#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/68/1536813.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_1536813
loop_
_publ_author_name
'Koehler, J.'
'Mueller, B.G.'
_publ_section_title
;
 Li Sm Al F6 - das erste Fluoroaluminat mit zweiwertigem Samarium
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              169
_journal_page_last               176
_journal_volume                  606
_journal_year                    1991
_chemical_formula_sum            'Al F6 Li Sm'
_chemical_name_systematic        'Li Sm (Al F6)'
_space_group_IT_number           182
_symmetry_space_group_name_Hall  'P 6c 2c'
_symmetry_space_group_name_H-M   'P 63 2 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   5.079
_cell_length_b                   5.079
_cell_length_c                   10.405
_cell_volume                     232.450
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Koehler_ZAACAB_1991_27.cif
_cod_data_source_block           Al1F6Li1Sm1
_cod_original_cell_volume        232.4498
_cod_original_formula_sum        'Al1 F6 Li1 Sm1'
_cod_database_code               1536813
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
-y,-x,-z+1/2
x-y,-y,-z
x,x-y,-z+1/2
y,x,-z
-x+y,y,-z+1/2
-x,-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
F1 F-1 0.3882 0.0314 0.1502 1 0.0
Li1 Li+1 0.3333 0.6667 0.25 1 0.0
Al1 Al+3 0.6667 0.3333 0.25 1 0.0
Sm1 Sm+2 0 0 0 1 0.0
