Chekcell: Results for xfit.txt
CRYSFIRE Solution Nb   0
Cell:    6.2980    6.2980   21.6480    90.000    90.000    90.000
Space group:NO EXT.
Wavelength:    1.54056
Angular Tolerance:    0.100
Nb of calculated lines:  393
Nb of observed lines  :    7
Nb of indexed lines   :    7
Mean difference:  0.00453 (SQRT(Dif^2)/Nb)

  N    h   k   l    ThObs     Thcalc     Dif
   1   0   2   1    28.608    28.622    -0.014
   2   2   2   1    40.688    40.700    -0.012
   3   1   1   9    42.677    42.688    -0.011
   4   1   3   3    47.306    47.309    -0.003
   5   3   1   5    50.412    50.392     0.020
   6   2   3   3    53.952    53.964    -0.012
   7   1   1  13    59.189    59.187     0.002
