Ba2 Cu2.79 Fe0.15 O6.96 Y
      Roth G, Heger G, Renker B, Pannetier J, Caignaert V, Hervieu M, Raveau B
      Zeitschrift fur Physik B71 (1988) 43-52
      Crystallographic study of tetragonal, superconducting
      YBa2(Cu0.93Fe0.05)3O7
      _cod_database_code 1001424
      _database_code_amcsd 0015855

      CELL PARAMETERS:    3.8620   3.8620  11.6730   90.000   90.000   90.000
      SPACE GROUP: P4/mmm    
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    174.103
      Density (g/cm3):      6.312
      MAX. ABS. INTENSITY / VOLUME**2:      168.0763091    
      RIR:      8.670
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                 7.57          1.70       11.6730    0   0   1         2
                15.18          1.72        5.8365    0   0   2         2
                22.86          3.38        3.8910    0   0   3         2
                23.03          6.35        3.8620    1   0   0         4
                27.70          7.59        3.2207    1   0   2         8
                32.67        100.00        2.7410    1   0   3         8
                32.80         51.80        2.7308    1   1   0         4
                36.32          2.28        2.4735    1   1   2         8
                38.56          6.15        2.3346    0   0   5         2
                38.67          6.24        2.3283    1   0   4         8
                40.35         12.07        2.2353    1   1   3         8
                46.69          8.08        1.9455    0   0   6         2
                47.06         29.96        1.9310    2   0   0         4
                51.50          3.52        1.7745    1   1   5         8
                52.68          1.19        1.7375    1   0   6         8
                52.94          1.44        1.7297    2   0   3         8
                53.02          1.45        1.7271    2   1   0         8
                55.07          1.24        1.6676    0   0   7         2
                55.48          1.93        1.6561    2   1   2        16
                58.23         14.59        1.5845    1   1   6         8
                58.46         33.83        1.5786    2   1   3        16
                62.41          4.63        1.4880    2   0   5         8
                62.49          2.56        1.4863    2   1   4        16
                65.60          1.94        1.4232    1   1   7         8
                68.46          8.71        1.3705    2   0   6         8
                68.75          7.94        1.3654    2   2   0         4
                68.78          3.69        1.3650    1   0   8         8
                75.30          1.78        1.2621    2   0   7         8
                77.66          2.36        1.2295    1   0   9         8
                78.21          6.53        1.2222    3   0   3         8
                78.28          6.87        1.2213    3   1   0         8
                81.70          1.79        1.1786    2   2   5         8
                82.84          2.15        1.1652    3   1   3        16
                87.23          4.10        1.1176    2   2   6         8
                87.25          2.13        1.1174    1   0  10         8
                87.52          3.47        1.1146    2   1   8        16
================================================================================
       XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
  For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.