#------------------------------------------------------------------------------ #$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $ #$Revision: 14 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9009861.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_9009861 _chemical_name 'K6HgS4' loop_ _publ_author_name 'Sommer H' 'Hoppe R' 'Jansen M' _journal_name_full "Die Naturwissenschaften" _journal_volume 63 _journal_year 1976 _journal_page_first 194 _journal_page_last 195 _publ_section_title ; Das erste thiomercurat(II) mit inselstruktur: K6(HgS4) ; _chemical_formula_sum 'K6 Hg S4' _cell_length_a 9.98 _cell_length_b 9.98 _cell_length_c 7.64 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 658.999 _symmetry_space_group_name_H-M 'P 63 m c' loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' '-x,-x+y,1/2+z' 'x-y,x,1/2+z' '-y,-x,z' '-y,x-y,z' 'x-y,-y,1/2+z' '-x,-y,1/2+z' 'x,x-y,z' '-x+y,-x,z' 'y,x,1/2+z' 'y,-x+y,1/2+z' '-x+y,y,z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z K1 0.14700 0.29400 0.79700 K2 0.52800 0.05600 0.62500 Hg 0.33333 0.66667 0.50100 S1 0.33333 0.66667 0.83300 S2 0.80900 0.61800 0.89600