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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050251
 
 Symmetry constraint is: TRICLINIC   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.028
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    9.9994 8.863459   0  0  1    2   10.0016  8.861475    0.0022  0.001984
   19.5828 4.535895  -1  1  1    2   19.5870  4.534929    0.0042  0.000966
   24.3093 3.662591   1  2  1    2   24.3095  3.662557    0.0002  0.000034
   25.7862 3.455838   2  0  0    2   25.7992  3.454118    0.0130  0.001719
   27.2805 3.269644  -1  2  1    2   27.2839  3.269243    0.0034  0.000401
   28.4143 3.141572   0  2  2    2   28.4067  3.142394   -0.0076 -0.000822
   29.0880 3.070254   2  0  1    2   29.0975  3.069274    0.0095  0.000980
   29.7392 3.004427  -2  1  0    2   29.7312  3.005222   -0.0080 -0.000796
   30.1539 2.964006  -2  1  1    2   30.1558  2.963821    0.0019  0.000186
   31.1048 2.875445  -1 -3  1    2   31.0967  2.876181   -0.0081 -0.000736
   31.8451 2.810209  -1 -1  3    2   31.8499  2.809794    0.0048  0.000416
   32.3272 2.769356   1  3  1    2   32.3257  2.769479   -0.0015 -0.000123
   33.6403 2.664108  -1  1  3    2   33.6366  2.664396   -0.0037 -0.000287
   38.9434 2.312399  -3  0  1    2   38.9329  2.312997   -0.0105 -0.000598
   43.9727 2.058709  -3 -3  1    2   43.9768  2.058526    0.0041  0.000183
   47.3758 1.918370  -2  3  2    2   47.3802  1.918203    0.0044  0.000167
   50.1540 1.818361   3 -1  2    2   50.1530  1.818395   -0.0010 -0.000034

 rmse = 0.00005935167
 
     A =7.1636(8)              B =9.137(2)                C =8.964(2)            
 Alpha =91.88(2)            Beta =98.65(1)            Gamma =77.15(1)            
 
 Volume = 565.5(1)