#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/15/1521514.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_1521514
loop_
_publ_author_name
'Licci, F.'
'Marezio, M.'
'Bougerol-Chaillout, C.'
'Santoro, A.'
'Huang, Q.'
'Masini, R.'
_publ_section_title
;
 Synthesis, structure and superconductivity of Hg0.75 Mo0.25 Ba2 Cu O4+d
;
_journal_name_full               'Physica C (Amsterdam)'
_journal_page_first              41
_journal_page_last               48
_journal_volume                  325
_journal_year                    1999
_chemical_formula_sum            'Ba2 Cu Hg0.752 Mo0.252 O4.584'
_chemical_name_systematic        'Hg0.752 Mo0.252 Ba2 Cu O4.584'
_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                   3.883
_cell_length_b                   3.883
_cell_length_c                   9.3547
_cell_volume                     141.047
_citation_journal_id_ASTM        PHYCE6
_cod_data_source_file            Licci_PHYCE6_1999_656.cif
_cod_data_source_block           Ba2Cu1Hg0.752Mo0.252O4.584
_cod_original_cell_volume        141.0473
_cod_original_formula_sum        'Ba2 Cu1 Hg0.752 Mo0.252 O4.584'
_cod_database_code               1521514
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 0.372 0.372 0 0.146 0.0
O2 O-2 0 0 0.2088 1 0.0
Ba1 Ba+2 0.5 0.5 0.2923 1 0.0
O1 O-2 0 0.5 0.5 1 0.0
Mo1 Mo+6 0.136 0 0 0.063 0.0
Cu1 Cu+2 0 0 0.5 1 0.0
Hg1 Hg+2 0 0 0 0.752 0.0
