#------------------------------------------------------------------------------ #$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176429 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/34/1523435.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_1523435 loop_ _publ_author_name 'Daams, J.L.C.' 'van Vucht, J.H.N.' _publ_section_title ; Contribution to the system Mg-Au-Hg ; _journal_name_full 'Philips Journal of Research' _journal_page_first 275 _journal_page_last 292 _journal_volume 39 _journal_year 1984 _chemical_formula_sum 'Hg Mg3' _chemical_name_systematic 'Hg Mg3' _space_group_IT_number 155 _symmetry_space_group_name_Hall 'R 3 2"' _symmetry_space_group_name_H-M 'R 3 2 :H' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 18 _cell_length_a 8.351 _cell_length_b 8.351 _cell_length_c 25.845 _cell_volume 1560.933 _citation_journal_id_ASTM PHJRD9 _cod_data_source_file Daams_PHJRD9_1984_635.cif _cod_data_source_block Hg1Mg3 _cod_original_cell_volume 1560.932 _cod_original_formula_sum 'Hg1 Mg3' _cod_database_code 1523435 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x-y,z -x+y,-x,z y,x,-z -x,-x+y,-z x-y,-y,-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 y+2/3,x+1/3,-z+1/3 -x+2/3,-x+y+1/3,-z+1/3 x-y+2/3,-y+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 y+1/3,x+2/3,-z+2/3 -x+1/3,-x+y+2/3,-z+2/3 x-y+1/3,-y+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 Mg5 Mg 0.333 0.333 0.111 1 0.0 Mg1 Mg 0 0 0.861 1 0.0 Hg1 Hg 0.667 0 0 1 0.0 Hg2 Hg 0.333 0 0.5 1 0.0 Mg3 Mg 0 0 0.695 1 0.0 Mg4 Mg 0.667 0.667 0.055 1 0.0 Mg2 Mg 0 0 0.417 1 0.0