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 #019 at P = 3.97 GPa, T = 659 K
      _database_code_amcsd 0002542

      CELL PARAMETERS:    6.9656   8.6709   6.4816   90.000  113.399   90.000
      SPACE GROUP: A2/a      
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    359.281
      Density (g/cm3):      3.624
      MAX. ABS. INTENSITY / VOLUME**2:      13.18788592    
      RIR:      1.185
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                18.08         26.31        4.9052    0   1   1         4
                20.49          1.30        4.3355    0   2   0         2
                26.27          1.71        3.3919    1   1   1         4
                27.88        100.00        3.1998   -2   1   1         4
                30.04         91.85        2.9743    0   0   2         2
                31.94          8.46        2.8020   -2   0   2         2
                34.50         92.96        2.5997    0   3   1         4
                34.62          1.49        2.5912   -1   2   2         4
                34.87         53.64        2.5727    2   2   0         4
                38.25          4.08        2.3533   -2   2   2         4
                38.32          6.15        2.3491    2   1   1         4
                39.63         28.95        2.2744    1   3   1         4
                40.24         14.01        2.2410   -3   1   1         4
                40.76          7.72        2.2137   -2   3   1         4
                41.66          6.22        2.1677    0   4   0         2
                43.34         10.65        2.0876   -1   1   3         4
                43.64          6.69        2.0740    1   2   2         4
                44.11          8.61        2.0529    1   4   0         4
                44.40         25.09        2.0404   -2   1   3         4
                47.01          9.51        1.9330    0   1   3         4
                47.55          1.01        1.9124    3   2   0         4
                48.84          2.29        1.8646    2   3   1         4
                49.46          4.29        1.8428    2   0   2         2
                50.44          1.23        1.8091   -3   3   1         4
                50.90          9.38        1.7941    2   4   0         4
                52.09          1.78        1.7556    3   1   1         4
                52.22          3.67        1.7518    0   4   2         4
                53.21         15.37        1.7214   -4   0   2         2
                53.44         14.45        1.7145   -2   4   2         4
                53.98          2.33        1.6986   -2   3   3         4
                54.07         21.58        1.6960    2   2   2         4
                54.23          5.44        1.6915   -4   1   1         4
                55.46          2.39        1.6567   -1   5   1         4
                56.26         30.91        1.6351    0   3   3         4
                57.68          7.96        1.5982    4   0   0         2
                59.70         16.08        1.5488   -2   5   1         4
                61.21          9.12        1.5142   -2   2   4         4
                61.87          1.27        1.4995    4   2   0         4
                62.45          5.42        1.4871    0   0   4         2
                62.74         19.58        1.4810   -4   3   1         4
                63.14          1.99        1.4725    1   3   3         4
                64.48          2.09        1.4452    0   6   0         2
                65.38          5.88        1.4274    2   1   3         4
                66.10          9.79        1.4136    2   5   1         4
                66.61          1.53        1.4040    2   4   2         4
                66.77         14.83        1.4010   -4   0   4         2
                67.17          9.66        1.3936   -4   3   3         4
                69.76          1.50        1.3481   -4   4   2         4
                70.42          8.10        1.3370   -2   5   3         4
                71.51          2.65        1.3193   -1   6   2         4
                72.75          7.76        1.2998    0   6   2         4
                73.03          2.17        1.2956   -2   4   4         4
                74.96          9.77        1.2669    4   3   1         4
                78.37          4.60        1.2202    4   0   2         2
                78.42          1.91        1.2194   -5   3   3         4
                79.42          1.53        1.2067   -3   6   2         4
                80.27          1.11        1.1960    3   6   0         4
                81.51          1.22        1.1809    2   0   4         2
                81.87          1.00        1.1766   -4   4   4         4
                82.61          1.49        1.1679   -3   3   5         4
                85.16          2.51        1.1394    2   2   4         4
                87.19          4.30        1.1180   -4   3   5         4
                87.87          1.69        1.1111    2   5   3         4
                88.30          2.06        1.1068   -4  -6   2         4
                88.52          2.59        1.1046    2   7   1         4
                88.97          5.66        1.1002    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.