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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/16/1541644.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_1541644
loop_
_publ_author_name
'Rooksby, H.P.'
_publ_section_title
;
 Compounds of the Structural Type of Calcium Titanate
;
_journal_name_full               'Nature (London)'
_journal_page_first              484
_journal_page_last               484
_journal_volume                  155
_journal_year                    1945
_chemical_formula_sum            'Ca O3 Sn'
_chemical_name_systematic        'Ca Sn O3'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   7.89
_cell_length_b                   7.89
_cell_length_c                   7.89
_cell_volume                     491.169
_citation_journal_id_ASTM        NATUAS
_cod_data_source_file            Rooksby_NATUAS_1945_1167.cif
_cod_data_source_block           Ca1O3Sn1
_cod_original_formula_sum        'Ca1 O3 Sn1'
_cod_database_code               1541644
loop_
_symmetry_equiv_pos_as_xyz
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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 0 0 1 0.0
O1 O-2 0.25 0.25 0 1 0.0
Ca2 Ca+2 0.5 0.5 0.5 1 0.0
Sn1 Sn+4 0.25 0.25 0.25 1 0.0
