B =8.940(2)                C =7.398(1)            
 Alpha =91.68(2)            Beta =104.74(4)           Gamma =89.79(3)            
 
 Volume = 329.2(1)