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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/00/1530092.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_1530092
loop_
_publ_author_name
'Hiltunen, L.'
'Holsa, J.'
'Micka, Z.'
_publ_section_title
;
 Crystal structure, thermal behaviour, and infrared absorption spectrum of
 cesium hydrogen selenite selenious acid (1/2) Cs H Se O3 (H2 Se O3)2
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              307
_journal_page_last               313
_journal_volume                  68
_journal_year                    1987
_chemical_formula_sum            'Cs H5 O9 Se3'
_chemical_name_systematic        'Cs H Se O3 (H2 Se O3)2'
_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                 95.141
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.9897
_cell_length_b                   8.5078
_cell_length_c                   12.6476
_cell_volume                     963.430
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Hiltunen_JSSCBI_1987_1410.cif
_cod_data_source_block           H5Cs1O9Se3
_cod_original_cell_volume        963.4297
_cod_original_formula_sum        'H5 Cs1 O9 Se3'
_cod_database_code               1530092
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
Cs1 Cs+1 0.7424 0.2573 0.9952 1 0.0
O8 O-2 -0.1539 0.1107 0.2773 1 0.0
O7 O-2 0.0097 -0.1264 0.3207 1 0.0
O3 O-2 0.1073 0.1454 0.4957 1 0.0
O9 O-2 0.0111 -0.0015 0.1304 1 0.0
O4 O-2 0.5229 0.6299 0.1825 1 0.0
O6 O-2 0.4963 0.4985 0.3642 1 0.0
Se3 Se+4 0.0294 0.0443 0.2641 1 0.0
O5 O-2 0.689 0.3873 0.2384 1 0.0
Se1 Se+4 0.2657 0.2646 0.5354 1 0.0
Se2 Se+4 0.5143 0.4388 0.2341 1 0.0
O2 O-2 0.2473 0.3911 0.4346 1 0.0
O1 O-2 0.4015 0.1455 0.5063 1 0.0
