data_global _amcsd_formula_title 'LiGaS2' loop_ _publ_author_name 'Leal-Gonzalez J' 'Melibary S S' 'Smith A J' _journal_name_full 'Acta Crystallographica, Section C' _journal_volume 46 _journal_year 1990 _journal_page_first 2017 _journal_page_last 2019 _publ_section_title ; Structure of lithium gallium sulfide, LiGaS2 ; _database_code_amcsd 0010203 _chemical_formula_sum 'Li Ga S2' _cell_length_a 6.519 _cell_length_b 7.872 _cell_length_c 6.238 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 320.119 _exptl_crystal_density_diffrn 2.921 _symmetry_space_group_name_H-M 'P n a 21' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2-y,z' '1/2-x,1/2+y,1/2+z' '-x,-y,1/2+z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Li 0.41780 0.14450 0.12550 Ga 0.07360 0.12710 0.61350 S1 0.09510 0.63510 0.00650 S2 0.06590 0.11530 0.98790