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 #040 at P = 2.51 GPa, T = 523 K
      _database_code_amcsd 0002563

      CELL PARAMETERS:    6.9929   8.6850   6.5059   90.000  113.508   90.000
      SPACE GROUP: A2/a      
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    362.331
      Density (g/cm3):      3.593
      MAX. ABS. INTENSITY / VOLUME**2:      16.01252425    
      RIR:      1.451
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                18.04         23.85        4.9175    0   1   1         4
                20.45          1.73        4.3425    0   2   0         2
                26.21          1.69        3.3996    1   1   1         4
                27.77        100.00        3.2121   -2   1   1         4
                27.83          3.94        3.2063    2   0   0         2
                29.96         78.51        2.9830    0   0   2         2
                31.80          6.85        2.8144   -2   0   2         2
                34.43         65.25        2.6045    0   3   1         4
                34.51          1.24        2.5991   -1   2   2         4
                34.78         47.53        2.5794    2   2   0         4
                38.10          4.15        2.3618   -2   2   2         4
                38.22          4.09        2.3548    2   1   1         4
                39.55         17.35        2.2787    1   3   1         4
                40.09         10.34        2.2492   -3   1   1         4
                40.65          5.06        2.2196   -2   3   1         4
                41.59          3.62        2.1713    0   4   0         2
                43.19          8.68        2.0948   -1   1   3         4
                43.54          5.55        2.0787    1   2   2         4
                44.03         10.71        2.0566    1   4   0         4
                44.21         19.15        2.0486   -2   1   3         4
                46.22          1.59        1.9643   -3   2   2         4
                46.87          7.72        1.9385    0   1   3         4
                48.73          1.32        1.8686    2   3   1         4
                49.33          2.73        1.8472    2   0   2         2
                50.78          7.80        1.7978    2   4   0         4
                51.95          1.20        1.7601    3   1   1         4
                52.10          2.23        1.7555    0   4   2         4
                52.97         12.55        1.7286   -4   0   2         2
                53.29         10.04        1.7191   -2   4   2         4
                53.79          2.84        1.7041   -2   3   3         4
                53.94         19.98        1.6998    2   2   2         4
                54.02          3.84        1.6975   -4   1   1         4
                55.35          1.92        1.6598   -1   5   1         4
                56.11         25.89        1.6392    0   3   3         4
                57.49          4.36        1.6031    4   0   0         2
                59.56         13.59        1.5521   -2   5   1         4
                60.64          1.35        1.5270    3   3   1         4
                60.97          7.00        1.5197   -2   2   4         4
                62.25          4.46        1.4915    0   0   4         2
                62.52         18.67        1.4856   -4   3   1         4
                62.98          1.64        1.4759    1   3   3         4
                64.36          2.50        1.4475    0   6   0         2
                65.21          3.97        1.4307    2   1   3         4
                65.96          7.40        1.4163    2   5   1         4
                66.44         11.77        1.4072   -4   0   4         2
                66.45          1.80        1.4069    2   4   2         4
                66.89          7.59        1.3988   -4   3   3         4
                70.21          8.81        1.3406   -2   5   3         4
                71.35          1.55        1.3219   -1   6   2         4
                72.60          6.34        1.3023    0   6   2         4
                72.77          2.29        1.2996   -2   4   4         4
                74.74          8.45        1.2701    4   3   1         4
                78.13          4.36        1.2232    4   0   2         2
                79.18          1.62        1.2097   -3   6   2         4
                82.25          1.13        1.1722   -3   3   5         4
                84.91          1.84        1.1421    2   2   4         4
                86.76          3.15        1.1224   -4   3   5         4
                87.64          1.63        1.1134    2   5   3         4
                88.00          1.47        1.1098   -4  -6   2         4
                88.32          2.46        1.1065    2   7   1         4
                88.67          4.84        1.1032    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.