Ba2 Cu2.98 O6.96 Y
      Roth G, Heger G, Renker B, Pannetier J, Caignaert V, Hervieu M, Raveau B
      Physica C 153 (1988) 972-973
      Crystallographic study of the tetragonal high-Tc superconductor
      YBa2(Cu.95Fe.05)3O7
      _cod_database_code 1001378
      _database_code_amcsd 0015011

      CELL PARAMETERS:    3.8580   3.8580  11.5850   90.000   90.000   90.000
      SPACE GROUP: P4/mmm    
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    172.433
      Density (g/cm3):      6.395
      MAX. ABS. INTENSITY / VOLUME**2:      165.4183980    
      RIR:      8.423
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                 7.63          1.40       11.5850    0   0   1         2
                15.30          1.46        5.7925    0   0   2         2
                23.03          3.02        3.8617    0   0   3         2
                23.05          5.84        3.8580    1   0   0         4
                27.78          8.10        3.2110    1   0   2         8
                32.81        100.00        2.7293    1   0   3         8
                32.83         52.07        2.7280    1   1   0         4
                36.40          2.13        2.4680    1   1   2         8
                38.87          6.17        2.3170    0   0   5         2
                38.88          5.84        2.3162    1   0   4         8
                40.49         10.98        2.2281    1   1   3         8
                47.06          7.79        1.9308    0   0   6         2
                47.11         29.48        1.9290    2   0   0         4
                51.77          3.48        1.7660    1   1   5         8
                53.07          1.01        1.7257    2   0   3         8
                55.53          1.05        1.6550    0   0   7         2
                55.58          1.99        1.6536    2   1   2        16
                58.57         13.46        1.5760    1   1   6         8
                58.60         31.58        1.5753    2   1   3        16
                62.67          4.55        1.4825    2   0   5         8
                62.68          2.21        1.4823    2   1   4        16
                66.03          1.58        1.4150    1   1   7         8
                68.79          7.96        1.3647    2   0   6         8
                68.83          7.36        1.3640    2   2   0         4
                69.31          3.56        1.3558    1   0   8         8
                75.72          1.38        1.2561    2   0   7         8
                78.30          1.98        1.2211    1   0   9         8
                78.37          5.67        1.2201    3   0   3         8
                78.38          6.03        1.2200    3   1   0         8
                81.97          1.71        1.1754    2   2   5         8
                83.01          1.44        1.1633    3   1   3        16
                87.58          3.53        1.1141    2   2   6         8
                88.02          1.62        1.1096    1   0  10         8
                88.06          3.25        1.1092    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.