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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060117
 
 Symmetry constraint is: MONOCLINIC3 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.045
  
 Number of iterations =   2

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   18.0295 4.928309   0  2  0    2   18.0195  4.931027   -0.0100 -0.002718
   44.9693 2.016075   5  3  0    2   44.9642  2.016291   -0.0051 -0.000216
   34.4956 2.601191   3  3  0    2   34.4933  2.601362   -0.0023 -0.000171
   35.6264 2.521071   1  2  2    2   35.6250  2.521169   -0.0014 -0.000098
   53.5359 1.711643   6 -1  2    2   53.5348  1.711676   -0.0011 -0.000033
   43.5277 2.079515   6  1  0    2   43.5267  2.079560   -0.0010 -0.000045
   52.5584 1.741180   3 -4  2    2   52.5582  1.741187   -0.0002 -0.000007
   39.7707 2.267090   5  2  0    2   39.7711  2.267067    0.0004  0.000024
   61.5212 1.507071   0  0  4    2   61.5217  1.507059    0.0005  0.000012
   48.2968 1.884527   2  5  0    2   48.2984  1.884468    0.0016  0.000059
   61.0270 1.518095   8  2  0    2   61.0288  1.518054    0.0018  0.000041
   33.4625 2.679208   4  2  0    2   33.4647  2.679039    0.0022  0.000169
   30.6058 2.922829   2  3  0    2   30.6098  2.922454    0.0040  0.000376
   16.5694 5.360353   2  1  0    2   16.5765  5.358077    0.0071  0.002275
   13.9002 6.386471   2  0  0    2   13.9096  6.382181    0.0094  0.004290
   11.3646 7.810763   1  1  0    2   11.3743  7.804085    0.0097  0.006678

 rmse = 0.00002962405
 
     A =12.7644(4)             B =9.8621(5)               C =6.0282(2)           
 Alpha =89.995(6)           Beta =90                  Gamma =90                  
 
 Volume = 758.85(4)