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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050126
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.041
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   15.3239 5.792630   0  1  1    2   15.3271  5.791411    0.0032  0.001219
   16.5243 5.373391  -1  1  1    2   16.5241  5.373466   -0.0002 -0.000074
   17.5007 5.075038   0  2  0    2   17.5016  5.074765    0.0009  0.000272
   18.0118 4.931838   1  1  1    2   18.0097  4.932413   -0.0021 -0.000575
   23.3060 3.820154   2  1  1    2   23.3020  3.820804   -0.0040 -0.000650
   29.9206 2.987826   3  1  1    2   29.9186  2.988025   -0.0020 -0.000199
   31.1018 2.876843  -1  2  2    2   31.1036  2.876677    0.0018  0.000167
   33.3609 2.686776  -2  2  2    2   33.3614  2.686733    0.0005  0.000043
   34.2915 2.615875   2  3  1    2   34.2940  2.615686    0.0025  0.000189
   36.3211 2.474057   1  4  0    2   36.3212  2.474051    0.0001  0.000006
   45.0892 2.010787   5  1  1    2   45.0899  2.010756    0.0007  0.000030
   45.8256 1.980144  -2  4  2    2   45.8240  1.980208   -0.0016 -0.000064

 rmse = 0.00001590897
 
     A =    11.234(1)        B =    10.1495(4)          C =     7.1098(7)      
 Alpha =    90.             Beta =    97.303(8)       Gamma =    90.             
 
 Volume =    804.10(5)