#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/7/22/27/7222797.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_7222797
loop_
_publ_author_name
'Riecken, J.F.'
'Poettgen, R.'
_publ_section_title
;
 Structure Refinement of Ba Ir In2
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              118
_journal_page_last               120
_journal_volume                  60
_journal_year                    2005
_chemical_formula_sum            'Ba In2 Ir'
_chemical_name_systematic        'Ba Ir In2'
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.433
_cell_length_b                   11.513
_cell_length_c                   8.06
_cell_volume                     411.359
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Riecken_ZNBSEN_2005_1797.cif
_cod_data_source_block           Ba1In2Ir1
_cod_original_cell_volume        411.3593
_cod_original_formula_sum        'Ba1 In2 Ir1'
_cod_database_code               7222797
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
x,-y,-z
-x,y,-z+1/2
-x,-y,-z
x,y,-z-1/2
-x,y,z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,-y+1/2,z+1/2
x+1/2,-y+1/2,-z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x+1/2,y+1/2,-z-1/2
-x+1/2,y+1/2,z
x+1/2,-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
Ba1 Ba 0 0.05421 0.25 1 0.0
In1 In 0 0.33619 0.05497 1 0.0
Ir1 Ir 0 0.78136 0.25 1 0.0
