# generated using pymatgen data_Lu4Zn(SiB4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.05286692 _cell_length_b 7.05286692 _cell_length_c 7.44024816 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu4Zn(SiB4)2 _chemical_formula_sum 'Lu8 Zn2 Si4 B16' _cell_volume 370.09975704 _cell_formula_units_Z 2 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 Lu Lu0 1 0.68267472 0.18267472 0.23536915 1.0 Lu Lu1 1 0.31732528 0.81732528 0.76463085 1.0 Lu Lu2 1 0.31732528 0.81732528 0.23536915 1.0 Lu Lu3 1 0.81732528 0.68267472 0.23536915 1.0 Lu Lu4 1 0.81732528 0.68267472 0.76463085 1.0 Lu Lu5 1 0.68267472 0.18267472 0.76463085 1.0 Lu Lu6 1 0.18267472 0.31732528 0.76463085 1.0 Lu Lu7 1 0.18267472 0.31732528 0.23536915 1.0 Zn Zn8 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn9 1 0.50000000 0.50000000 0.50000000 1.0 Si Si10 1 0.11578476 0.61578476 0.50000000 1.0 Si Si11 1 0.88421524 0.38421524 0.50000000 1.0 Si Si12 1 0.38421524 0.11578476 0.50000000 1.0 Si Si13 1 0.61578476 0.88421524 0.50000000 1.0 B B14 1 0.17406252 0.03974650 0.00000000 1.0 B B15 1 0.82593748 0.96025350 0.00000000 1.0 B B16 1 0.96025350 0.17406252 0.00000000 1.0 B B17 1 0.32593748 0.53974650 0.00000000 1.0 B B18 1 0.03974650 0.82593748 0.00000000 1.0 B B19 1 0.67406252 0.46025350 0.00000000 1.0 B B20 1 0.53974650 0.67406252 0.00000000 1.0 B B21 1 0.46025350 0.32593748 0.00000000 1.0 B B22 1 0.08895487 0.58895487 0.00000000 1.0 B B23 1 0.91104513 0.41104513 0.00000000 1.0 B B24 1 0.41104513 0.08895487 0.00000000 1.0 B B25 1 0.58895487 0.91104513 0.00000000 1.0 B B26 1 0.00000000 0.00000000 0.17256384 1.0 B B27 1 0.00000000 0.00000000 0.82743616 1.0 B B28 1 0.50000000 0.50000000 0.82743616 1.0 B B29 1 0.50000000 0.50000000 0.17256384 1.0