# generated using pymatgen data_K2BaLaB24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.29665434 _cell_length_b 7.29665450 _cell_length_c 5.96343290 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 109.45235674 _symmetry_Int_Tables_number 1 _chemical_formula_structural K2BaLaB24 _chemical_formula_sum 'K2 Ba1 La1 B24' _cell_volume 299.37681116 _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 K K0 1 0.49856217 0.50143812 0.00000000 1.0 K K1 1 0.25267529 0.74732407 0.50000000 1.0 Ba Ba2 1 0.74715051 0.25284981 0.50000000 1.0 La La3 1 0.00361590 0.99638344 0.00000000 1.0 B B4 1 0.17494785 0.32345419 0.64921236 1.0 B B5 1 0.92676458 0.57614746 0.14827101 1.0 B B6 1 0.67654583 0.82505216 0.64921231 1.0 B B7 1 0.42385257 0.07323544 0.14827102 1.0 B B8 1 0.17494785 0.32345419 0.35078764 1.0 B B9 1 0.92676458 0.57614746 0.85172899 1.0 B B10 1 0.67654583 0.82505216 0.35078769 1.0 B B11 1 0.42385257 0.07323544 0.85172898 1.0 B B12 1 0.39714692 0.39854511 0.50000000 1.0 B B13 1 0.15051958 0.64789842 0.00000000 1.0 B B14 1 0.90006402 0.89937140 0.50000000 1.0 B B15 1 0.64701285 0.14982972 0.00000000 1.0 B B16 1 0.32171396 0.17373917 0.64933914 1.0 B B17 1 0.07469772 0.42533425 0.14813811 1.0 B B18 1 0.82626086 0.67828606 0.64933911 1.0 B B19 1 0.57466578 0.92530235 0.14813814 1.0 B B20 1 0.10062862 0.09993601 0.50000000 1.0 B B21 1 0.85017033 0.35298719 0.00000000 1.0 B B22 1 0.60145487 0.60285310 0.50000000 1.0 B B23 1 0.35210165 0.84948047 0.00000000 1.0 B B24 1 0.32171396 0.17373917 0.35066086 1.0 B B25 1 0.07469772 0.42533425 0.85186189 1.0 B B26 1 0.82626086 0.67828606 0.35066089 1.0 B B27 1 0.57466578 0.92530235 0.85186186 1.0