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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/02/1540211.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1540211
loop_
_publ_author_name
'Katano, S.'
'Matsumoto, T.'
'Hatano, T.'
'Matsushita, A.'
'Funahashi, S.'
_publ_section_title
;
 Crystal structure, magnetism, and superconductivity of Y Ba2 (Cu.85
 Fe.15) O7.2
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              2009
_journal_page_last               2016
_journal_volume                  41
_journal_year                    1990
_chemical_formula_sum            'Ba2 Cu2.55 Fe0.45 O7.2 Y'
_chemical_name_systematic        'Y Ba2 (Cu.85 Fe.15)3 O7.2'
_space_group_IT_number           123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.8814
_cell_length_b                   3.8814
_cell_length_c                   11.695
_cell_volume                     176.188
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Katano_PRBMDO_1990_1882.cif
_cod_data_source_block           Ba2Cu2.55Fe0.45O7.2Y1
_cod_original_cell_volume        176.1883
_cod_original_formula_sum        'Ba2 Cu2.55 Fe0.45 O7.2 Y1'
_cod_database_code               1540211
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Ba1 Ba+2 0.5 0.5 0.1851 1 0.0
Cu2 Cu+2 0 0 0.3567 0.93 0.0
Cu1 Cu+2 0 0 0 0.68 0.0
O1 O-2 0.5 0 0 0.59 0.0
Fe1 Fe+3 0 0 0 0.32 0.0
O3 O-2 0.5 0 0.3783 1 0.0
Fe2 Fe+3 0 0 0.3567 0.07 0.0
Y1 Y+3 0.5 0.5 0.5 1 0.0
O2 O-2 0 0 0.1581 1 0.0
