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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 file_id=7062[1]
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.055
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   25.7330 3.466484   1  1  0    2   25.7345  3.466285    0.0015  0.000199
   26.9244 3.315419   0  2  0    2   26.9245  3.315402    0.0001  0.000017
   29.1977 3.061756   0  2  1    2   29.1989  3.061632    0.0012  0.000124
   34.2958 2.616651   1  1  2    2   34.2961  2.616632    0.0003  0.000019
   35.2207 2.549919   0  2  2    2   35.2213  2.549874    0.0006  0.000045
   43.6408 2.074837   0  2  3    2   43.6451  2.074641    0.0043  0.000196
   44.5852 2.033001   2  0  0    2   44.5840  2.033052   -0.0012 -0.000051
   45.4865 1.994742   0  0  4    2   45.4850  1.994803   -0.0015 -0.000062
   48.2473 1.886717   1  3  1    2   48.2441  1.886835   -0.0032 -0.000119
   52.4111 1.746042   1  3  2    2   52.4106  1.746058   -0.0005 -0.000016
   53.6275 1.709230   0  2  4    2   53.6264  1.709263   -0.0011 -0.000033
   58.0250 1.589595   2  2  2    2   58.0237  1.589627   -0.0013 -0.000032
   64.1257 1.452158   2  2  3    2   64.1303  1.452065    0.0046  0.000092
   65.5577 1.423834   2  0  4    2   65.5559  1.423869   -0.0018 -0.000036

 rmse = 0.00002780852
 
     A =4.0661(1)              B =6.6308(3)               C =7.9792(3)           
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 215.132(9)