******************************************************************************
       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
 ******************************************************************************
 
 R060662
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.047
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
    7.491811.864676   1  1  0    2    7.4897 11.868049   -0.0021 -0.003373
    9.8915 8.977257   0  2  0    2    9.8950  8.974118    0.0035  0.003140
   11.2245 7.909464   2  0  0    2   11.2235  7.910171   -0.0010 -0.000707
   13.0926 6.780741  -2  0  1    2   13.0890  6.782620   -0.0036 -0.001879
   13.3817 6.634375   0  0  1    2   13.3782  6.636110   -0.0035 -0.001735
   14.9704 5.931481   2  2  0    2   14.9640  5.934024   -0.0064 -0.002544
   15.8776 5.593549   1  3  0    2   15.8707  5.595969   -0.0069 -0.002420
   16.9381 5.244673  -3  1  1    2   16.9352  5.245552   -0.0029 -0.000879
   17.3833 5.110978   1  1  1    2   17.3837  5.110858    0.0004  0.000120
   19.1003 4.654094  -1  3  1    2   19.1000  4.654172   -0.0003 -0.000078
   19.8044 4.489795   0  4  0    2   19.8166  4.487059    0.0122  0.002736
   20.4122 4.357147  -4  0  1    2   20.4233  4.354802    0.0111  0.002345
   23.8053 3.741992  -2  4  1    2   23.8035  3.742268   -0.0018 -0.000277
   26.0551 3.423171  -2  2  2    2   26.0531  3.423433   -0.0020 -0.000262
   28.1517 3.172386  -4  2  2    2   28.1520  3.172349    0.0003  0.000037
   28.5917 3.124478  -4  4  1    2   28.5866  3.125021   -0.0051 -0.000543
   29.0663 3.074448  -1  3  2    2   29.0687  3.074201    0.0024  0.000247

 rmse = 0.00002858794
 
     A =    17.665(4)          B =    17.948(3)           C =     7.4099(9)      
 Alpha =    90.             Beta =   116.41(2)        Gamma =    90.             
 
 Volume =   2104.0(6)