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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060114

 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.081
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    9.4300 9.451489   1  1  0    2    9.4352  9.446234    0.0052  0.005256
   13.0232 6.834460   2  0  0    2   13.0229  6.834612   -0.0003 -0.000152
   14.3809 6.188489  -2  0  1    2   14.3837  6.187284    0.0028  0.001205
   17.6834 5.034189   1  1  1    2   17.6797  5.035246   -0.0037 -0.001057
   18.8554 4.722494   2  2  0    2   18.8529  4.723117   -0.0025 -0.000623
   19.8273 4.492198  -2  2  1    2   19.8246  4.492801   -0.0027 -0.000603
   23.7088 3.762297  -1  3  1    2   23.7008  3.763548   -0.0080 -0.001251
   24.3840 3.659280  -4  0  1    2   24.3813  3.659687   -0.0027 -0.000408
   26.5838 3.360334  -3  1  2    2   26.5837  3.360352   -0.0001 -0.000018
   27.3526 3.267326   0  4  0    2   27.3533  3.267242    0.0007  0.000084
   28.4021 3.148590   3  3  0    2   28.4007  3.148745   -0.0014 -0.000155
   30.3678 2.948567   2  4  0    2   30.3765  2.947740    0.0087  0.000827
   31.1453 2.876519  -5  1  1    2   31.1441  2.876627   -0.0012 -0.000109
   32.0606 2.796247  -4  2  2    2   32.0622  2.796113    0.0016  0.000135
   34.9340 2.572015   2  4  1    2   34.9335  2.572051   -0.0005 -0.000036
   35.4287 2.537145   1  3  2    2   35.4235  2.537503   -0.0052 -0.000358
   40.7563 2.216284  -6  2  2    2   40.7560  2.216303   -0.0003 -0.000018
   41.5012 2.178132   0  6  0    2   41.5006  2.178161   -0.0006 -0.000029
   49.3015 1.849651   0  6  2    2   49.3069  1.849462    0.0054  0.000190
   59.0724 1.564463   7  5  0    2   59.0760  1.564377    0.0036  0.000086
   71.0151 1.327527   6  8  0    2   71.0116  1.327584   -0.0035 -0.000057

 rmse = 0.00003240799
 
     A =14.7467(8)             B =13.0690(6)              C =7.5543(8)           
 Alpha =90                  Beta =112.039(7)          Gamma =90                  
 
 Volume = 1349.5(2)