Wairakite
      Seryotkin Y V, Joswig W, Bakakin V V, Belitsky I A, Fursenko B A
      European Journal of Mineralogy 15 (2003) 475-484
      High-temperature crystal structure of wairakite
      Sample: Wai-400, T = 400 C
      _database_code_amcsd 0006993

      CELL PARAMETERS:   13.6620  13.6620  13.5550   90.000   90.000   90.000
      SPACE GROUP: I4_1/acd  
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:   2530.044
      Density (g/cm3):      2.146
      MAX. ABS. INTENSITY / VOLUME**2:      14.69716415    
      RIR:      2.230
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                12.96         26.12        6.8310    2   0   0         4
                15.91        100.00        5.5701    2   1   1        16
                15.97         18.29        5.5483    1   1   2         8
                18.37         14.68        4.8302    2   2   0         4
                18.44          3.24        4.8112    2   0   2         8
                24.39          1.63        3.6493    3   2   1        16
                24.43         11.90        3.6431    3   1   2        16
                26.09         40.14        3.4155    4   0   0         4
                26.30         34.09        3.3888    0   0   4         2
                30.74         14.01        2.9086    3   3   2         8
                30.80         18.46        2.9034    3   2   3        16
                32.14          1.35        2.7851    4   2   2        16
                32.27          3.55        2.7741    2   2   4         8
                33.45          3.91        2.6785    4   3   1        16
                33.54          1.50        2.6720    4   1   3        16
                33.61          7.62        2.6664    3   1   4        16
                36.02          1.35        2.4937    5   2   1        16
                36.05         11.75        2.4917    5   1   2        16
                36.25          5.91        2.4780    2   1   5        16
                37.23          2.18        2.4151    4   4   0         4
                37.38          1.34        2.4056    4   0   4         8
                39.72          2.38        2.2690    4   2   4        16
                40.72          4.97        2.2158    6   1   1        16
                41.82          1.04        2.1602    6   2   0         8
                42.13          1.79        2.1449    2   0   6         8
                47.16          1.15        1.9272    5   3   4        16
                48.02          2.79        1.8946    6   4   0         8
                48.15          2.63        1.8900    6   0   4         8
                48.30          1.07        1.8843    4   0   6         8
                49.06          1.17        1.8567    6   3   3        16
                49.27          1.69        1.8494    3   3   6         8
                50.23          1.98        1.8164    4   2   6        16
                52.79          2.87        1.7342    7   3   2        16
                52.82          3.62        1.7331    7   2   3        16
                52.94          1.75        1.7296    6   1   5        16
                53.02          2.38        1.7271    5   1   6        16
                53.11          3.35        1.7243    3   2   7        16
                54.58          2.54        1.6815    7   4   1        16
                54.68          1.79        1.6785    7   1   4        16
                54.92          1.19        1.6719    4   1   7        16
                57.22          1.25        1.6101    6   6   0         4
                58.09          2.09        1.5880    8   3   1        16
                58.14          1.17        1.5866    8   1   3        16
                58.51          1.13        1.5774    3   1   8        16
                62.70          1.07        1.4817    4   2   8        16
                63.13          2.00        1.4727    9   1   2        16
                63.63          1.96        1.4623    2   1   9        16
                66.39          1.56        1.4081    9   2   3        16
                66.39          1.21        1.4081    7   6   3        16
                69.49          1.02        1.3526   10   1   1        16
                69.51          1.35        1.3523    7   7   2         8
                69.79          2.11        1.3476    7   2   7        16
                70.10          1.61        1.3424    1   1  10         8
                72.58          1.21        1.3025   10   3   1        16
                74.39          1.45        1.2752    8   1   7        16
                78.66          1.54        1.2164    9   6   3        16
================================================================================
       XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
  For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.