Titanite
      Kunz M, Arlt T, Stolz J
      American Mineralogist 85 (2000) 1465-1473
      In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
      and high temperature
      Sample #034 at P = 4.89 GPa, T = 656 K
      _database_code_amcsd 0002557

      CELL PARAMETERS:    6.9443   8.6582   6.4621   90.000  113.327   90.000
      SPACE GROUP: A2/a      
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    356.776
      Density (g/cm3):      3.649
      MAX. ABS. INTENSITY / VOLUME**2:      14.94164414    
      RIR:      1.333
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                18.12         22.82        4.8947    0   1   1         4
                20.52          1.38        4.3291    0   2   0         2
                26.33          1.75        3.3852    1   1   1         4
                27.97        100.00        3.1903   -2   1   1         4
                27.98          1.42        3.1883    2   0   0         2
                30.12         79.57        2.9669    0   0   2         2
                32.05          7.39        2.7923   -2   0   2         2
                34.56         81.20        2.5954    0   3   1         4
                34.71          1.05        2.5846   -1   2   2         4
                34.95         45.94        2.5672    2   2   0         4
                38.36          3.51        2.3465   -2   2   2         4
                38.40          5.37        2.3442    2   1   1         4
                39.70         25.88        2.2705    1   3   1         4
                40.37         11.60        2.2345   -3   1   1         4
                40.86          6.20        2.2088   -2   3   1         4
                41.73          4.60        2.1646    0   4   0         2
                43.47          9.90        2.0818   -1   1   3         4
                43.73          5.89        2.0698    1   2   2         4
                44.19          8.25        2.0497    1   4   0         4
                44.55         20.31        2.0339   -2   1   3         4
                47.13          8.06        1.9283    0   1   3         4
                48.94          1.80        1.8612    2   3   1         4
                49.57          3.51        1.8390    2   0   2         2
                51.00          9.23        1.7908    2   4   0         4
                52.22          1.60        1.7518    3   1   1         4
                52.32          2.60        1.7486    0   4   2         4
                53.40         14.75        1.7159   -4   0   2         2
                53.57         13.85        1.7107   -2   4   2         4
                54.14          2.18        1.6941   -2   3   3         4
                54.19         19.92        1.6926    2   2   2         4
                54.40          4.76        1.6867   -4   1   1         4
                55.56          2.19        1.6540   -1   5   1         4
                56.39         27.43        1.6316    0   3   3         4
                57.84          5.90        1.5942    4   0   0         2
                59.82         13.54        1.5460   -2   5   1         4
                61.41          8.43        1.5098   -2   2   4         4
                62.62          4.89        1.4835    0   0   4         2
                62.91         17.61        1.4773   -4   3   1         4
                63.28          1.84        1.4696    1   3   3         4
                64.58          1.86        1.4430    0   6   0         2
                65.54          5.09        1.4244    2   1   3         4
                66.22          8.38        1.4112    2   5   1         4
                66.74          1.57        1.4015    2   4   2         4
                67.03         13.03        1.3962   -4   0   4         2
                67.40          8.16        1.3894   -4   3   3         4
                70.60          7.47        1.3341   -2   5   3         4
                71.66          2.39        1.3170   -1   6   2         4
                72.89          6.89        1.2977    0   6   2         4
                73.24          2.13        1.2923   -2   4   4         4
                75.15          8.77        1.2642    4   3   1         4
                77.46          1.16        1.2322   -5   3   1         4
                78.57          4.35        1.2176    4   0   2         2
                78.71          1.38        1.2158   -5   3   3         4
                79.61          1.61        1.2042   -3   6   2         4
                80.44          1.01        1.1939    3   6   0         4
                81.72          1.04        1.1783    2   0   4         2
                82.91          1.59        1.1645   -3   3   5         4
                85.38          2.06        1.1370    2   2   4         4
                87.52          3.87        1.1146   -4   3   5         4
                88.08          1.51        1.1090    2   5   3         4
                88.54          1.67        1.1044   -4  -6   2         4
                88.70          2.71        1.1028    2   7   1         4
                89.23          4.97        1.0976    0   3   5         4
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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.