#------------------------------------------------------------------------------
#$Date: 2025-08-18 17:02:58 +0200 (Mon, 18 Aug 2025) $
#$Revision: 301777 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/52/47/1524714.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_1524714
loop_
_publ_author_name
'Kocak, M.'
'Platte, C.'
'Troemel, M.'
_publ_section_title
;
 Ueber verschiedene Formen von Ba Te O3
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              93
_journal_page_last               97
_journal_volume                  453
_journal_year                    1979
_chemical_formula_sum            'Ba O3 Te'
_chemical_name_systematic        'Ba Te O3'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.4
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.633
_cell_length_b                   5.943
_cell_length_c                   7.104
_cell_volume                     187.643
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kocak_ZAACAB_1979_560.cif
_cod_data_source_block           Ba1O3Te1
_cod_original_cell_volume        187.6427
_cod_original_formula_sum        'Ba1 O3 Te1'
_cod_database_code               1524714
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
-x,-y,-z
x,-y-1/2,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
O2 O-2 0.179 0.012 0.326 1 0.0
O1 O-2 0.657 0.25 0.108 1 0.0
Ba1 Ba+2 0.3382 0.25 0.6888 1 0.0
Te1 Te+4 0.0704 0.25 0.1488 1 0.0
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 139045891
