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#$Date: 2025-01-14 10:49:31 +0200 (Tue, 14 Jan 2025) $
#$Revision: 297313 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/33/14/4331415.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_4331415
loop_
_publ_author_name
'Hagenbach, A.'
'Drews, T.'
'Seppelt, K.'
'Supel, J.'
_publ_section_title
;
 Solid state molecular structures of transition metal hexafluorides
;
_journal_coden_ASTM              INOCAJ
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3782
_journal_page_last               3788
_journal_paper_doi               10.1021/ic052029f
_journal_volume                  45
_journal_year                    2006
_chemical_formula_sum            'Au F6 O2'
_chemical_name_systematic        'Dioxygenyl hexafluoroaurate'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                101.33
_cell_angle_beta                 90.691
_cell_angle_gamma                102.072
_cell_formula_units_Z            1
_cell_length_a                   4.966
_cell_length_b                   4.991
_cell_length_c                   5.035
_cell_volume                     119.472
_cod_data_source_file            gold_203.cif
_cod_data_source_block           Au1F6O2
_cod_original_cell_volume        119.4721
_cod_original_formula_sum        'Au1 F6 O2'
_cod_database_code               4331415
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,-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
F2 F-1 0.0836 -0.2329 -0.3206 1 0.0
F1 F-1 0.3057 -0.0469 0.2026 1 0.0
Au1 Au+5 0 0 0 1 0.0
O1 O 0.5392 0.4276 0.5536 1 0.0
F3 F-1 0.2282 0.3219 -0.0899 1 0.0
loop_
_cod_changelog_entry_id
_cod_changelog_entry_author
_cod_changelog_entry_date
_cod_changelog_entry_text
1 'Vaitkus, Antanas' 2025-01-14T10:46:05+02:00
;
 Updated bibliographic information. Updated the '_chemical_name_systematic'
 data item value.
;
