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#$Date: 2015-09-19 00:05:09 +0200 (Sat 19 de Sep de 2015) $
#$Revision: 158167 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/24/1532451.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_1532451
loop_
_publ_author_name
'zur Loye, H.C.'
'Smith, M.D.'
'Stitzer, K.E.'
_publ_section_title
;
 Structure determination of Ba8 Co Rh6 O21, a new member of the
 2H-perovskite related oxides
;
_journal_name_full
'Materials Research Society Symposia Proceedings'
_journal_page_first              GG1.4.1
_journal_page_last               GG1.4.7
_journal_volume                  658
_journal_year                    2001
_chemical_formula_sum            Ba1.14
_chemical_name_systematic        '(Ba8 Co Rh6 O21)0.1429'
_space_group_IT_number           165
_symmetry_space_group_name_Hall  '-P 3 2"c'
_symmetry_space_group_name_H-M   'P -3 c 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   10.0431
_cell_length_b                   10.0431
_cell_length_c                   4.5405
_cell_volume                     396.616
_citation_journal_id_ASTM        MRSPDH
_cod_data_source_file            zurLoye_MRSPDH_2001_1199.cif
_cod_data_source_block           Ba1.14
_cod_original_cell_volume        396.6157
_cod_database_code               1532451
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z+1/2
-x,-x+y,-z+1/2
x-y,-y,-z+1/2
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z-1/2
x,x-y,z-1/2
-x+y,y,z-1/2
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 0.32593 0 0.25 0.57 0.0
Ba2 Ba+2 0.34939 0 0.25 0.57 0.0
