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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/2/10/64/2106494.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_2106494
loop_
_publ_author_name
'Cousson, A.'
'Pages, M.'
'Chevalier, R.'
_publ_section_title
;
 The crystal structure of Li3 Th F7
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1776
_journal_page_last               1778
_journal_volume                  34
_journal_year                    1978
_chemical_formula_sum            'F7 Li3 Th'
_chemical_name_systematic        'Li3 Th F7'
_space_group_IT_number           130
_symmetry_space_group_name_Hall  '-P 4a 2ac'
_symmetry_space_group_name_H-M   'P 4/n c c :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.206
_cell_length_b                   6.206
_cell_length_c                   12.94
_cell_volume                     498.377
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Cousson_ACBCAR_1978_1101.cif
_cod_data_source_block           F7Li3Th1
_cod_original_cell_volume        498.3768
_cod_original_formula_sum        'F7 Li3 Th1'
_cod_database_code               2106494
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/2,x,z
-x+1/2,-y+1/2,z
y,-x+1/2,z
x+1/2,-y,-z+1/2
y+1/2,x+1/2,-z+1/2
-x,y+1/2,-z+1/2
-y,-x,-z+1/2
-x,-y,-z
y-1/2,-x,-z
x-1/2,y-1/2,-z
-y,x-1/2,-z
-x-1/2,y,z-1/2
-y-1/2,-x-1/2,z-1/2
x,-y-1/2,z-1/2
y,x,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
Li2 Li+1 0.634 -0.634 0.75 1 0.0
F1 F-1 0.25 0.25 0.3732 1 0.0
Li1 Li+1 0.25 0.75 0 1 0.0
F3 F-1 0.0623 -0.0623 0.75 1 0.0
F2 F-1 0.161 -0.0366 0.0775 1 0.0
Th1 Th+4 0.25 0.25 0.189 1 0.0
