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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R061034
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.073
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   10.1846 8.740352   0  2  0    2   10.2215  8.708661    0.0369  0.031691
   12.6427 7.036144   0  0  2    2   12.6649  7.023787    0.0222  0.012357
   18.5159 4.806623   1  2  2    2   18.5328  4.802271    0.0169  0.004352
   24.3131 3.668633   2  3  1    2   24.3228  3.667184    0.0097  0.001449
   25.4107 3.512147   0  0  4    2   25.4126  3.511894    0.0019  0.000253
   25.7002 3.473125   1  4  2    2   25.7029  3.472760    0.0027  0.000364
   28.8701 3.097620   1  2  4    2   28.8636  3.098304   -0.0065 -0.000684
   34.0628 2.635333   1  4  4    2   34.0312  2.637716   -0.0316 -0.002384
   40.3321 2.238231   0  6  4    2   40.3465  2.237465    0.0144  0.000766
   47.9342 1.898961   4  6  0    2   47.9209  1.899458   -0.0133 -0.000497
   54.9741 1.670943   4  6  4    2   54.9814  1.670739    0.0073  0.000204
   61.3462 1.511558   6  0  4    2   61.3481  1.511515    0.0019  0.000043

 rmse = 0.00012560566
 
     A =10.047(2)              B =17.417(6)               C =14.048(6)           
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 2458.3(8)