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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060011
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.031
  
 Number of iterations =   1

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    9.6517 9.185567   1  0  0    2    9.6478  9.189312   -0.0039 -0.003744
   13.8275 6.413321   1  1  0    2   13.8264  6.413820   -0.0011 -0.000499
   19.3264 4.596238   2  0  0    2   19.3331  4.594656    0.0067  0.001582
   19.8391 4.478413   0  2  0    2   19.8405  4.478101    0.0014  0.000312
   21.2360 4.186443  -1  0  2    2   21.2271  4.188181   -0.0089 -0.001738
   21.7464 4.089184   2  1  0    2   21.7523  4.088084    0.0059  0.001100
   22.0886 4.026512   1  2  0    2   22.0939  4.025551    0.0053  0.000961
   27.8198 3.207726   2  2  0    2   27.8270  3.206910    0.0072  0.000816
   31.5136 2.839283   1  3  0    2   31.5132  2.839320   -0.0004 -0.000037
   32.2203 2.778542  -1  3  1    2   32.2132  2.779135   -0.0071 -0.000593
   34.0056 2.636507  -2  1  3    2   34.0078  2.636339    0.0022  0.000169
   35.5120 2.527946   3  2  0    2   35.5079  2.528228   -0.0041 -0.000282
   35.8675 2.503679   2  3  0    2   35.8721  2.503371    0.0046  0.000309
   39.2126 2.297288   4  0  0    2   39.2119  2.297328   -0.0007 -0.000040
   45.0373 2.012575   2  4  0    2   45.0326  2.012775   -0.0047 -0.000201
   66.4657 1.406093  -1  6  2    2   66.4672  1.406066    0.0015  0.000027

 rmse = 0.00003746464
 
     A =10.081(6)              B =8.9562(4)               C =8.376(2)            
 Alpha =90                  Beta =114.28(8)           Gamma =90                  
 
 Volume = 689.4(0)