Ca0.48 Cu2 O6.96 Pr0.52 Sr2 Tl0.94
      Sundaresan A, Michel C, Raveau B, Huong P
      Chemistry of Materials 9 (1997) 2212-2217
      Charge-transfer-induced insulator-superconductor transition in
      TlBa2-xSrxCa0.4Pr0.6Cu2O7-d: a joint neutron/X ray Rietveld refinement,
      infrared absorption, and Raman scattering studies
      _cod_database_code 1001792
      _database_code_amcsd 0012215

      CELL PARAMETERS:    3.8262   3.8262  12.1262   90.000   90.000   90.000
      SPACE GROUP: P4/mmm    
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    177.525
      Density (g/cm3):      6.531
      MAX. ABS. INTENSITY / VOLUME**2:      146.8142979    
      RIR:      7.320
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                 7.29          3.14       12.1262    0   0   1         2
                14.61          6.06        6.0631    0   0   2         2
                21.99          5.86        4.0421    0   0   3         2
                23.25          2.67        3.8262    1   0   0         4
                24.39         19.07        3.6489    1   0   1         8
                27.57         21.49        3.2358    1   0   2         8
                29.46          4.73        3.0315    0   0   4         2
                32.21        100.00        2.7787    1   0   3         8
                33.11         65.53        2.7055    1   1   0         4
                33.95          4.70        2.6406    1   1   1         8
                36.36          2.12        2.4707    1   1   2         8
                37.07         10.56        2.4252    0   0   5         2
                37.86          7.30        2.3761    1   0   4         8
                44.22          4.00        2.0484    1   0   5         8
                44.85          7.34        2.0210    0   0   6         2
                44.90         14.08        2.0186    1   1   4         8
                47.53         30.56        1.9131    2   0   0         4
                50.54          8.88        1.8059    1   1   5         8
                51.11          4.76        1.7871    1   0   6         8
                52.85          1.26        1.7323    0   0   7         2
                52.95          1.03        1.7292    2   0   3         8
                54.13          2.32        1.6943    2   1   1        16
                55.83          3.98        1.6468    2   1   2        16
                56.87         10.24        1.6192    1   1   6         8
                56.91          1.81        1.6179    2   0   4         8
                58.49          6.33        1.5781    1   0   7         8
                58.58         27.27        1.5758    2   1   3        16
                61.14          1.88        1.5158    0   0   8         2
                61.76          5.92        1.5020    2   0   5         8
                62.31          3.41        1.4901    2   1   4        16
                63.80          1.13        1.4589    1   1   7         8
                66.33          2.51        1.4092    1   0   8         8
                66.92          1.28        1.3982    2   1   5        16
                67.40          5.64        1.3894    2   0   6         8
                69.48          6.73        1.3528    2   2   0         4
                71.32          1.93        1.3224    1   1   8         8
                72.36          2.06        1.3059    2   1   6        16
                73.79          1.95        1.2841    2   0   7         8
                78.58          3.58        1.2174    2   1   7        16
                78.67          4.34        1.2163    3   0   3         8
                79.16          5.66        1.2100    3   1   0         8
                79.46          1.58        1.2061    1   1   9         8
                80.92          2.19        1.1881    2   0   8         8
                81.47          1.67        1.1814    2   2   5         8
                85.60          1.67        1.1346    2   1   8        16
                86.59          1.90        1.1242    2   2   6         8
                86.63          1.49        1.1238    3   1   4        16
                88.32          1.60        1.1066    1   1  10         8
================================================================================
       XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
  For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.