#------------------------------------------------------------------------------
#$Date: 2015-09-17 04:15:09 +0300 (Thu, 17 Sep 2015) $
#$Revision: 156604 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/12/1531234.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_1531234
loop_
_publ_author_name
'Burley, J.C.'
'Weill, F.'
'Battle, P.D.'
'Jordan, N.A.'
'Sloan, J.'
_publ_section_title
;
 Synthesis and structural characterization of Ba14 Pd3 Ir8 O33
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              96
_journal_page_last               103
_journal_volume                  174
_journal_year                    2003
_chemical_formula_sum            'Ir0.73 O3 Pd0.27'
_chemical_name_systematic        '(Pd0.27 Ir0.73) O3'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   10.1409
_cell_length_b                   10.1409
_cell_length_c                   2.748
_cell_volume                     244.737
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Burley_JSSCBI_2003_1643.cif
_cod_data_source_block           Ir0.73O3Pd0.27
_cod_original_cell_volume        244.7374
_cod_database_code               1531234
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,y,z
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
y+2/3,x+1/3,-z+1/3
-x+2/3,-x+y+1/3,-z+1/3
x-y+2/3,-y+1/3,-z+1/3
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
-y+2/3,-x+1/3,z+1/3
x+2/3,x-y+1/3,z+1/3
-x+y+2/3,y+1/3,z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
y+1/3,x+2/3,-z+2/3
-x+1/3,-x+y+2/3,-z+2/3
x-y+1/3,-y+2/3,-z+2/3
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
-y+1/3,-x+2/3,z+2/3
x+1/3,x-y+2/3,z+2/3
-x+y+1/3,y+2/3,z+2/3
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
Pd1 Pd 0 0 0 0.273 0.0
Ir1 Ir 0 0 0 0.727 0.0
O1 O 0.167 0.167 0.5 0.5 0.0
