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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060465
 
 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
    9.8940 8.985328   0  2  0    2    9.8980  8.981683    0.0040  0.003645
   11.2224 7.918973   2  0  0    2   11.2240  7.917851    0.0016  0.001122
   13.0842 6.790985  -2  0  1    2   13.0791  6.793612   -0.0051 -0.002626
   13.3822 6.639761   0  0  1    2   13.3801  6.640798   -0.0021 -0.001037
   15.8630 5.602680   1  3  0    2   15.8684  5.600776    0.0054  0.001904
   16.9183 5.254297  -3  1  1    2   16.9190  5.254079    0.0007  0.000218
   17.3861 5.113485   1  1  1    2   17.3856  5.113624   -0.0005 -0.000139
   19.0898 4.659392  -1  3  1    2   19.0925  4.658739    0.0027  0.000653
   19.8169 4.489539   0  4  0    2   19.8111  4.490842   -0.0058 -0.001303
   20.4047 4.361145  -4  0  1    2   20.4013  4.361860   -0.0034 -0.000715
   23.2258 3.836074   2  2  1    2   23.2304  3.835328    0.0046  0.000746
   25.0319 3.562588  -3  1  2    2   25.0356  3.562071    0.0037  0.000516
   25.7133 3.469488  -5  1  1    2   25.7124  3.469610   -0.0009 -0.000122
   26.0363 3.427078  -2  2  2    2   26.0343  3.427343   -0.0020 -0.000265
   26.8889 3.320078   0  0  2    2   26.8863  3.320399   -0.0026 -0.000321
   28.1184 3.177334  -4  2  2    2   28.1198  3.177181    0.0014  0.000153

 rmse = 0.00001838096
 
     A =    17.691(2)          B =    17.963(3)           C =     7.4190(5)      
 Alpha =    90.             Beta =   116.479(7)       Gamma =    90.             
 
 Volume =   2110.4(3)