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 #042 at P = 2.25 GPa, T = 440 K
      _database_code_amcsd 0002565

      CELL PARAMETERS:    6.9982   8.6853   6.5079   90.000  113.523   90.000
      SPACE GROUP: P2_1/a    
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    362.689
      Density (g/cm3):      3.589
      MAX. ABS. INTENSITY / VOLUME**2:      14.55074427    
      RIR:      1.320
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                17.18          2.17        5.1609    1   1   0         4
                18.04         24.66        4.9182    0   1   1         4
                20.45          1.91        4.3426    0   2   0         2
                25.75          1.00        3.4598   -2   0   1         2
                26.21          1.70        3.4006    1   1   1         4
                27.76        100.00        3.2142   -2   1   1         4
                27.81          3.35        3.2083    2   0   0         2
                29.95         80.90        2.9835    0   0   2         2
                31.78          8.50        2.8161   -2   0   2         2
                33.10          2.28        2.7060   -2   2   1         4
                33.45          3.24        2.6788   -2   1   2         4
                34.43         78.74        2.6047    0   3   1         4
                34.50          1.39        2.5997   -1   2   2         4
                34.77         48.78        2.5805    2   2   0         4
                38.09          2.84        2.3628   -2   2   2         4
                38.20          5.32        2.3558    2   1   1         4
                39.54         19.34        2.2790    1   3   1         4
                40.06         12.26        2.2508   -3   1   1         4
                40.63          7.13        2.2203   -2   3   1         4
                41.59          3.16        2.1713    0   4   0         2
                43.17          9.98        2.0953   -1   1   3         4
                43.53          5.97        2.0791    1   2   2         4
                44.03         10.37        2.0568    1   4   0         4
                44.10          1.83        2.0534   -3   2   1         4
                44.19         16.48        2.0494   -2   1   3         4
                46.86          6.97        1.9388    0   1   3         4
                47.38          1.08        1.9188    3   2   0         4
                47.95          2.72        1.8971   -2   2   3         4
                48.72          1.42        1.8691    2   3   1         4
                49.32          2.85        1.8478    2   0   2         2
                49.56          1.39        1.8391   -2   4   1         4
                50.77          8.00        1.7982    2   4   0         4
                51.92          1.13        1.7610    3   1   1         4
                52.09          2.35        1.7556    0   4   2         4
                52.85          2.15        1.7322   -4   0   1         2
                52.93          9.28        1.7299   -4   0   2         2
                53.27         11.53        1.7195   -2   4   2         4
                53.78          3.49        1.7046   -2   3   3         4
                53.93         20.80        1.7003    2   2   2         4
                53.98          2.68        1.6987   -4   1   1         4
                54.05          1.36        1.6966   -4   1   2         4
                55.35          1.58        1.6599   -1   5   1         4
                56.10         26.76        1.6394    0   3   3         4
                57.26          1.46        1.6089   -4   2   1         4
                57.45          3.35        1.6042    4   0   0         2
                57.65          2.57        1.5988   -4   0   3         2
                57.80          3.34        1.5952   -2   1   4         4
                58.51          1.19        1.5775    4   1   0         4
                59.55         11.93        1.5524   -2   5   1         4
                60.95          5.41        1.5201   -2   2   4         4
                62.23          4.50        1.4918    0   0   4         2
                62.48         14.80        1.4864   -4   3   1         4
                62.55          3.28        1.4850   -4   3   2         4
                62.86          1.64        1.4784   -2   5   2         4
                62.97          1.20        1.4762    1   3   3         4
                64.36          2.64        1.4475    0   6   0         2
                65.19          5.26        1.4311    2   1   3         4
                65.94          7.88        1.4166    2   5   1         4
                66.39          8.80        1.4080   -4   0   4         2
                66.44          1.97        1.4072    2   4   2         4
                66.65          1.72        1.4032    4   3   0         4
                66.85          5.44        1.3996   -4   3   3         4
                67.37          1.19        1.3899   -4   1   4         4
                70.19          7.11        1.3408   -2   5   3         4
                71.34          1.53        1.3220   -1   6   2         4
                72.59          7.54        1.3024    0   6   2         4
                72.75          2.06        1.2999   -2   4   4         4
                74.71          7.37        1.2706    4   3   1         4
                75.01          1.90        1.2662   -4   3   4         4
                76.42          1.04        1.2463   -2   2   5         4
                78.09          3.72        1.2238    4   0   2         2
                78.51          1.48        1.2183   -4   0   5         2
                79.16          1.06        1.2099   -3   6   2         4
                84.89          2.19        1.1423    2   2   4         4
                86.71          1.95        1.1229   -4   3   5         4
                87.62          1.50        1.1136    2   5   3         4
                87.96          1.42        1.1102   -4  -6   2         4
                88.31          2.85        1.1067    2   7   1         4
                88.65          4.71        1.1034    0   3   5         4
================================================================================
       XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
  For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.