#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/02/1510297.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_1510297 loop_ _publ_author_name 'Rabenau, A.' 'Schulz, H.' _publ_section_title ; The crystal structures of alpha-AuSe and beta-AuSe ; _journal_name_full 'Journal of the Less-Common Metals' _journal_page_first 89 _journal_page_last 101 _journal_paper_doi 10.1016/0022-5088(76)90235-6 _journal_volume 48 _journal_year 1976 _chemical_formula_sum 'Au Se' _chemical_name_systematic 'Au Se' _space_group_IT_number 12 _symmetry_space_group_name_Hall '-C 2y' _symmetry_space_group_name_H-M 'C 1 2/m 1' _cell_angle_alpha 90 _cell_angle_beta 103.15 _cell_angle_gamma 90 _cell_formula_units_Z 8 _cell_length_a 12.202 _cell_length_b 3.69 _cell_length_c 8.433 _cell_volume 369.742 _citation_journal_id_ASTM JCOMAH _cod_data_source_file gold_361.cif _cod_data_source_block Au1Se1 _cod_original_cell_volume 369.7425 _cod_original_formula_sum 'Au1 Se1' _cod_database_code 1510297 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y,-z -x,-y,-z x,-y,z x+1/2,y+1/2,z -x+1/2,y+1/2,-z -x+1/2,-y+1/2,-z x+1/2,-y+1/2,z 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 Se1 Se-2 0.329 0 0.687 1 0.0 Se2 Se-2 0.393 0 0.275 1 0.0 Au1 Au+1 0.3547 0 0.9808 1 0.0 Au2 Au+3 0.0335 0 0.2961 1 0.0