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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/2/31/09/2310938.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_2310938
loop_
_publ_author_name
'Rosenzweig, A.'
'Cromer, D.T.'
_publ_section_title
;
 The crystal structure of K Au (C N)2
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              709
_journal_page_last               712
_journal_volume                  12
_journal_year                    1959
_chemical_formula_sum            'C2 Au K N2'
_chemical_name_systematic        'K (Au (C N)2)'
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            9
_cell_length_a                   7.28
_cell_length_b                   7.28
_cell_length_c                   26.35999
_cell_volume                     1209.870
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Rosenzweig_ACCRA9_1959_1371.cif
_cod_data_source_block           C2Au1K1N2
_cod_original_cell_volume        1209.87
_cod_original_formula_sum        'C2 Au1 K1 N2'
_cod_database_code               2310938
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
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
Au1 Au+1 0.5 0 0.5 1 0.0
K2 K+1 0 0 0.3441 1 0.0
K1 K+1 0 0 0 1 0.0
C1 C+2 0.403 0.406 0.424 1 0.0
N1 N-3 0.337 0.348 0.383 1 0.0
