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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/8/10/42/8104216.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_8104216
loop_
_publ_author_name
'Iizuka, M.'
'Sudo, T.'
_publ_section_title
;
 Crystal structure of cadmium mercuric thiocyanate, Cd Hg (S V N)4
;
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, 
Kristallchemie (-144,1977)
;
_journal_page_first              376
_journal_page_last               378
_journal_volume                  126
_journal_year                    1968
_chemical_formula_sum            'Cd Hg S4'
_chemical_name_systematic        'Cd Hg (S C N)4'
_space_group_IT_number           82
_symmetry_space_group_name_Hall  'I -4'
_symmetry_space_group_name_H-M   'I -4'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   11.48
_cell_length_b                   11.48
_cell_length_c                   4.33
_cell_volume                     570.652
_citation_journal_id_ASTM        ZEKGAX
_cod_data_source_file            Iizuka_ZEKGAX_1968_1551.cif
_cod_data_source_block           Cd1Hg1S4
_cod_original_cell_volume        570.6524
_cod_original_formula_sum        'Cd1 Hg1 S4'
_cod_database_code               8104216
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
y,-x,-z
-x,-y,z
-y,x,-z
x+1/2,y+1/2,z+1/2
y+1/2,-x+1/2,-z+1/2
-x+1/2,-y+1/2,z+1/2
-y+1/2,x+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
Hg1 Hg+2 0 0 0 1 0.0
S1 S-2 0.148 0.134 0.29 1 0.0
Cd1 Cd+2 0 0.5 0.25 1 0.0
