#------------------------------------------------------------------------------
#$Date: 2025-08-18 17:14:33 +0200 (Mon, 18 Aug 2025) $
#$Revision: 301778 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/68/1536861.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_1536861
loop_
_publ_author_name
'Kopelev, N.S.'
'Val'kovskii, M.D.'
'Popov, A.I.'
'Chumaevskii, N.A.'
_publ_section_title
;
 Synthesis and properties of sodium manganates.
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              2210
_journal_page_last               2215
_journal_volume                  36
_journal_year                    1991
_chemical_formula_sum            'Cs2 Mn O4'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.432
_cell_length_b                   6.29
_cell_length_c                   11.083
_cell_volume                     587.812
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Kopelev_ZNOKAQ_1991_1202.cif
_cod_data_source_block           Cs2Mn1O4
_cod_original_cell_volume        587.8122
_cod_original_formula_sum        'Cs2 Mn1 O4'
_cod_database_code               1536861
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,y+1/2,-z
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z-1/2
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 0.15 0.25 0.116 1 0.0
O3 O-2 0.307 0.0346 0.347 1 0.0
O2 O-2 0.296 0.25 0.559 1 0.0
Cs2 Cs+1 0.978 0.25 0.708 1 0.0
Mn1 Mn+6 0.237 0.25 0.416 1 0.0
O1 O-2 0.041 0.25 0.41 1 0.0
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 139047272
