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
      Locality: synthetic
      Sample: adr90CaSc10
      _database_code_amcsd 0004183

      CELL PARAMETERS:   12.0748  12.0748  12.0748   90.000   90.000   90.000
      SPACE GROUP: Ia-3d     
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:   1760.515
      Density (g/cm3):      3.818
      MAX. ABS. INTENSITY / VOLUME**2:      23.17133973    
      RIR:      1.976
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                20.81         22.16        4.2691    2   2   0        12
                29.59         74.19        3.0187    4   0   0         6
                33.18        100.00        2.7000    4   2   0        24
                34.85          9.39        2.5744    3   3   2        24
                36.45         74.29        2.4648    4   2   2        24
                38.00         15.58        2.3681    4   3   1        48
                40.94         13.73        2.2045    5   2   1        48
                46.35         11.46        1.9588    5   3   2        48
                46.35         11.69        1.9588    6   1   1        24
                47.63         14.79        1.9092    6   2   0        24
                52.51          6.07        1.7428    4   4   4         8
                54.83         28.51        1.6745    6   4   0        24
                57.08         87.00        1.6136    6   4   2        48
                61.43         13.24        1.5093    8   0   0         6
                62.49          1.83        1.4863    7   4   1        48
                65.61          2.70        1.4230    8   2   2        24
                69.65         18.62        1.3500    8   4   0        24
                71.63         16.95        1.3175    8   4   2        48
                73.59         13.53        1.2872    6   6   4        24
                74.56          1.13        1.2728    7   5   4        48
                74.56          1.10        1.2728    8   5   1        48
                77.45          1.47        1.2324    8   4   4        24
                78.40          1.80        1.2197    8   5   3        48
                78.40          1.87        1.2197    9   4   1        48
                86.89          5.55        1.1211   10   4   0        24
                86.89          8.89        1.1211    8   6   4        48
                88.76         19.65        1.1023   10   4   2        48
================================================================================
       XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
  For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.