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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050484
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.033
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   15.1526 5.854895   0  2  1    2   15.1566  5.853343    0.0040  0.001552
   16.8271 5.274703   3  0  0    2   16.8279  5.274454    0.0008  0.000248
   18.0030 4.932107   2  1  1    2   18.0163  4.928500    0.0133  0.003607
   19.4362 4.570916   2  2  0    2   19.4495  4.567811    0.0133  0.003104
   21.2053 4.192811   0  1  2    2   21.1969  4.194450   -0.0084 -0.001639
   22.7025 3.919171  -1  4  1    2   22.7075  3.918325    0.0050  0.000846
   24.7374 3.600766   4  0  1    2   24.7353  3.601072   -0.0021 -0.000306
   25.8064 3.453791   4  1  0    2   25.8129  3.452941    0.0065  0.000850
   26.6246 3.349348   3  2  1    2   26.6178  3.350194   -0.0068 -0.000845
   28.9112 3.089134   3  1  2    2   28.9077  3.089499   -0.0035 -0.000365
   31.6488 2.827613  -2  6  1    2   31.6449  2.827953   -0.0039 -0.000340
   36.7047 2.448544   4 -2  3    2   36.7086  2.448292    0.0039  0.000252
   41.2689 2.187454   3  5  1    2   41.2613  2.187839   -0.0076 -0.000385
   42.4842 2.127601   6  2  1    2   42.4826  2.127676   -0.0016 -0.000074
   48.2141 1.887107  -2  9  1    2   48.2141  1.887109    0.0000 -0.000001
   56.4544 1.629479  11 -5  1    2   56.4578  1.629389    0.0034  0.000089

 rmse = 0.00004210212
 
     A =    18.2712(7)         B =    18.2712(7)          C =     8.700(1)       
 Alpha =    90.             Beta =    90.             Gamma =   120.             
 
 Volume =   2515.3(4)