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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/1/53/67/1536754.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_1536754
loop_
_publ_author_name
'Yakubovich, O.V.'
'Simonov, M.A.'
'Mel'nikov, O.K.'
_publ_section_title
;
 Crystal structure of CsMnPO4
;
_journal_name_full               Kristallografiya
_journal_page_first              42
_journal_page_last               46
_journal_volume                  35
_journal_year                    1990
_chemical_formula_sum            'Cs Mn O4 P'
_chemical_name_systematic        'Cs Mn P O4'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.128
_cell_length_b                   9.575
_cell_length_c                   5.595
_cell_volume                     489.006
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Yakubovich_KRISAJ_1990_955.cif
_cod_data_source_block           Cs1Mn1O4P1
_cod_original_cell_volume        489.0063
_cod_original_formula_sum        'Cs1 Mn1 O4 P1'
_cod_database_code               1536754
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
-x+1/2,y+1/2,z+1/2
x+1/2,-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
O3 O-2 0.683 -0.029 0.919 0.3 0.0
O2 O-2 0.239 0.996 0.464 0.7 0.0
O7 O-2 0.199 0.777 0.181 0.5 0.0
Mn1 Mn+2 0.1688 0.5804 0.243 1 0.0
O4 O-2 0.283 0.758 0.308 0.5 0.0
O6 O-2 0.45 0.972 0.317 0.5 0.0
O1 O-2 0.225 0.963 0.021 1 0.0
P1 P+5 0.2969 0.9097 0.243 1 0.0
Cs1 Cs+1 0.0071 0.19447 0.25 1 0.0
O5 O-2 0.454 0.844 0.263 0.5 0.0
