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#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/31/01/2310181.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2310181
loop_
_publ_author_name
'Duwell, E.J.'
'Baenziger, N.C.'
_publ_section_title
;
 The crystal structure of K5 Hg7
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              476
_journal_page_last               479
_journal_volume                  13
_journal_year                    1960
_chemical_formula_sum            'Hg7 K5'
_space_group_IT_number           57
_symmetry_space_group_name_Hall  '-P 2c 2b'
_symmetry_space_group_name_H-M   'P b c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.06
_cell_length_b                   19.45
_cell_length_c                   8.34
_cell_volume                     1631.863
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Duwell_ACCRA9_1960_624.cif
_cod_data_source_block           Hg7K5
_cod_database_code               2310181
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
x,-y+1/2,-z
-x,y+1/2,-z+1/2
-x,-y,-z
x,y,-z-1/2
-x,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
Hg3 Hg 0.679 0.1194 0.5708 1 0.0
Hg4 Hg 0.3737 0.1399 0.5708 1 0.0
K4 K 0.009 0.398 0.25 1 0.0
K5 K 0.896 0.083 0.25 1 0.0
Hg2 Hg 0.1994 0.0274 0.0646 1 0.0
Hg1 Hg 0.8701 0.25 0 1 0.0
K2 K 0.538 0.017 0.25 1 0.0
K1 K 0.559 0.22 0.25 1 0.0
K3 K 0.174 0.21 0.25 1 0.0
