ThC
      Wyckoff R W G
      Crystal Structures 1 (1963) 85-237
      Second edition. Interscience Publishers, New York, New York
      rocksalt structure
      _database_code_amcsd 0011420

      CELL PARAMETERS:    5.3380   5.3380   5.3380   90.000   90.000   90.000
      SPACE GROUP: Fm3m      
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    152.102
      Density (g/cm3):     10.656
      MAX. ABS. INTENSITY / VOLUME**2:      814.3016444    
      RIR:     24.883
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                28.97        100.00        3.0819    1   1   1         8
                33.58         62.12        2.6690    2   0   0         6
                48.22         41.35        1.8873    2   2   0        12
                57.24         39.44        1.6095    3   1   1        24
                60.04         13.13        1.5409    2   2   2         8
                70.58          5.61        1.3345    4   0   0         6
                78.03         13.73        1.2246    3   3   1        24
                80.46         14.59        1.1936    4   2   0        24
================================================================================
       XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
  For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.