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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R061070
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.018
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    8.8588 9.993993   0  0  1    2    8.8614  9.991011    0.0026  0.002982
   17.7622 4.994377   0  0  2    2   17.7582  4.995506   -0.0040 -0.001129
   19.6279 4.523216   0  2  0    2   19.6216  4.524650   -0.0063 -0.001434
   24.5901 3.619863  -1  1  2    2   24.5844  3.620691   -0.0057 -0.000828
   26.7648 3.330273   0  0  3    2   26.7643  3.330337   -0.0005 -0.000064
   28.7007 3.109751   1  1  2    2   28.6993  3.109900   -0.0014 -0.000150
   30.9096 2.892237  -1  1  3    2   30.9158  2.891669    0.0062  0.000568
   33.3932 2.682470   0  2  3    2   33.3976  2.682130    0.0044  0.000340
   34.4300 2.603986   1  3  0    2   34.4279  2.604139   -0.0021 -0.000153
   45.3633 1.998311   0  0  5    2   45.3659  1.998202    0.0026  0.000109
   65.3445 1.427237   0  0  7    2   65.3419  1.427287   -0.0026 -0.000050
   69.6041 1.349915   1  3  6    2   69.6052  1.349897    0.0011  0.000019

 rmse = 0.00003272956
 
     A =5.241(1)               B =9.049(1)                C =10.1471(4)          
 Alpha =90                  Beta =100.064(8)          Gamma =90                  
 
 Volume = 473.8(1)