# generated using pymatgen data_Tm(Hf5Bi6)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.79536862 _cell_length_b 10.79536862 _cell_length_c 7.59896664 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm(Hf5Bi6)3 _chemical_formula_sum 'Tm1 Hf15 Bi18' _cell_volume 885.58344831 _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 Tm Tm0 1 0.75000000 0.75000000 0.07853115 1.0 Hf Hf1 1 0.00046583 0.00046583 0.00022766 1.0 Hf Hf2 1 0.49953417 0.00046583 0.00022766 1.0 Hf Hf3 1 0.00046583 0.49953417 0.00022766 1.0 Hf Hf4 1 0.49953417 0.49953417 0.00022766 1.0 Hf Hf5 1 0.75000000 0.10452311 0.15453035 1.0 Hf Hf6 1 0.75000000 0.39547589 0.15453035 1.0 Hf Hf7 1 0.10452311 0.75000000 0.15453035 1.0 Hf Hf8 1 0.39547589 0.75000000 0.15453035 1.0 Hf Hf9 1 0.25000000 0.25000000 0.43264188 1.0 Hf Hf10 1 0.75000000 0.75000000 0.56482124 1.0 Hf Hf11 1 0.60446244 0.24999900 0.84420524 1.0 Hf Hf12 1 0.89553856 0.25000000 0.84420524 1.0 Hf Hf13 1 0.24999900 0.60446244 0.84420524 1.0 Hf Hf14 1 0.25000000 0.89553856 0.84420524 1.0 Hf Hf15 1 0.25000000 0.25000000 0.92422021 1.0 Bi Bi16 1 0.25000000 0.01644117 0.19386201 1.0 Bi Bi17 1 0.01644117 0.25000000 0.19386201 1.0 Bi Bi18 1 0.48355783 0.24999900 0.19386201 1.0 Bi Bi19 1 0.24999900 0.48355783 0.19386201 1.0 Bi Bi20 1 0.58156289 0.58156289 0.35280804 1.0 Bi Bi21 1 0.91843711 0.58156289 0.35280804 1.0 Bi Bi22 1 0.91843711 0.91843711 0.35280804 1.0 Bi Bi23 1 0.58156289 0.91843711 0.35280804 1.0 Bi Bi24 1 0.75000000 0.25000000 0.49840067 1.0 Bi Bi25 1 0.25000000 0.75000000 0.49840067 1.0 Bi Bi26 1 0.41509356 0.08490644 0.65108472 1.0 Bi Bi27 1 0.08490644 0.08490644 0.65108472 1.0 Bi Bi28 1 0.08490644 0.41509356 0.65108472 1.0 Bi Bi29 1 0.41509356 0.41509356 0.65108472 1.0 Bi Bi30 1 0.75000000 0.51352634 0.80403077 1.0 Bi Bi31 1 0.51352634 0.75000000 0.80403077 1.0 Bi Bi32 1 0.98647366 0.75000000 0.80403077 1.0 Bi Bi33 1 0.75000000 0.98647366 0.80403077 1.0