# generated using pymatgen data_Lu5Bi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.06051665 _cell_length_b 9.28468218 _cell_length_c 11.72858800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu5Bi3 _chemical_formula_sum 'Lu20 Bi12' _cell_volume 877.75972995 _cell_formula_units_Z 4 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 0.02218787 0.25000000 0.51087222 1.0 Lu Lu1 1 0.97781213 0.75000000 0.48912778 1.0 Lu Lu2 1 0.47781213 0.75000000 0.01087222 1.0 Lu Lu3 1 0.52218787 0.25000000 0.98912778 1.0 Lu Lu4 1 0.35583472 0.25000000 0.28310493 1.0 Lu Lu5 1 0.64416528 0.75000000 0.71689507 1.0 Lu Lu6 1 0.14416528 0.75000000 0.78310493 1.0 Lu Lu7 1 0.85583472 0.25000000 0.21689507 1.0 Lu Lu8 1 0.18623456 0.25000000 0.78490790 1.0 Lu Lu9 1 0.81376544 0.75000000 0.21509210 1.0 Lu Lu10 1 0.31376544 0.75000000 0.28490790 1.0 Lu Lu11 1 0.68623456 0.25000000 0.71509210 1.0 Lu Lu12 1 0.19210557 0.06764005 0.05971984 1.0 Lu Lu13 1 0.80789443 0.93235995 0.94028016 1.0 Lu Lu14 1 0.30789443 0.93235995 0.55971984 1.0 Lu Lu15 1 0.80789443 0.56764005 0.94028016 1.0 Lu Lu16 1 0.69210557 0.06764005 0.44028016 1.0 Lu Lu17 1 0.19210557 0.43235995 0.05971984 1.0 Lu Lu18 1 0.69210557 0.43235995 0.44028016 1.0 Lu Lu19 1 0.30789443 0.56764005 0.55971984 1.0 Bi Bi20 1 0.40209439 0.25000000 0.54239978 1.0 Bi Bi21 1 0.59790561 0.75000000 0.45760022 1.0 Bi Bi22 1 0.09790561 0.75000000 0.04239978 1.0 Bi Bi23 1 0.90209439 0.25000000 0.95760022 1.0 Bi Bi24 1 0.06541915 0.00370329 0.32544414 1.0 Bi Bi25 1 0.93458085 0.99629671 0.67455586 1.0 Bi Bi26 1 0.43458085 0.99629671 0.82544414 1.0 Bi Bi27 1 0.93458085 0.50370329 0.67455586 1.0 Bi Bi28 1 0.56541915 0.00370329 0.17455586 1.0 Bi Bi29 1 0.06541915 0.49629671 0.32544414 1.0 Bi Bi30 1 0.56541915 0.49629671 0.17455586 1.0 Bi Bi31 1 0.43458085 0.50370329 0.82544414 1.0