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: adr70CaSc30
      _database_code_amcsd 0004185

      CELL PARAMETERS:   12.1128  12.1128  12.1128   90.000   90.000   90.000
      SPACE GROUP: Ia-3d     
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:   1777.189
      Density (g/cm3):      3.752
      MAX. ABS. INTENSITY / VOLUME**2:      22.95379495    
      RIR:      1.992
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                20.74         17.04        4.2825    2   2   0        12
                29.50         70.44        3.0282    4   0   0         6
                33.07        100.00        2.7085    4   2   0        24
                34.74          9.50        2.5825    3   3   2        24
                36.33         69.26        2.4725    4   2   2        24
                37.87         15.56        2.3755    4   3   1        48
                40.80         13.52        2.2115    5   2   1        48
                46.20         11.52        1.9650    5   3   2        48
                46.20         11.52        1.9650    6   1   1        24
                47.47         13.07        1.9152    6   2   0        24
                52.33          6.57        1.7483    4   4   4         8
                54.64         28.48        1.6797    6   4   0        24
                56.88         82.69        1.6186    6   4   2        48
                61.22         12.49        1.5141    8   0   0         6
                62.27          1.84        1.4910    7   4   1        48
                64.35          1.01        1.4478    6   5   3        48
                65.37          2.21        1.4275    8   2   2        24
                69.40         17.43        1.3543    8   4   0        24
                71.37         17.12        1.3216    8   4   2        48
                73.32         12.68        1.2912    6   6   4        24
                74.28          1.08        1.2768    8   5   1        48
                74.28          1.10        1.2768    7   5   4        48
                77.16          1.19        1.2363    8   4   4        24
                78.11          1.72        1.2236    8   5   3        48
                78.11          1.81        1.2236    9   4   1        48
                86.55          8.93        1.1246    8   6   4        48
                86.55          5.54        1.1246   10   4   0        24
                88.40         18.60        1.1057   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.