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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050099
 
 Symmetry constraint is: CUBIC       
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.032
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   24.3421 3.658241   2  0  0    2   24.3460  3.657662    0.0039  0.000579
   27.2721 3.271044   2  1  0    2   27.2681  3.271512   -0.0040 -0.000468
   29.9331 2.985726   2  1  1    2   29.9255  2.986469   -0.0076 -0.000742
   36.8619 2.438377   2  2  1    2   36.8609  2.438441   -0.0010 -0.000065
   38.9293 2.313404   3  1  0    2   38.9310  2.313309    0.0017  0.000095
   40.9165 2.205431   3  1  1    2   40.9122  2.205653   -0.0043 -0.000222
   42.8108 2.112055   2  2  2    2   42.8172  2.111752    0.0064  0.000302
   44.6538 2.029006   3  2  0    2   44.6561  2.028906    0.0023  0.000101
   46.4355 1.955165   3  2  1    2   46.4371  1.955103    0.0016  0.000062
   49.8479 1.828934   4  0  0    2   49.8509  1.828831    0.0030  0.000102
   51.4978 1.774110   3  2  2    2   51.4942  1.774227   -0.0036 -0.000116
   53.1046 1.724122   3  3  0    2   53.1007  1.724238   -0.0039 -0.000116
   56.2265 1.635514   4  2  0    2   56.2174  1.635756   -0.0091 -0.000242
   57.7304 1.596410   4  2  1    2   57.7334  1.596335    0.0030  0.000075
   59.2201 1.559735   3  3  2    2   59.2244  1.559632    0.0043  0.000102
   62.1320 1.493406   4  2  2    2   62.1399  1.493234    0.0079  0.000172
   63.5636 1.463159   5  0  0    2   63.5682  1.463065    0.0046  0.000094
   64.9793 1.434645   4  3  1    2   64.9789  1.434653   -0.0004 -0.000008
   66.3820 1.407677   3  3  3    2   66.3736  1.407835   -0.0084 -0.000158
   69.1138 1.358529   5  2  0    2   69.1200  1.358422    0.0062  0.000107
   70.4762 1.335555   5  2  1    2   70.4741  1.335589   -0.0021 -0.000034
   73.1509 1.293158   4  4  0    2   73.1496  1.293179   -0.0013 -0.000020
   74.4773 1.273368   5  2  2    2   74.4728  1.273434   -0.0045 -0.000066
   75.7959 1.254450   5  3  0    2   75.7876  1.254568   -0.0083 -0.000117
   78.3872 1.219323   4  4  2    2   78.3951  1.219221    0.0079  0.000103
   80.9697 1.186807   5  3  2    2   80.9783  1.186702    0.0086  0.000105
   84.8204 1.142461   4  4  3    2   84.8203  1.142462   -0.0001 -0.000001
   86.0999 1.128727   5  4  1    2   86.0950  1.128779   -0.0049 -0.000052
   88.6404 1.102812   6  2  2    2   88.6390  1.102827   -0.0014 -0.000014
   89.9093 1.090507   5  4  2    2   89.9096  1.090504    0.0003  0.000003

 rmse = 0.00006455815
 
     A =     7.31532(9)        B =     7.31532(9)         C =     7.31532(9)     
 Alpha =    90.             Beta =    90.             Gamma =    90.             
 
 Volume =    391.47(1)