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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060035
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.082
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    7.811411.428788   1  0  1    2    7.8223 11.412725    0.0109  0.016063
   12.5042 7.119728   1  1  0    2   12.5093  7.116826    0.0051  0.002902
   13.8140 6.443417   1  0  4    2   13.8243  6.438601    0.0103  0.004816
   14.7290 6.042882   0  2  1    2   14.7387  6.038888    0.0097  0.003993
   15.5957 5.707175   2  0  2    2   15.5979  5.706362    0.0022  0.000813
   16.4105 5.424168   0  1  5    2   16.4106  5.424138    0.0001  0.000030
   17.6819 5.035086   0  0  6    2   17.6870  5.033635    0.0051  0.001451
   20.6537 4.313923   2  0  5    2   20.6533  4.314007   -0.0004 -0.000084
   21.6849 4.110272   1  1  6    2   21.6885  4.109597    0.0036  0.000674
   23.4392 3.805373   3  0  3    2   23.4462  3.804242    0.0070  0.001132
   25.2566 3.534620   0  2  7    2   25.2570  3.534559    0.0004  0.000062
   26.2946 3.396957   1  3  1    2   26.2933  3.397117   -0.0013 -0.000159
   26.7896 3.335110   3  1  2    2   26.7952  3.334426    0.0056  0.000684
   27.7729 3.218872   2  0  8    2   27.7691  3.219300   -0.0038 -0.000428
   29.4878 3.034936   1  1  9    2   29.4846  3.035256   -0.0032 -0.000319
   30.0916 2.975233   3  1  5    2   30.0909  2.975300   -0.0007 -0.000067
   31.4082 2.853123   4  0  4    2   31.4075  2.853181   -0.0007 -0.000058
   33.0848 2.711908   0  2 10    2   33.0828  2.712069   -0.0020 -0.000161
   33.4950 2.679546   1  3  7    2   33.4948  2.679559   -0.0002 -0.000013
   33.9045 2.648034   3  2  4    2   33.9012  2.648284   -0.0033 -0.000249
   34.5627 2.598977   0  3  9    2   34.5611  2.599094   -0.0016 -0.000116
   36.6261 2.456824   0  5  1    2   36.6208  2.457168   -0.0053 -0.000344
   37.7306 2.387247   0  4  8    2   37.7298  2.387299   -0.0008 -0.000052
   38.8219 2.322472   2  4  1    2   38.8192  2.322629   -0.0027 -0.000157
   41.9265 2.157054   4  0 10    2   41.9275  2.157003    0.0010  0.000051
   45.8077 1.982580   4  2  8    2   45.8101  1.982481    0.0024  0.000099
   54.7505 1.677519   4  4  6    2   54.7512  1.677499    0.0007  0.000020
   87.1429 1.118394   8  2 15    2   87.1434  1.118389    0.0005  0.000005

 rmse = 0.00002282239
 
     A =14.2337(3)             B =14.2337(3)              C =30.202(1)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 5299.0(0)