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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060901
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.011
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    9.2334 9.581093   1  1  0    2    9.2356  9.578848    0.0022  0.002245
   11.4435 7.733424  -1  1  1    2   11.4431  7.733700   -0.0004 -0.000275
   15.2127 5.823407   1  1  1    2   15.2115  5.823850   -0.0012 -0.000443
   19.2136 4.618178  -1  1  2    2   19.2257  4.615294    0.0121  0.002884
   19.6082 4.526071   0  0  2    2   19.6074  4.526251   -0.0008 -0.000180
   23.1344 3.843234  -1  3  1    2   23.1393  3.842427    0.0049  0.000807
   25.2576 3.524632   1  3  1    2   25.2575  3.524643   -0.0001 -0.000011
   26.9056 3.312281  -3  3  1    2   26.9052  3.312330   -0.0004 -0.000049
   28.8336 3.094952  -5  1  2    2   28.8372  3.094571    0.0036  0.000381
   29.4222 3.034339  -3  3  2    2   29.4218  3.034378   -0.0004 -0.000038
   30.3088 2.947536  -2  2  3    2   30.3125  2.947189    0.0037  0.000347
   30.6919 2.911598   2  2  2    2   30.6884  2.911925   -0.0035 -0.000327
   30.8898 2.893388   5  1  0    2   30.8874  2.893609   -0.0024 -0.000221
   31.4240 2.845392   1  3  2    2   31.4203  2.845716   -0.0037 -0.000324
   32.1880 2.779555   3  3  1    2   32.1883  2.779528    0.0003  0.000027
   32.7062 2.736674  -5  1  3    2   32.7069  2.736613    0.0007  0.000061
   35.0374 2.559689  -1  3  3    2   35.0333  2.559979   -0.0041 -0.000290
   35.9707 2.495366  -6  2  2    2   35.9636  2.495843   -0.0071 -0.000477
   36.1556 2.483024  -6  2  1    2   36.1581  2.482860    0.0025  0.000164
   37.2865 2.410248  -4  4  2    2   37.2861  2.410272   -0.0004 -0.000024
   40.7081 2.215155  -7  1  3    2   40.7055  2.215289   -0.0026 -0.000133
   41.5384 2.172764   0  4  3    2   41.5410  2.172634    0.0026  0.000130
   43.9695 2.058074  -8  0  2    2   43.9726  2.057936    0.0031  0.000137
   44.2346 2.046350   6  2  1    2   44.2343  2.046362   -0.0003 -0.000012
   62.5961 1.482993   8  4  1    2   62.5966  1.482981    0.0005  0.000011

 rmse = 0.00002699631
 
     A =16.4671(5)             B =12.523(1)               C =10.0245(8)          
 Alpha =90                  Beta =115.439(3)          Gamma =90                  
 
 Volume = 1866.8(1)