******************************************************************************
       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
 ******************************************************************************
 
 R070334
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.063
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   12.1304 7.328206   1  1  0    2   12.1510  7.315749    0.0206  0.012458
   18.2416 4.876058   0  1  1    2   18.2406  4.876318   -0.0010 -0.000261
   19.4758 4.568746   1  1  1    2   19.4852  4.566560    0.0094  0.002186
   24.3877 3.656150   2  2  0    2   24.3761  3.657874   -0.0116 -0.001724
   26.1981 3.406844   1  2  1    2   26.2105  3.405261    0.0124  0.001583
   28.8919 3.094335   3  2  0    2   28.8798  3.095612   -0.0121 -0.001277
   30.6465 2.920689   0  0  2    2   30.6393  2.921363   -0.0072 -0.000673
   31.1171 2.877493   1  3  0    2   31.1175  2.877458    0.0004  0.000035
   33.3888 2.686352   2  3  0    2   33.3856  2.686604   -0.0032 -0.000253
   34.2644 2.619554   4  2  0    2   34.2748  2.618780    0.0104  0.000773
   34.7866 2.581345  -1  3  1    2   34.7889  2.581180    0.0023  0.000164
   37.6633 2.390198   4  2  1    2   37.6603  2.390380   -0.0030 -0.000182
   63.7150 1.460691   0  0  4    2   63.7155  1.460681    0.0005  0.000010

 rmse = 0.00006421004
 
     A =12.994(4)              B =8.852(1)                C =5.8427(4)           
 Alpha =90                  Beta =89.95(4)            Gamma =90                  
 
 Volume = 672.0(2)