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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R070331
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.028
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   11.2148 7.902609   1  1  0    2   11.2219  7.897615    0.0071  0.004994
   13.1842 6.723768   0  2  0    2   13.1877  6.722010    0.0035  0.001758
   21.8321 4.072673   1  3  0    2   21.8331  4.072490    0.0010  0.000184
   23.1347 3.845949  -2  0  1    2   23.1374  3.845512    0.0027  0.000437
   27.8756 3.201040  -1  3  1    2   27.8754  3.201065   -0.0002 -0.000026
   34.0580 2.632311   3  3  0    2   34.0550  2.632538   -0.0030 -0.000227
   38.8471 2.317878  -1  5  1    2   38.8454  2.317976   -0.0017 -0.000098
   40.6219 2.220540   2  4  1    2   40.6256  2.220348    0.0037  0.000193
   41.3166 2.184769   1  5  1    2   41.3126  2.184974   -0.0040 -0.000204
   54.5895 1.680537   0  8  0    2   54.5907  1.680502    0.0012  0.000035
   60.9999 1.518303  -6  0  2    2   61.0000  1.518301    0.0001  0.000003

 rmse = 0.00002583205
 
     A =10.0993(8)             B =13.4440(5)              C =4.6765(7)           
 Alpha =90                  Beta =104.916(6)          Gamma =90                  
 
 Volume = 613.56(6)