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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R040060
 
 Symmetry constraint is: TRICLINIC   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.032
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   14.3394 6.185456   0  0  1    2   14.3329  6.188247   -0.0065 -0.002791
   19.2842 4.606464   1  1  0    2   19.2874  4.605710    0.0032  0.000755
   23.0913 3.853823   0  2  0    2   23.0860  3.854689   -0.0053 -0.000866
   26.7855 3.329467   0 -2  1    2   26.7853  3.329488   -0.0002 -0.000022
   27.2761 3.270614   1 -1  1    2   27.2743  3.270821   -0.0018 -0.000206
   30.1612 2.963674   2  0  0    2   30.1612  2.963678    0.0000 -0.000004
   34.9898 2.564576  -2  2  1    2   34.9846  2.564946   -0.0052 -0.000370
   35.9790 2.496239  -2 -2  1    2   35.9715  2.496745   -0.0075 -0.000506
   36.5335 2.459580   0 -2  2    2   36.5381  2.459283    0.0046  0.000298
   37.5502 2.395231  -1  3  0    2   37.5530  2.395056    0.0028  0.000175
   37.9793 2.369127   0  2  2    2   37.9796  2.369111    0.0003  0.000016
   38.4470 2.341352  -2  2  2    2   38.4549  2.340889    0.0079  0.000463
   38.7732 2.322385   1  3  0    2   38.7778  2.322121    0.0046  0.000264
   39.3785 2.288041   2  0  1    2   39.3790  2.288013    0.0005  0.000028
   41.0339 2.199405  -1  1  3    2   41.0294  2.199638   -0.0045 -0.000233
   42.5141 2.126133   1 -3  1    2   42.5084  2.126404   -0.0057 -0.000271
   46.3565 1.958329  -2 -2  3    2   46.3608  1.958158    0.0043  0.000171
   48.0020 1.894924   3  1  0    2   48.0073  1.894727    0.0053  0.000197
   50.9959 1.790409   0  2  3    2   50.9945  1.790455   -0.0014 -0.000046
   60.8168 1.522538  -4 -2  2    2   60.8141  1.522599   -0.0027 -0.000060

 rmse = 0.00004568437
 
     A =     6.7105(5)         B =     7.7179(6)          C =     7.0047(5)      
 Alpha =    91.195(6)       Beta =   117.861(6)       Gamma =    91.586(7)       
 
 Volume =    320.37(3)