# generated using pymatgen data_LiAc2LaB24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.22219982 _cell_length_b 7.22219973 _cell_length_c 5.92043676 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 109.33777782 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiAc2LaB24 _chemical_formula_sum 'Li1 Ac2 La1 B24' _cell_volume 291.38874121 _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 0.74844672 0.25155328 0.50000000 1.0 Ac Ac1 1 0.50258910 0.49741090 0.00000000 1.0 Ac Ac2 1 0.24960428 0.75039572 0.50000000 1.0 La La3 1 0.99721288 0.00278712 0.00000000 1.0 B B4 1 0.17370726 0.32369814 0.64829530 1.0 B B5 1 0.92506409 0.57374557 0.14958123 1.0 B B6 1 0.67630186 0.82629274 0.64829530 1.0 B B7 1 0.42625443 0.07493591 0.14958123 1.0 B B8 1 0.17370726 0.32369814 0.35170470 1.0 B B9 1 0.92506409 0.57374557 0.85041877 1.0 B B10 1 0.67630186 0.82629274 0.35170470 1.0 B B11 1 0.42625443 0.07493591 0.85041877 1.0 B B12 1 0.39995190 0.39773946 0.50000000 1.0 B B13 1 0.14859183 0.64882695 0.00000000 1.0 B B14 1 0.89859099 0.90072624 0.50000000 1.0 B B15 1 0.65015944 0.14931894 0.00000000 1.0 B B16 1 0.32496601 0.17467614 0.64830181 1.0 B B17 1 0.07305680 0.42394258 0.14958411 1.0 B B18 1 0.82532386 0.67503399 0.64830181 1.0 B B19 1 0.57605742 0.92694320 0.14958411 1.0 B B20 1 0.09927376 0.10140901 0.50000000 1.0 B B21 1 0.85068106 0.34984056 0.00000000 1.0 B B22 1 0.60226054 0.60004810 0.50000000 1.0 B B23 1 0.35117305 0.85140817 0.00000000 1.0 B B24 1 0.32496601 0.17467614 0.35169819 1.0 B B25 1 0.07305680 0.42394258 0.85041589 1.0 B B26 1 0.82532386 0.67503399 0.35169819 1.0 B B27 1 0.57605742 0.92694320 0.85041589 1.0