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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050257
 
 Symmetry constraint is: ORTHORHOMBIC
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.039
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   17.1728 5.171009   0  2  0    2   17.1696  5.171978   -0.0032 -0.000968
   20.7679 4.281571   1  1  0    2   20.7734  4.280457    0.0055  0.001113
   22.6959 3.921394   0  2  1    2   22.6959  3.921386    0.0000  0.000009
   24.0388 3.704925   1  0  1    2   24.0434  3.704232    0.0046  0.000693
   32.2190 2.779349   1  3  0    2   32.2053  2.780499   -0.0137 -0.001150
   35.5816 2.523726   1  3  1    2   35.5802  2.523825   -0.0014 -0.000099
   36.5194 2.460971   1  1  2    2   36.5252  2.460591    0.0058  0.000380
   37.8717 2.376055   0  4  1    2   37.8778  2.375684    0.0061  0.000371
   39.3064 2.292482   2  1  0    2   39.3061  2.292499   -0.0003 -0.000017
   39.7898 2.265711   1  4  0    2   39.7864  2.265899   -0.0034 -0.000189
   49.1902 1.852122   2  0  2    2   49.1904  1.852116    0.0002  0.000006
   50.5282 1.806132   1  5  1    2   50.5264  1.806191   -0.0018 -0.000059
   55.4281 1.657390   0  6  1    2   55.4333  1.657248    0.0052  0.000142
   56.5816 1.626284   1  3  3    2   56.5872  1.626136    0.0056  0.000148
   58.2258 1.584183   0  4  3    2   58.2174  1.584392   -0.0084 -0.000209

 rmse = 0.00005787655
 
     A =4.7019(5)              B =10.3440(6)              C =6.0142(5)           
 Alpha =90                  Beta =90                  Gamma =90                  
 
 Volume = 292.51(3)