# generated using pymatgen data_Li2LaThAs4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.05769997 _cell_length_b 4.05769997 _cell_length_c 10.50454534 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2LaThAs4 _chemical_formula_sum 'Li2 La1 Th1 As4' _cell_volume 172.95659336 _cell_formula_units_Z 1 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 0.00000000 0.00000000 0.99850873 1.0 Li Li1 1 0.50000000 0.50000000 0.99850873 1.0 La La2 1 0.50000000 0.00000000 0.72529154 1.0 Th Th3 1 0.00000000 0.50000000 0.27662514 1.0 As As4 1 0.00000000 0.50000000 0.84805091 1.0 As As5 1 0.50000000 0.00000000 0.16518069 1.0 As As6 1 0.00000000 0.00000000 0.49391712 1.0 As As7 1 0.50000000 0.50000000 0.49391712 1.0