#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/67/1536717.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_1536717
loop_
_publ_author_name
'Emmerling, F.'
'Hirschle, C.'
'Roehr, C.'
_publ_section_title
;
 Cs5 Sb8 und beta-Cs Sb: zwei neue binaere Zintl-Phasen
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              559
_journal_page_last               563
_journal_volume                  628
_journal_year                    2002
_chemical_formula_sum            'Cs5 Sb8'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 96.663
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.244
_cell_length_b                   11.352
_cell_length_c                   27.509
_cell_volume                     2246.893
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Emmerling_ZAACAB_2002_419.cif
_cod_data_source_block           Cs5Sb8
_cod_database_code               1536717
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-z
x,-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
Sb4 Sb 0.2414 0.2525 0.02389 1 0.0
Sb8 Sb 0.1953 0.1286 0.25617 1 0.0
Cs3 Cs+1 0.5206 0.428 0.42661 1 0.0
Sb5 Sb 0.0146 0.5247 0.37452 1 0.0
Cs1 Cs+1 0.0267 0.1859 0.37825 1 0.0
Sb6 Sb 0.5306 0.0391 0.39101 1 0.0
Sb2 Sb 0.1908 0.36124 0.11326 1 0.0
Cs2 Cs+1 0.2859 0.46403 0.25741 1 0.0
Cs4 Cs+1 0.7415 0.3976 0.0213 1 0.0
Sb7 Sb 0.5169 0.20196 0.3162 1 0.0
Cs5 Cs+1 0.7633 0.3067 0.1907 1 0.0
Sb1 Sb 0.061 0.59743 0.47279 1 0.0
Sb3 Sb 0.3057 0.14218 0.16274 1 0.0
