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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060365
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.034
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   12.6309 7.020968   0  0  1    2   12.6340  7.019221    0.0031  0.001747
   19.1334 4.642844   1  1  0    2   19.1379  4.641769    0.0045  0.001076
   21.1088 4.211917  -1  1  1    2   21.1143  4.210822    0.0055  0.001095
   25.3880 3.509915   0  0  2    2   25.3902  3.509611    0.0022  0.000304
   28.8239 3.098370  -3  1  1    2   28.8240  3.098356    0.0001  0.000014
   29.2181 3.057410  -1  1  2    2   29.2181  3.057411    0.0000 -0.000001
   30.2911 2.951387   3  1  0    2   30.2914  2.951359    0.0003  0.000028
   34.5391 2.597141   1  1  2    2   34.5349  2.597451   -0.0042 -0.000309
   34.9198 2.569667   0  2  0    2   34.9212  2.569570    0.0014  0.000097
   35.5355 2.526500   2  0  2    2   35.5311  2.526800   -0.0044 -0.000300
   44.0026 2.057614   4  1  1    2   44.0015  2.057662   -0.0011 -0.000047
   46.9717 1.934144  -4  2  1    2   46.9695  1.934229   -0.0022 -0.000085
   52.9371 1.729241  -4  1  4    2   52.9376  1.729227    0.0005  0.000014
   53.2657 1.719338   4  1  2    2   53.2687  1.719248    0.0030  0.000091

 rmse = 0.00002525081
 
     A =11.753(1)              B =5.1391(3)               C =7.6276(3)           
 Alpha =90                  Beta =113.040(4)          Gamma =90                  
 
 Volume = 423.96(3)