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#$Date: 2015-10-10 06:09:49 +0300 (Sat, 10 Oct 2015) $
#$Revision: 164618 $
#$URL: svn://www.crystallography.net/cod/cif/7/22/27/7222742.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_7222742
loop_
_publ_author_name
'Emmerling, F.'
'Roehr, C.'
_publ_section_title
;
 Die neuen Oxoarsenate(III) A As O2 (A = Na, K, Rb) und Cs3 As5 O9.
 Darstellung, Kristallstrukturen und Raman- Spektren
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              620
_journal_page_last               626
_journal_volume                  58
_journal_year                    2003
_chemical_formula_sum            'As5 Cs3 O9'
_chemical_name_systematic        'Cs3 (As5 O9)'
_space_group_IT_number           157
_symmetry_space_group_name_Hall  'P 3 -2'
_symmetry_space_group_name_H-M   'P 3 1 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   8.455
_cell_length_b                   8.455
_cell_length_c                   6.0262
_cell_volume                     373.080
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Emmerling_ZNBSEN_2003_1048.cif
_cod_data_source_block           As5Cs3O9
_cod_original_cell_volume        373.0795
_cod_database_code               7222742
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,z
-x,-x+y,z
x-y,-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
Cs1 Cs+1 0.3663 0 0 1 0.0
O2 O-2 0.2863 0.4722 0.6221 1 0.0
As2 As+3 0.3333 0.6667 0.4711 1 0.0
O1 O-2 0.6872 0 0.2358 1 0.0
As1 As+3 0.73916 0 0.5033 1 0.0
