# generated using pymatgen data_K11B62 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.26690400 _cell_length_b 4.26177300 _cell_length_c 46.20387342 _cell_angle_alpha 89.95024365 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural K11B62 _chemical_formula_sum 'K11 B62' _cell_volume 840.19754297 _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 0.50000000 0.50470200 0.04544200 1.0 K K1 1 0.50000000 0.50046300 0.22775500 1.0 K K2 1 0.50000000 0.49935400 0.13733000 1.0 K K3 1 0.50000000 0.50005800 0.31823100 1.0 K K4 1 0.50000000 0.49999600 0.49998800 1.0 K K5 1 0.50000000 0.50001100 0.40905400 1.0 K K6 1 0.50000000 0.49996700 0.68192600 1.0 K K7 1 0.50000000 0.49996000 0.59095100 1.0 K K8 1 0.50000000 0.50008900 0.77240300 1.0 K K9 1 0.50000000 0.49945200 0.95378900 1.0 K K10 1 0.50000000 0.50033000 0.86388600 1.0 B B11 1 0.00000000 0.98818300 0.02819600 1.0 B B12 1 0.00000000 0.98186800 0.11998800 1.0 B B13 1 0.00000000 0.30696600 0.18105100 1.0 B B14 1 0.00000000 0.00149600 0.24972500 1.0 B B15 1 0.00000000 0.69399000 0.17970100 1.0 B B16 1 0.00000000 0.00010800 0.29808200 1.0 B B17 1 0.00000000 0.30609700 0.27243600 1.0 B B18 1 0.00000000 0.99994400 0.33587900 1.0 B B19 1 0.00000000 0.99993800 0.39056800 1.0 B B20 1 0.00000000 0.30163200 0.36313900 1.0 B B21 1 0.00000000 0.00004500 0.42699800 1.0 B B22 1 0.00000000 0.69830200 0.36315300 1.0 B B23 1 0.00000000 0.99993300 0.48181600 1.0 B B24 1 0.00000000 0.30040200 0.45447600 1.0 B B25 1 0.00000000 0.69956600 0.45448700 1.0 B B26 1 0.00000000 0.00005200 0.51813400 1.0 B B27 1 0.00000000 0.99992300 0.57275900 1.0 B B28 1 0.00000000 0.99991600 0.66384800 1.0 B B29 1 0.00000000 0.00008500 0.70047800 1.0 B B30 1 0.00000000 0.69989000 0.63644500 1.0 B B31 1 0.00000000 0.99979300 0.75490000 1.0 B B32 1 0.00000000 0.29974600 0.72775700 1.0 B B33 1 0.00000000 0.99987200 0.79198100 1.0 B B34 1 0.00000000 0.70018800 0.72776600 1.0 B B35 1 0.00000000 0.30027800 0.81809400 1.0 B B36 1 0.00000000 0.00051600 0.88528700 1.0 B B37 1 0.00000000 0.69959400 0.81810000 1.0 B B38 1 0.00000000 0.00835200 0.93442400 1.0 B B39 1 0.00000000 0.30540100 0.90880100 1.0 B B40 1 0.00000000 0.98093300 0.97071900 1.0 B B41 1 0.00000000 0.69888700 0.90919000 1.0 B B42 1 0.68429500 0.96791800 0.99907800 1.0 B B43 1 0.68440100 0.96763700 0.09188700 1.0 B B44 1 0.70292500 0.00315300 0.18190200 1.0 B B45 1 0.69439400 0.00034300 0.27238400 1.0 B B46 1 0.69838600 0.99998800 0.36314400 1.0 B B47 1 0.69962000 0.99999000 0.45447900 1.0 B B48 1 0.70009300 0.99998800 0.54546400 1.0 B B49 1 0.69991300 0.99998700 0.63643900 1.0 B B50 1 0.70022900 0.99998300 0.72775500 1.0 B B51 1 0.69579900 0.00030800 0.81762000 1.0 B B52 1 0.69651400 0.00179300 0.90851600 1.0 B B53 1 0.31570500 0.96791800 0.99907800 1.0 B B54 1 0.31559900 0.96763700 0.09188700 1.0 B B55 1 0.29707500 0.00315300 0.18190200 1.0 B B56 1 0.30560600 0.00034300 0.27238400 1.0 B B57 1 0.30161400 0.99998800 0.36314400 1.0 B B58 1 0.30038000 0.99999000 0.45447900 1.0 B B59 1 0.29990700 0.99998800 0.54546400 1.0 B B60 1 0.30008700 0.99998700 0.63643900 1.0 B B61 1 0.30420100 0.00030800 0.81762000 1.0 B B62 1 0.29977100 0.99998300 0.72775500 1.0 B B63 1 0.30348600 0.00179300 0.90851600 1.0 B B64 1 0.00000000 0.00772900 0.15569400 1.0 B B65 1 0.00000000 0.77397000 0.99996700 1.0 B B66 1 0.00000000 0.77460400 0.09079000 1.0 B B67 1 0.00000000 0.98652500 0.06245600 1.0 B B68 1 0.00000000 0.69492400 0.27237100 1.0 B B69 1 0.00000000 0.00006200 0.60911100 1.0 B B70 1 0.00000000 0.29992800 0.54545600 1.0 B B71 1 0.00000000 0.30009000 0.63643400 1.0 B B72 1 0.00000000 0.70006000 0.54546700 1.0