# generated using pymatgen data_Tb9Ho(Pb3Br)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.22681810 _cell_length_b 9.22681867 _cell_length_c 6.73250448 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999097 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb9Ho(Pb3Br)2 _chemical_formula_sum 'Tb9 Ho1 Pb6 Br2' _cell_volume 496.37656218 _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 Tb Tb0 1 0.26905431 0.99991838 0.24977059 1.0 Tb Tb1 1 0.73086407 0.99991838 0.75022941 1.0 Tb Tb2 1 0.00008162 0.26913593 0.24977059 1.0 Tb Tb3 1 0.00008162 0.73094569 0.75022941 1.0 Tb Tb4 1 0.73086407 0.73094569 0.24977059 1.0 Tb Tb5 1 0.26905431 0.26913593 0.75022941 1.0 Tb Tb6 1 0.66666700 0.33333300 0.00000000 1.0 Tb Tb7 1 0.66666700 0.33333300 0.50000000 1.0 Tb Tb8 1 0.33333300 0.66666700 0.50000000 1.0 Ho Ho9 1 0.33333300 0.66666700 0.00000000 1.0 Pb Pb10 1 0.61164144 0.99935715 0.24933542 1.0 Pb Pb11 1 0.38771471 0.99935715 0.75066458 1.0 Pb Pb12 1 0.00064285 0.61228529 0.24933542 1.0 Pb Pb13 1 0.00064285 0.38835856 0.75066458 1.0 Pb Pb14 1 0.38771471 0.38835856 0.24933542 1.0 Pb Pb15 1 0.61164144 0.61228529 0.75066458 1.0 Br Br16 1 0.00000000 0.00000000 0.00000000 1.0 Br Br17 1 0.00000000 0.00000000 0.50000000 1.0