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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060041
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.036
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    9.7752 9.074222   0  2  0    2    9.7843  9.065767    0.0091  0.008455
   10.4944 8.451757   1  1  0    2   10.4958  8.450600    0.0014  0.001158
   18.1433 4.895096  -1  1  1    2   18.1452  4.894581    0.0019  0.000515
   19.6088 4.531756   0  4  0    2   19.6039  4.532884   -0.0049 -0.001128
   26.2854 3.392268   1  3  1    2   26.2850  3.392324   -0.0004 -0.000057
   27.1376 3.287502   2  4  0    2   27.1357  3.287729   -0.0019 -0.000227
   28.4743 3.135942   3  1  0    2   28.4753  3.135833    0.0010  0.000108
   31.7771 2.816761   3  3  0    2   31.7759  2.816867   -0.0012 -0.000105
   32.6578 2.742699  -3  3  1    2   32.6590  2.742605    0.0012  0.000094
   32.9869 2.716054   1  5  1    2   32.9880  2.715968    0.0011  0.000085
   34.4686 2.602491   0  6  1    2   34.4696  2.602421    0.0010  0.000070
   35.3205 2.541584  -2  0  2    2   35.3196  2.541650   -0.0009 -0.000066
   38.3631 2.346527  -3  5  1    2   38.3631  2.346524    0.0000  0.000003

 rmse = 0.00001408672
 
     A =9.8768(4)              B =18.1315(9)              C =5.2943(3)           
 Alpha =90                  Beta =104.747(5)          Gamma =90                  
 
 Volume = 916.87(6)