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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R070535
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:    0.005
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    9.7002 9.105477   0  2  0    2    9.6949  9.110420   -0.0053 -0.004942
   13.0030 6.800080   2  0  0    2   13.0031  6.800042    0.0001  0.000038
   13.8874 6.369117   0  2  2    2   13.8809  6.372098   -0.0065 -0.002981
   16.3751 5.407008   2  0  2    2   16.3754  5.406895    0.0003  0.000113
   16.7213 5.295868   1  3  1    2   16.7224  5.295525    0.0011  0.000343
   19.0699 4.648791   2  2  2    2   19.0662  4.649686   -0.0037 -0.000895
   20.7789 4.270238   3  1  1    2   20.7743  4.271178   -0.0046 -0.000940
   21.8946 4.055145   1  3  3    2   21.8962  4.054860    0.0016  0.000285
   22.1819 4.003280   0  2  4    2   22.1767  4.004209   -0.0052 -0.000929
   23.8413 3.728329   2  0  4    2   23.8424  3.728166    0.0011  0.000163
   25.5468 3.483213   2  4  2    2   25.5433  3.483685   -0.0035 -0.000472
   28.7700 3.099957   3  3  3    2   28.7716  3.099791    0.0016  0.000166
   29.4538 3.029539   1  5  3    2   29.4618  3.028729    0.0080  0.000809
   29.7545 2.999608   1  3  5    2   29.7546  2.999600    0.0001  0.000008
   32.2499 2.773014   2  6  0    2   32.2517  2.772860    0.0018  0.000154
   34.9755 2.562938   3  5  3    2   34.9787  2.562711    0.0032  0.000227
   36.0562 2.488571   0  4  6    2   36.0494  2.489027   -0.0068 -0.000456
   36.6291 2.450958   5  1  3    2   36.6306  2.450863    0.0015  0.000095
   42.5270 2.123737   0  6  6    2   42.5208  2.124033   -0.0062 -0.000296
   43.0570 2.098818   2  8  2    2   43.0535  2.098980   -0.0035 -0.000162
   44.4267 2.037245   5  3  5    2   44.4223  2.037438   -0.0044 -0.000193
   50.0067 1.822230   0 10  0    2   50.0110  1.822084    0.0043  0.000147
   51.1754 1.783331   0  0 10    2   51.1810  1.783150    0.0056  0.000181
   55.9197 1.642763   8  2  2    2   55.9272  1.642559    0.0075  0.000204
   72.6816 1.299780   9  5  5    2   72.6772  1.299848   -0.0044 -0.000068

 rmse = 0.00004104805
 
     A =13.6001(5)             B =18.2208(9)              C =17.832(1)           
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 4418.7(3)