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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050119
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.011
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   11.1770 7.917506   1  1  0    2   11.1787  7.916330    0.0017  0.001176
   14.0544 6.301074   1  0  1    2   14.0489  6.303537   -0.0055 -0.002463
   19.4156 4.570596   3  0  0    2   19.4160  4.570495    0.0004  0.000100
   21.2189 4.185858   2  1  1    2   21.2204  4.185564    0.0015  0.000295
   22.4562 3.957831   2  2  0    2   22.4543  3.958165   -0.0019 -0.000334
   25.9178 3.436312   0  1  2    2   25.9216  3.435819    0.0038  0.000493
   26.5735 3.352955   1  3  1    2   26.5804  3.352099    0.0069  0.000856
   28.9133 3.086616   4  0  1    2   28.9118  3.086770   -0.0015 -0.000154
   29.8517 2.991653   4  1  0    2   29.8472  2.992092   -0.0045 -0.000439
   30.5175 2.927860   1  2  2    2   30.5136  2.928223   -0.0039 -0.000363
   31.0806 2.876068   3  2  1    2   31.0827  2.875877    0.0021  0.000191
   34.5475 2.594880   3  1  2    2   34.5506  2.594655    0.0031  0.000225
   35.0633 2.557868   0  5  1    2   35.0610  2.558028   -0.0023 -0.000159
   38.0155 2.365684   0  0  3    2   38.0097  2.366032   -0.0058 -0.000347
   38.2124 2.353943   2  3  2    2   38.2104  2.354061   -0.0020 -0.000119
   38.6773 2.326703   5  1  1    2   38.6790  2.326605    0.0017  0.000099
   42.0311 2.148428   4  3  1    2   42.0313  2.148420    0.0002  0.000008
   43.0202 2.101282   0  3  3    2   43.0224  2.101179    0.0022  0.000103
   43.1964 2.093116   4  2  2    2   43.2036  2.092782    0.0072  0.000334
   45.8181 1.979232   4  4  0    2   45.8218  1.979083    0.0037  0.000150
   47.7782 1.902489   3  4  2    2   47.7701  1.902794   -0.0081 -0.000305
   49.0552 1.855898   1  4  3    2   49.0553  1.855894    0.0001  0.000004
   49.6044 1.836624   6  2  1    2   49.6027  1.836683   -0.0017 -0.000058
   58.2330 1.583299   5  5  0    2   58.2343  1.583266    0.0013  0.000033
   58.9680 1.565301   8  1  1    2   58.9680  1.565300    0.0000  0.000001
   71.9385 1.311621   0  4  5    2   71.9404  1.311591    0.0019  0.000030
   76.2365 1.248002   5  4  4    2   76.2348  1.248025   -0.0017 -0.000023

 rmse = 0.00003283277
 
     A =    15.8326(3)         B =    15.8326(3)          C =     7.0980(2)      
 Alpha =    90.             Beta =    90.             Gamma =   120.             
 
 Volume =   1540.92(6)