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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/8/10/44/8104453.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_8104453
loop_
_publ_author_name
'von Schnering, H.G.'
'Peters, K.'
'Somer, M.'
'Blase, W.'
'Cordier, G.'
_publ_section_title
;
 Crystal structure of cesium triantimonidoaluminate, Cs6 Al Sb3
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              283
_journal_page_last               284
_journal_volume                  193
_journal_year                    1990
_chemical_formula_sum            'Al Cs6 Sb3'
_chemical_name_systematic        'Cs6 (Al Sb3)'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.95
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   10.8446
_cell_length_b                   6.5069
_cell_length_c                   12.7074
_cell_volume                     880.368
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            vonSchnering_ZEKRDZ_1990_1418.cif
_cod_data_source_block           Al1Cs6Sb3
_cod_original_cell_volume        880.3684
_cod_original_formula_sum        'Al1 Cs6 Sb3'
_cod_database_code               8104453
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
-x,-y,-z
x,-y-1/2,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
Cs1 Cs+1 -0.38141 0.25 0.17409 1 0.0
Cs4 Cs+1 0.25488 0.25 0.28314 1 0.0
Al1 Al+3 -0.1756 -0.25 0.22086 1 0.0
Cs3 Cs+1 -0.04237 0.25 0.42298 1 0.0
Sb3 Sb-3 -0.31167 -0.25 0.37526 1 0.0
Cs6 Cs+1 -0.40115 0.25 -0.13432 1 0.0
Cs2 Cs+1 -0.36842 0.25 0.51904 1 0.0
Sb1 Sb-3 0.07013 -0.25 0.26789 1 0.0
Cs5 Cs+1 -0.05255 0.25 0.0518 1 0.0
Sb2 Sb-3 -0.28737 -0.25 0.01883 1 0.0
