#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/64/2106427.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2106427
loop_
_publ_author_name
'Ryan, R.R.'
'Penneman, R.A.'
_publ_section_title
;
 The Crystal Structure of Potassium Enneafluorothorate
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              829
_journal_page_last               833
_journal_volume                  27
_journal_year                    1971
_chemical_formula_sum            'F9 K5 Th'
_chemical_name_systematic        'K5 Th F9'
_space_group_IT_number           36
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.848
_cell_length_b                   12.84
_cell_length_c                   10.785
_cell_volume                     1086.786
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Ryan_ACBCAR_1971_930.cif
_cod_data_source_block           F9K5Th1
_cod_original_formula_sum        'F9 K5 Th1'
_cod_database_code               2106427
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
-x,y,z
x,-y,z+1/2
x+1/2,y+1/2,z
-x+1/2,-y+1/2,z+1/2
-x+1/2,y+1/2,z
x+1/2,-y+1/2,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
K3 K+1 0.2468 0.8933 0.4013 1 0.0
F2 F-1 0 0.2033 0.0414 1 0.0
F4 F-1 0 0.2476 0.4476 1 0.0
K1 K+1 0 0.5769 0.2134 1 0.0
F3 F-1 0 0.3475 0.225 1 0.0
F7 F-1 0.2743 0.2194 0.2729 1 0.0
F5 F-1 0 0.5167 0.4619 1 0.0
K2 K+1 0.2588 0.8642 0.0527 1 0.0
Th1 Th+4 0 0.16186 0.25 1 0.0
F1 F-1 0 0.0397 0.4054 1 0.0
F6 F-1 0.1829 0.0327 0.178 1 0.0
