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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050261
 
 Symmetry constraint is: TRICLINIC   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.047
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   11.8322 7.502785   1  0  0    2   11.8357  7.500538    0.0035  0.002247
   13.1733 6.739106   0  0  1    2   13.1828  6.734236    0.0095  0.004870
   17.0578 5.207960  -1  0  1    2   17.0579  5.207938    0.0001  0.000022
   23.7467 3.751072   2  0  0    2   23.7519  3.750269    0.0052  0.000803
   27.1958 3.281845  -2  1  1    2   27.1935  3.282115   -0.0023 -0.000270
   28.2457 3.161996  -1  0  2    2   28.2526  3.161243    0.0069  0.000753
   29.3925 3.040986   0 -1  2    2   29.3851  3.041737   -0.0074 -0.000751
   29.9164 2.988830   1  0  2    2   29.9093  2.989527   -0.0071 -0.000697
   30.4124 2.941130  -1  1  2    2   30.4114  2.941227   -0.0010 -0.000097
   34.4515 2.604523  -2  0  2    2   34.4591  2.603969    0.0076  0.000554
   35.9374 2.500027   3  0  0    2   35.9351  2.500179   -0.0023 -0.000152
   38.0002 2.368756   1 -2  2    2   38.0023  2.368629    0.0021  0.000127
   41.1209 2.195701  -1  0  3    2   41.1148  2.196011   -0.0061 -0.000310
   54.4983 1.683682   0  0  4    2   54.5026  1.683559    0.0043  0.000123
   58.3789 1.580574  -2  0  4    2   58.3770  1.580621   -0.0019 -0.000047

 rmse = 0.00004893443
 
     A =7.713(2)               B =6.897(6)                C =6.7534(4)           
 Alpha =90.51(3)            Beta =94.06(1)            Gamma =102.78(6)           
 
 Volume = 349.4(0)