Andradite
      Quartieri S, Oberti R, Boiocchi M, Dalconi M C, Boscherini F , Safonova O,
      Woodland A B
      American Mineralogist 91 (2006) 1240-1248
      Site preference and local geometry of Sc in garnets: Part II.
      The crystal-chemistry of octahedral Sc in the andradite-Ca3Sc2Si3O12 join
      Sample: adr100
      _database_code_amcsd 0004182

      CELL PARAMETERS:   12.0578  12.0578  12.0578   90.000   90.000   90.000
      SPACE GROUP: Ia-3d     
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:   1753.090
      Density (g/cm3):      3.850
      MAX. ABS. INTENSITY / VOLUME**2:      23.47927609    
      RIR:      1.986
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                20.84         24.91        4.2631    2   2   0        12
                29.64         75.56        3.0145    4   0   0         6
                33.23        100.00        2.6962    4   2   0        24
                34.90          9.13        2.5707    3   3   2        24
                36.51         77.19        2.4613    4   2   2        24
                38.05         15.31        2.3647    4   3   1        48
                41.00         13.37        2.2014    5   2   1        48
                46.42         11.42        1.9560    6   1   1        24
                46.42         11.13        1.9560    5   3   2        48
                47.70         15.40        1.9065    6   2   0        24
                52.59          5.82        1.7404    4   4   4         8
                54.91         28.20        1.6721    6   4   0        24
                57.17         88.82        1.6113    6   4   2        48
                61.53         13.73        1.5072    8   0   0         6
                62.59          1.76        1.4842    7   4   1        48
                65.71          2.91        1.4210    8   2   2        24
                69.76         19.27        1.3481    8   4   0        24
                71.74         17.13        1.3156    8   4   2        48
                73.71         14.02        1.2854    6   6   4        24
                74.68          1.05        1.2710    8   5   1        48
                74.68          1.06        1.2710    7   5   4        48
                77.58          1.57        1.2306    8   4   4        24
                78.53          1.73        1.2180    8   5   3        48
                78.53          1.81        1.2180    9   4   1        48
                87.04          9.15        1.1195    8   6   4        48
                87.04          5.62        1.1195   10   4   0        24
                88.91         20.24        1.1007   10   4   2        48
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       XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
  For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.