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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/1/54/21/1542167.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_1542167
loop_
_publ_author_name
'Atovmyan, L.O.'
'Tkachev, V.V.'
_publ_section_title
;
 Crystal structure of a new modification of K2 Os N Cl5
;
_journal_name_full
'Zhurnal Strukturnoi Khimii (Issue-No. from 1981)'
_journal_page_first              708
_journal_page_last               710
_journal_volume                  9
_journal_year                    1968
_chemical_formula_sum            'Cl5 K2 N Os'
_chemical_name_systematic        'K2 Os N Cl5'
_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                   13.267
_cell_length_b                   9.842
_cell_length_c                   6.844
_cell_volume                     893.647
_citation_journal_id_ASTM        ZSTKAI
_cod_data_source_file            Atovmyan_ZSTKAI_1968_569.cif
_cod_data_source_block           Cl5K2N1Os1
_cod_original_cell_volume        893.6472
_cod_original_formula_sum        'Cl5 K2 N1 Os1'
_cod_database_code               1542167
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
Cl3 Cl-1 0.217 0.25 -0.07 1 0.0
Cl1 Cl-1 -0.001 0.25 0.464 1 0.0
Cl4 Cl-1 0.107 -0.012 0.193 1 0.0
Cl2 Cl-1 0.245 0.25 0.411 1 0.0
Os1 Os+6 0.0929 0.25 0.1693 1 0.0
K1 K+1 0.146 -0.002 0.671 1 0.0
N1 N-3 -0.011 0.25 0.01 1 0.0
