#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/54/10/1541000.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_1541000
loop_
_publ_author_name
'Staffel, T.'
'Meyer, G.'
_publ_section_title
;
 Synthese und Kristallstrukturen von Na In Br4 und Na In I4
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              107
_journal_page_last               113
_journal_volume                  574
_journal_year                    1989
_chemical_formula_sum            'Br4 In Na'
_chemical_name_systematic        'Na (In Br4)'
_space_group_IT_number           19
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.081
_cell_length_b                   10.507
_cell_length_c                   6.761
_cell_volume                     787.170
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Staffel_ZAACAB_1989_400.cif
_cod_data_source_block           Br4In1Na1
_cod_original_cell_volume        787.1702
_cod_original_formula_sum        'Br4 In1 Na1'
_cod_database_code               1541000
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-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
In1 In+3 0.0378 0.4915 0.2143 1 0.0
Br1 Br-1 0.0377 0.4966 0.5839 1 0.0
Br3 Br-1 0.3326 0.0099 0.9391 1 0.0
Br4 Br-1 0.369 0.3116 0.5706 1 0.0
Br2 Br-1 0.1553 0.3025 0.1048 1 0.0
Na1 Na+1 0.107 0.216 0.6911 1 0.0
