#------------------------------------------------------------------------------
#$Date: 2015-07-12 20:57:51 +0200 (dom 12 de jul de 2015) $
#$Revision: 148288 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/70/1527000.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_1527000
loop_
_publ_author_name
'Yamawaki, K.'
'Sasaki, S.'
'Lee, S.'
'Akao, T.'
'Yamauchi, H.'
_publ_section_title
;
 Single-crystal X-ray study of (Hg, Pb)-1223 superconductor at low
 temperature
;
_journal_name_full               'Physica C (Amsterdam)'
_journal_page_first              67
_journal_page_last               71
_journal_volume                  338
_journal_year                    2000
_chemical_formula_sum
'Ba0.52 Ca1.82 Cu3.1 Hg0.45 O8.31 Pb0.45 Sr1.66'
_chemical_name_systematic
;
(Hg0.45 Pb0.45 Cu0.1) (Sr0.74 Ba0.26)2 (Ca0.91 Sr0.09)2 Cu3 O8.31
;
_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                   3.825
_cell_length_b                   3.825
_cell_length_c                   15.4
_cell_volume                     225.312
_citation_journal_id_ASTM        PHYCE6
_cod_data_source_file            Yamawaki_PHYCE6_2000_433.cif
_cod_data_source_block           Ba0.52Ca1.82Cu3.1Hg0.45O8.31Pb0.45Sr1.66
_cod_original_cell_volume        225.3116
_cod_database_code               1527000
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
Ca1 Ca+2 0.5 0.5 0.3934 0.91 0.0
O4 O-2 0.5 0.5 0 0.31 0.0
Cu2 Cu+2 0 0 0.5 1 0.0
Sr2 Sr+2 0.5 0.5 0.3934 0.09 0.0
O1 O-2 0 0.5 0.5 1 0.0
Ba1 Ba+2 0.5 0.5 0.1706 0.26 0.0
O2 O-2 0.5 0 0.295 1 0.0
Hg1 Hg+2 0 0 0 0.45 0.0
Sr1 Sr+2 0.5 0.5 0.1706 0.74 0.0
Cu3 Cu+2 0 0 0.2882 1 0.0
O3 O-2 0 0 0.131 1 0.0
Pb1 Pb+2 0 0 0 0.45 0.0
Cu1 Cu+2 0 0 0 0.1 0.0
