******************************************************************************
       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
 ******************************************************************************
 
 R060194
 
 Symmetry constraint is: TRICLINIC   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.061
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   24.2598 3.674895   1  2  1    2   24.2564  3.675409   -0.0034 -0.000514
   25.8460 3.452310   2  0  0    2   25.8361  3.453611   -0.0099 -0.001301
   27.2246 3.280146  -1  2  1    2   27.2340  3.279036    0.0094  0.001111
   28.3728 3.149673   0  2  2    2   28.3685  3.150140   -0.0043 -0.000468
   29.0726 3.075269   2  0  1    2   29.0647  3.076088   -0.0079 -0.000818
   29.7096 3.010631  -2  1  0    2   29.7107  3.010525    0.0011  0.000106
   30.1957 2.963164  -2  1  1    2   30.2051  2.962260    0.0094  0.000904
   31.0055 2.887440  -1 -3  1    2   31.0045  2.887534   -0.0010 -0.000095
   32.2163 2.781422   1  3  1    2   32.2151  2.781524   -0.0012 -0.000101
   34.9386 2.570303   2  1  2    2   34.9443  2.569894    0.0057  0.000409
   38.2109 2.357021   3  1  0    2   38.2117  2.356976    0.0008  0.000045
   41.3342 2.185582   1  4  1    2   41.3359  2.185497    0.0017  0.000085
   47.3259 1.921542  -2  3  2    2   47.3229  1.921656   -0.0030 -0.000113

 rmse = 0.00005496249
 
     A =7.151(1)               B =9.189(1)                C =8.960(5)            
 Alpha =91.88(2)            Beta =98.25(3)            Gamma =77.30(2)            
 
 Volume = 568.4(0)