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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050569
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.058
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   13.2248 6.718430   1  0  0    2   13.2279  6.716850    0.0031  0.001581
   15.9409 5.575134   0  0  1    2   15.9535  5.570760    0.0126  0.004374
   17.9230 4.960807  -1  0  1    2   17.9285  4.959304    0.0055  0.001502
   18.9992 4.681305   0  1  1    2   18.9997  4.681186    0.0005  0.000119
   20.6130 4.317273   0  2  0    2   20.6112  4.317638   -0.0018 -0.000365
   23.2483 3.832290   1  0  1    2   23.2531  3.831510    0.0048  0.000780
   24.5527 3.631088   1  2  0    2   24.5465  3.631987   -0.0062 -0.000899
   25.4710 3.501923   1  1  1    2   25.4687  3.502240   -0.0023 -0.000316
   26.5825 3.357646   2  0  0    2   26.5762  3.358425   -0.0063 -0.000779
   28.5537 3.129704   2  1  0    2   28.5506  3.130036   -0.0031 -0.000332
   29.2154 3.060167  -2  1  1    2   29.2225  3.059440    0.0071  0.000727
   31.2407 2.865875   1  2  1    2   31.2414  2.865812    0.0007  0.000063
   32.1707 2.784969   0  0  2    2   32.1658  2.785380   -0.0049 -0.000411
   33.9089 2.645835   1  3  0    2   33.9104  2.645723    0.0015  0.000112
   35.1186 2.557267   0  3  1    2   35.1191  2.557230    0.0005  0.000036
   52.7515 1.735630  -4  0  1    2   52.7504  1.735663   -0.0011 -0.000034
   61.6482 1.504538   4  0  1    2   61.6493  1.504514    0.0011  0.000024

 rmse = 0.00003099891
 
     A =     6.9500(3)         B =     8.6352(7)          C =     5.7641(6)      
 Alpha =    90.             Beta =   104.883(6)       Gamma =    90.             
 
 Volume =    334.33(4)