Titanite
      Angel R J, Kunz M, Miletich R, Woodland A B, Koch M, Knoche R L
      American Mineralogist 84 (1999) 282-287
      Effect of isovalent Si,Ti substitution on the bulk moduli of Ca(Ti1-xSix)SiO5
      titanites
      P = 5.8 GPa
      _database_code_amcsd 0002105

      CELL PARAMETERS:    6.4699   8.3294   6.2444   90.000  112.688   90.000
      SPACE GROUP: A2/a      
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    310.473
      Density (g/cm3):      3.770
      MAX. ABS. INTENSITY / VOLUME**2:      11.87900877    
      RIR:      1.026
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                18.73          9.52        4.7382    0   1   1         4
                29.89        100.00        2.9889   -2   1   1         4
                29.94         11.04        2.9846    2   0   0         2
                31.05         85.48        2.8806    0   0   2         2
                33.90         20.64        2.6440   -2   0   2         2
                35.90         70.08        2.5012    0   3   1         4
                36.08          1.52        2.4894   -1   2   2         4
                37.06         40.33        2.4260    2   2   0         4
                37.98          5.77        2.3691    0   2   2         4
                40.41          1.59        2.2322   -2   2   2         4
                40.51          1.26        2.2268    2   1   1         4
                41.41         26.01        2.1804    1   3   1         4
                43.12         21.93        2.0977   -2   3   1         4
                43.38         14.03        2.0859   -3   1   1         4
                44.99         15.32        2.0148   -1   1   3         4
                45.45          9.33        1.9956    1   2   2         4
                46.17         15.30        1.9661    1   4   0         4
                46.60         13.94        1.9491   -2   1   3         4
                48.66          4.45        1.8713    0   1   3         4
                49.61          2.73        1.8375   -3   2   2         4
                51.45          6.10        1.7762    2   3   1         4
                51.93          9.24        1.7609    2   0   2         2
                53.67          6.42        1.7078    2   4   0         4
                54.36          1.02        1.6876    0   4   2         4
                55.24          2.47        1.6629   -1   3   3         4
                55.47          2.22        1.6565    3   1   1         4
                56.23          9.11        1.6359   -2   4   2         4
                56.63          9.63        1.6253   -2   3   3         4
                56.76         17.39        1.6219    2   2   2         4
                57.57         14.92        1.6011   -4   0   2         2
                58.05          1.96        1.5889   -1   5   1         4
                58.43         30.11        1.5794    0   3   3         4
                58.67          2.35        1.5736   -4   1   1         4
                62.21          4.98        1.4923    4   0   0         2
                62.89         15.24        1.4779   -2   5   1         4
                64.00          8.06        1.4548   -2   2   4         4
                64.72          7.04        1.4403    0   0   4         2
                64.81          1.54        1.4386    3   4   0         4
                65.79          1.27        1.4196    1   3   3         4
                67.47          3.15        1.3882    0   6   0         2
                67.49         18.89        1.3879   -4   3   1         4
                68.46          4.79        1.3705    2   1   3         4
                69.57          9.43        1.3514    2   5   1         4
                69.97          1.88        1.3446    2   4   2         4
                71.34         13.34        1.3220   -4   0   4         2
                71.96          7.31        1.3122   -4   3   3         4
                73.98         10.84        1.2812   -2   5   3         4
                74.93          1.71        1.2673   -1   6   2         4
                75.56          1.61        1.2584    0   5   3         4
                76.11          9.16        1.2506    0   6   2         4
                76.54          1.86        1.2447   -2   4   4         4
                77.25          1.01        1.2351   -2   1   5         4
                80.24         10.38        1.1964    4   3   1         4
                83.70          4.58        1.1555    4   0   2         2
                83.72          1.10        1.1552   -5   3   1         4
                83.75          1.34        1.1549   -4   5   1         4
                84.28          1.71        1.1490   -3   6   2         4
                85.40          2.11        1.1368    2   0   4         2
                87.12          1.75        1.1187   -3   3   5         4
                89.33          2.53        1.0967    2   2   4         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.