#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/35/8103503.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_8103503
loop_
_publ_author_name
'Carlson, S.'
'Norrestam, R.'
'Xu, Y.'
_publ_section_title
;
 Single crystal X-ray diffraction studies of Na2 Mn F5 at high hydrostatic
 pressures
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              259
_journal_page_last               263
_journal_volume                  214
_journal_year                    1999
_chemical_formula_sum            'F5 Mn Na2'
_chemical_name_systematic        'Na2 Mn F5'
_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                 109.29
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.615
_cell_length_b                   5.152
_cell_length_c                   10.741
_cell_volume                     397.738
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Carlson_ZEKRDZ_1999_908.cif
_cod_data_source_block           F5Mn1Na2
_cod_original_cell_volume        397.7383
_cod_original_formula_sum        'F5 Mn1 Na2'
_cod_database_code               8103503
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
F4 F-1 0.621 0.2106 0.143 1 0.0
Mn2 Mn+3 0.5 0 0 1 0.0
F5 F-1 0.5 0.2575 0.884 1 0.0
F2 F-1 0.883 0.3002 -0.081 1 0.0
Na2 Na+1 0.3428 0.4301 0.182 1 0.0
F1 F-1 0.056 0.1556 0.172 1 0.0
Mn1 Mn+3 0 0 0 1 0.0
F3 F-1 0.259 0.1611 0.013 1 0.0
Na1 Na+1 0.151 -0.0129 0.362 1 0.0
