# generated using pymatgen data_YbThB8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.17563994 _cell_length_b 7.17564019 _cell_length_c 4.07847115 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 91.32266943 _symmetry_Int_Tables_number 1 _chemical_formula_structural YbThB8 _chemical_formula_sum 'Yb2 Th2 B16' _cell_volume 209.94375209 _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 Yb Yb0 1 0.68172502 0.31827498 0.00000000 1.0 Yb Yb1 1 0.31827498 0.68172502 0.00000000 1.0 Th Th2 1 0.81361965 0.81361965 0.00000000 1.0 Th Th3 1 0.18638035 0.18638035 0.00000000 1.0 B B4 1 0.00000000 0.50000000 0.79630660 1.0 B B5 1 0.50000000 0.00000000 0.79630660 1.0 B B6 1 0.00000000 0.50000000 0.20369340 1.0 B B7 1 0.50000000 0.00000000 0.20369340 1.0 B B8 1 0.04099625 0.67450437 0.50000000 1.0 B B9 1 0.95900375 0.32549563 0.50000000 1.0 B B10 1 0.46425529 0.17608251 0.50000000 1.0 B B11 1 0.53574471 0.82391749 0.50000000 1.0 B B12 1 0.17608251 0.46425529 0.50000000 1.0 B B13 1 0.82391749 0.53574471 0.50000000 1.0 B B14 1 0.67450437 0.04099625 0.50000000 1.0 B B15 1 0.32549563 0.95900375 0.50000000 1.0 B B16 1 0.58890391 0.58890391 0.50000000 1.0 B B17 1 0.41109609 0.41109609 0.50000000 1.0 B B18 1 0.91288151 0.08711849 0.50000000 1.0 B B19 1 0.08711849 0.91288151 0.50000000 1.0