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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
 ******************************************************************************
 
 R060817
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.022
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    7.214812.280486   0  0  2    2    7.2247 12.263604    0.0099  0.016882
   14.4535 6.132706   0  0  4    2   14.4556  6.131802    0.0021  0.000904
   19.3044 4.599408   4  2  0    2   19.3065  4.598921    0.0021  0.000488
   21.7473 4.087423   0  0  6    2   21.7449  4.087868   -0.0024 -0.000445
   23.4477 3.794429  -4  2  4    2   23.4424  3.795276   -0.0053 -0.000847
   24.9219 3.573014   4  2  4    2   24.9219  3.573009    0.0000  0.000005
   26.6138 3.349392   1  1  7    2   26.6151  3.349237    0.0013  0.000155
   29.1249 3.065849   0  0  8    2   29.1244  3.065901   -0.0005 -0.000052
   32.4993 2.754593  -8  0  2    2   32.4942  2.755018   -0.0051 -0.000425
   33.9787 2.637888   4  5  3    2   33.9857  2.637359    0.0070  0.000530
   34.3968 2.606754  -8  0  4    2   34.4066  2.606036    0.0098  0.000718
   36.2457 2.477829   5  5  3    2   36.2394  2.478246   -0.0063 -0.000417
   37.3511 2.406953   4  5  5    2   37.3490  2.407084   -0.0021 -0.000130
   37.7369 2.383213  -8  0  6    2   37.7337  2.383406   -0.0032 -0.000192
   41.8435 2.158196   4  5  7    2   41.8454  2.158101    0.0019  0.000094

 rmse = 0.00004021137
 
     A =22.290(3)              B =16.389(3)               C =24.598(3)           
 Alpha =90                  Beta =94.35(2)            Gamma =90                  
 
 Volume = 8960(1)