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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060221
 
 Symmetry constraint is: TRICLINIC   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.065
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   13.7055 6.486463  -1  1  0    2   13.7054  6.486507   -0.0001 -0.000044
   18.9602 4.692751   0 -2  1    2   18.9629  4.692075    0.0027  0.000676
   22.0314 4.043080  -2  0  1    2   22.0321  4.042954    0.0007  0.000126
   22.8112 3.906203   1 -1  1    2   22.8100  3.906407   -0.0012 -0.000204
   24.5161 3.637556   1  3  0    2   24.5177  3.637319    0.0016  0.000236
   25.7054 3.471462  -1 -1  2    2   25.7048  3.471546   -0.0006 -0.000084
   26.5258 3.365662  -1  1  2    2   26.5265  3.365580    0.0007  0.000082
   27.5467 3.242906  -2  2  0    2   27.5437  3.243254   -0.0030 -0.000348
   28.0712 3.183352   0  0  2    2   28.0734  3.183106    0.0022  0.000247
   28.5140 3.134802   2  2  0    2   28.5130  3.134906   -0.0010 -0.000104
   29.5121 3.030780   1 -3  1    2   29.5093  3.031058   -0.0028 -0.000279
   30.3046 2.953131   0 -4  1    2   30.3020  2.953382   -0.0026 -0.000252
   30.4775 2.936734   0 -2  2    2   30.4782  2.936673    0.0007  0.000061
   30.7563 2.910689  -2 -2  2    2   30.7696  2.909461    0.0133  0.001227
   31.5856 2.835974   1  3  1    2   31.5845  2.836069   -0.0011 -0.000094
   31.8198 2.815590  -1 -3  2    2   31.8201  2.815566    0.0003  0.000024
   33.8227 2.652974  -1  3  2    2   33.8210  2.653104   -0.0017 -0.000130
   36.8327 2.442399   2  2  1    2   36.8270  2.442765   -0.0057 -0.000367
   37.7124 2.387324   3  1  0    2   37.7121  2.387343   -0.0003 -0.000019
   37.9662 2.371919   2  4  0    2   37.9732  2.371495    0.0070  0.000423
   39.0097 2.310733  -3  3  1    2   39.0125  2.310572    0.0028  0.000161
   39.5117 2.282475  -3 -3  1    2   39.5046  2.282870   -0.0071 -0.000396
   42.2295 2.141424   0  6  0    2   42.2366  2.141078    0.0071  0.000346
   43.0765 2.101194   1  5  1    2   43.0704  2.101476   -0.0061 -0.000282
   49.3211 1.848423  -4  0  3    2   49.3270  1.848216    0.0059  0.000208
   51.5853 1.772382  -2  0  4    2   51.5806  1.772531   -0.0047 -0.000150
   57.1438 1.612274  -3  5  3    2   57.1332  1.612549   -0.0106 -0.000275
   57.3960 1.605780   0  8  0    2   57.3949  1.605808   -0.0011 -0.000028
   63.3378 1.468532  -4  6  2    2   63.3409  1.468468    0.0031  0.000064
   63.9295 1.456345   0  6  3    2   63.9386  1.456160    0.0091  0.000185
   64.2241 1.450367   2  8  0    2   64.2214  1.450421   -0.0027 -0.000054
   78.7466 1.215089   2  8  2    2   78.7460  1.215098   -0.0006 -0.000008

 rmse = 0.00005347740
 
     A =8.1791(6)              B =12.8798(6)              C =7.1032(4)           
 Alpha =93.450(6)           Beta =116.034(7)          Gamma =90.512(5)           
 
 Volume = 670.63(7)