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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050396
 
 Symmetry constraint is: TRICLINIC   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.037
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   11.4212 7.765964   1  0  0    2   11.4215  7.765778    0.0003  0.000186
   12.6895 6.990232   0  0  1    2   12.6852  6.992579   -0.0043 -0.002347
   16.2591 5.459254  -1  0  1    2   16.2600  5.458943    0.0009  0.000311
   22.0981 4.025791  -1 -1  1    2   22.0984  4.025745    0.0003  0.000047
   22.9229 3.882537   2  0  0    2   22.9208  3.882889   -0.0021 -0.000352
   25.4893 3.496580   0  0  2    2   25.4914  3.496289    0.0021  0.000290
   26.1240 3.412931  -2  1  1    2   26.1238  3.412959   -0.0002 -0.000028
   26.9749 3.307027  -1  0  2    2   26.9746  3.307069   -0.0003 -0.000042
   27.3173 3.266293   2  0  1    2   27.3171  3.266318   -0.0002 -0.000025
   28.3187 3.152876   0 -1  2    2   28.3185  3.152899   -0.0002 -0.000022
   34.2586 2.618004  -3  1  0    2   34.2588  2.617991    0.0002  0.000013
   34.6581 2.588704   3  0  0    2   34.6596  2.588593    0.0015  0.000111
   41.3969 2.181163  -3  0  2    2   41.3957  2.181223   -0.0012 -0.000060
   43.3483 2.087305  -2  0  3    2   43.3492  2.087265    0.0009  0.000040
   54.9010 1.671982   1  0  4    2   54.9007  1.671991   -0.0003 -0.000009

 rmse = 0.00001020416
 
     A =     7.9897(2)         B =     7.042(1)           C =     7.02417(10)    
 Alpha =    90.472(9)       Beta =    95.184(2)       Gamma =   102.492(6)       
 
 Volume =    384.15(8)