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#$Date: 2015-10-21 20:22:02 +0300 (Wed, 21 Oct 2015) $
#$Revision: 169519 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/54/02/1540272.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_1540272
loop_
_publ_author_name
'Klamut, J.'
'Janczak, J.'
'Henkie, Z.'
'Glovyak, T.'
'Zygmunt, A.'
'Horyn, R.'
'Kubiak, R.'
'Bukowski, Z.'
'Wojakowski, A.'
'Lukaszewicz, K.'
'Stepen'-Damm, Yu.'
_publ_section_title
;
 Thermal vibrations in Y Ba2 Cu3 O6+x and Pr Ba2 Cu3 O6+x
;
_journal_name_full               'Acta Physica Polonica, A'
_journal_page_first              759
_journal_page_last               765
_journal_volume                  73
_journal_year                    1988
_chemical_formula_sum            'Ba2 Cu3 O6 Y'
_chemical_name_systematic        'Y Ba2 Cu3 O6'
_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                   3.87
_cell_length_b                   3.87
_cell_length_c                   11.801
_cell_volume                     176.742
_citation_journal_id_ASTM        ATPLB6
_cod_data_source_file            Klamut_ATPLB6_1988_46.cif
_cod_data_source_block           Ba2Cu3O6Y1
_cod_original_cell_volume        176.7424
_cod_chemical_formula_sum_orig   'Ba2 Cu3 O6 Y1'
_cod_database_code               1540272
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
O3 O-2 0.5 0 0.5 1 0.0
O1 O-2 0.5 0.5 0.34518 1 0.0
Cu2 Cu+2 0.5 0.5 0.14167 1 0.0
Cu1 Cu+1 0.5 0.5 0.5 1 0.0
Y1 Y+3 0 0 0 1 0.0
O2 O-2 0.5 0 0.12041 0.5 0.0
Ba1 Ba+2 0 0 0.30981 1 0.0