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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050350
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.082
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   14.3009 6.223611   1  1  0    2   14.3121  6.218728    0.0112  0.004883
   18.9701 4.694351   2  0  0    2   18.9817  4.691504    0.0116  0.002848
   20.3164 4.384952   1  1  1    2   20.3248  4.383159    0.0084  0.001793
   22.5781 3.948958   0  0  2    2   22.5560  3.952798   -0.0221 -0.003840
   28.1378 3.177770  -2  2  1    2   28.1409  3.177427    0.0031  0.000344
   28.5867 3.128739  -3  1  1    2   28.5858  3.128833   -0.0009 -0.000095
   29.7184 3.011790   1  1  2    2   29.7185  3.011777    0.0001  0.000013
   30.5958 2.927159   3  1  0    2   30.5978  2.926968    0.0020  0.000191
   31.2965 2.863030   0  2  2    2   31.2970  2.862985    0.0005  0.000045
   31.9053 2.809634  -2  2  2    2   31.9037  2.809767   -0.0016 -0.000133
   38.4189 2.345923   4  0  0    2   38.4218  2.345752    0.0029  0.000171
   41.2441 2.191197   2  2  2    2   41.2366  2.191579   -0.0075 -0.000382
   42.2520 2.141128  -3  3  1    2   42.2538  2.141042    0.0018  0.000086
   43.7100 2.072894   3  3  0    2   43.7097  2.072909   -0.0003 -0.000015
   45.1992 2.007873   0  4  1    2   45.1947  2.008063   -0.0045 -0.000190
   50.7497 1.800167   2  2  3    2   50.7500  1.800156    0.0003  0.000011
   51.4292 1.777930   1  3  3    2   51.4365  1.777694    0.0073  0.000235
   59.1013 1.563793   6  0  0    2   59.0996  1.563835   -0.0017 -0.000042

 rmse = 0.00005270384
 
     A =    10.135(1)          B =     8.3046(8)          C =     8.539(2)       
 Alpha =    90.             Beta =   112.21(2)        Gamma =    90.             
 
 Volume =    665.3(1)