# generated using pymatgen data_Li3SiIr _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.50544400 _cell_length_b 6.50544400 _cell_length_c 6.50544400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li3SiIr _chemical_formula_sum 'Li12 Si4 Ir4' _cell_volume 275.31560478 _cell_formula_units_Z 4 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Li Li0 1 0.53966412 0.62990423 0.29927361 1.0 Li Li1 1 0.79927361 0.96033588 0.37009577 1.0 Li Li2 1 0.03966412 0.87009577 0.70072639 1.0 Li Li3 1 0.87009577 0.70072639 0.03966412 1.0 Li Li4 1 0.70072639 0.03966412 0.87009577 1.0 Li Li5 1 0.62990423 0.29927361 0.53966412 1.0 Li Li6 1 0.12990423 0.20072639 0.46033588 1.0 Li Li7 1 0.37009577 0.79927361 0.96033588 1.0 Li Li8 1 0.29927361 0.53966412 0.62990423 1.0 Li Li9 1 0.46033588 0.12990423 0.20072639 1.0 Li Li10 1 0.20072639 0.46033588 0.12990423 1.0 Li Li11 1 0.96033588 0.37009577 0.79927361 1.0 Si Si12 1 0.92465204 0.57534796 0.42465204 1.0 Si Si13 1 0.57534796 0.42465204 0.92465204 1.0 Si Si14 1 0.42465204 0.92465204 0.57534796 1.0 Si Si15 1 0.07534796 0.07534796 0.07534796 1.0 Ir Ir16 1 0.32053951 0.17946049 0.82053951 1.0 Ir Ir17 1 0.17946049 0.82053951 0.32053951 1.0 Ir Ir18 1 0.82053951 0.32053951 0.17946049 1.0 Ir Ir19 1 0.67946049 0.67946049 0.67946049 1.0