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 #036 at P = 3.79 GPa, T = 662 K
      _database_code_amcsd 0002559

      CELL PARAMETERS:    6.9664   8.6728   6.4846   90.000  113.400   90.000
      SPACE GROUP: A2/a      
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    359.565
      Density (g/cm3):      3.621
      MAX. ABS. INTENSITY / VOLUME**2:      14.70479871    
      RIR:      1.322
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                18.08         23.74        4.9071    0   1   1         4
                20.48          1.39        4.3364    0   2   0         2
                26.27          1.99        3.3929    1   1   1         4
                27.88        100.00        3.2004   -2   1   1         4
                27.91          2.14        3.1967    2   0   0         2
                30.03         86.79        2.9756    0   0   2         2
                31.93          7.53        2.8028   -2   0   2         2
                34.49         72.35        2.6004    0   3   1         4
                34.60          1.89        2.5921   -1   2   2         4
                34.87         50.77        2.5731    2   2   0         4
                38.23          4.34        2.3539   -2   2   2         4
                38.31          4.60        2.3496    2   1   1         4
                39.62         21.89        2.2749    1   3   1         4
                40.24         11.95        2.2412   -3   1   1         4
                40.75          6.22        2.2141   -2   3   1         4
                41.66          4.83        2.1682    0   4   0         2
                43.32          9.15        2.0886   -1   1   3         4
                43.63          6.44        2.0747    1   2   2         4
                44.10         10.40        2.0533    1   4   0         4
                44.38         23.08        2.0412   -2   1   3         4
                46.99          8.59        1.9338    0   1   3         4
                48.83          1.54        1.8650    2   3   1         4
                49.44          2.96        1.8433    2   0   2         2
                50.89          8.13        1.7944    2   4   0         4
                52.09          1.61        1.7559    3   1   1         4
                52.20          2.87        1.7524    0   4   2         4
                53.20         13.92        1.7217   -4   0   2         2
                53.43         10.91        1.7150   -2   4   2         4
                53.96          2.24        1.6991   -2   3   3         4
                54.06         22.04        1.6964    2   2   2         4
                54.22          4.83        1.6916   -4   1   1         4
                55.45          2.63        1.6570   -1   5   1         4
                56.24         28.25        1.6357    0   3   3         4
                57.67          5.51        1.5984    4   0   0         2
                59.69         15.76        1.5491   -2   5   1         4
                60.79          1.30        1.5238    3   3   1         4
                61.18          8.04        1.5148   -2   2   4         4
                62.42          4.32        1.4878    0   0   4         2
                62.73         18.65        1.4812   -4   3   1         4
                63.11          2.24        1.4731    1   3   3         4
                64.46          2.21        1.4455    0   6   0         2
                65.36          4.22        1.4278    2   1   3         4
                66.08          8.60        1.4139    2   5   1         4
                66.59          1.60        1.4044    2   4   2         4
                66.75         13.39        1.4014   -4   0   4         2
                67.16          7.82        1.3939   -4   3   3         4
                69.75          1.00        1.3483   -4   4   2         4
                70.40          8.62        1.3374   -2   5   3         4
                71.49          2.37        1.3196   -1   6   2         4
                72.73          6.18        1.3002    0   6   2         4
                73.00          2.07        1.2961   -2   4   4         4
                74.95          9.04        1.2671    4   3   1         4
                77.21          1.05        1.2355   -5   3   1         4
                78.35          4.52        1.2204    4   0   2         2
                78.41          1.40        1.2197   -5   3   3         4
                79.40          1.65        1.2069   -3   6   2         4
                81.48          1.09        1.1813    2   0   4         2
                82.57          1.25        1.1684   -3   3   5         4
                85.12          2.10        1.1398    2   2   4         4
                87.15          3.42        1.1184   -4   3   5         4
                87.84          1.80        1.1114    2   5   3         4
                88.27          1.62        1.1070   -4  -6   2         4
                88.50          2.37        1.1048    2   7   1         4
                88.92          5.21        1.1006    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.