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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060912
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.016
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    9.5296 9.288986   0  0  1    2    9.5426  9.276384    0.0130  0.012602
   14.2733 6.207172   1  1  0    2   14.2637  6.211316   -0.0096 -0.004143
   15.8833 5.580780  -1  1  1    2   15.8919  5.577764    0.0086  0.003016
   18.0198 4.923028   2  1  0    2   18.0196  4.923082   -0.0002 -0.000054
   18.3870 4.825444   1  1  1    2   18.3855  4.825842   -0.0015 -0.000398
   19.1086 4.644662   0  0  2    2   19.1355  4.638192    0.0269  0.006470
   22.0501 4.030800  -1  1  2    2   22.0607  4.028883    0.0106  0.001917
   22.9973 3.866762   3  1  0    2   22.9877  3.868363   -0.0096 -0.001601
   25.3344 3.514871  -3  1  2    2   25.3307  3.515380   -0.0037 -0.000510
   30.3050 2.948421   4  0  1    2   30.3042  2.948498   -0.0008 -0.000076
   32.2348 2.776087   0  2  2    2   32.2287  2.776597   -0.0061 -0.000509
   35.3327 2.539347  -4  2  1    2   35.3311  2.539459   -0.0016 -0.000112
   39.2778 2.292794  -1  1  4    2   39.2817  2.292577    0.0039  0.000218
   43.1856 2.093862   6  0  1    2   43.1856  2.093862    0.0000  0.000000
   43.7250 2.069265   1  1  4    2   43.7157  2.069685   -0.0093 -0.000420
   47.1229 1.927619   0  2  4    2   47.1261  1.927494    0.0032  0.000125
   48.7955 1.865361  -8  0  2    2   48.7926  1.865465   -0.0029 -0.000104
   59.1551 1.560924   8  2  0    2   59.1589  1.560832    0.0038  0.000091

 rmse = 0.00005640886
 
     A =14.930(1)              B =6.933(1)                C =9.903(1)            
 Alpha =90                  Beta =110.50(1)           Gamma =90                  
 
 Volume = 960.1(2)