# generated using pymatgen data_Lu2O3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.88673007 _cell_length_b 8.88673119 _cell_length_c 8.88672962 _cell_angle_alpha 109.47122629 _cell_angle_beta 109.47122879 _cell_angle_gamma 109.47121314 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu2O3 _chemical_formula_sum 'Lu16 O24' _cell_volume 540.26156847 _cell_formula_units_Z 8 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 0.25000000 0.71671147 0.46671147 1.0 Lu Lu1 1 0.03328853 0.75000000 0.78328853 1.0 Lu Lu2 1 0.78328853 0.03328853 0.75000000 1.0 Lu Lu3 1 0.46671147 0.25000000 0.71671147 1.0 Lu Lu4 1 0.71671147 0.46671147 0.25000000 1.0 Lu Lu5 1 0.75000000 0.78328853 0.03328853 1.0 Lu Lu6 1 0.75000000 0.28328853 0.53328853 1.0 Lu Lu7 1 0.96671147 0.25000000 0.21671147 1.0 Lu Lu8 1 0.21671147 0.96671147 0.25000000 1.0 Lu Lu9 1 0.53328853 0.75000000 0.28328853 1.0 Lu Lu10 1 0.28328853 0.53328853 0.75000000 1.0 Lu Lu11 1 0.25000000 0.21671147 0.96671147 1.0 Lu Lu12 1 -0.00000000 0.50000000 0.00000000 1.0 Lu Lu13 1 0.50000000 0.00000000 0.00000000 1.0 Lu Lu14 1 -0.00000000 0.00000000 0.50000000 1.0 Lu Lu15 1 0.50000000 0.50000000 0.50000000 1.0 O O16 1 0.03224875 0.48820397 0.76081483 1.0 O O17 1 0.22738713 0.27143392 0.73918517 1.0 O O18 1 0.27261287 0.01179603 0.04404478 1.0 O O19 1 0.22856608 0.45595522 0.46775125 1.0 O O20 1 0.45595522 0.46775125 0.22856608 1.0 O O21 1 0.76081483 0.03224875 0.48820397 1.0 O O22 1 0.27143392 0.73918517 0.22738713 1.0 O O23 1 0.04404478 0.27261287 0.01179603 1.0 O O24 1 0.48820397 0.76081483 0.03224875 1.0 O O25 1 0.73918517 0.22738713 0.27143392 1.0 O O26 1 0.01179603 0.04404478 0.27261287 1.0 O O27 1 0.46775125 0.22856608 0.45595522 1.0 O O28 1 0.96775125 0.51179603 0.23918517 1.0 O O29 1 0.77261287 0.72856608 0.26081483 1.0 O O30 1 0.72738713 0.98820397 0.95595522 1.0 O O31 1 0.77143392 0.54404478 0.53224875 1.0 O O32 1 0.53224875 0.77143392 0.54404478 1.0 O O33 1 0.98820397 0.95595522 0.72738713 1.0 O O34 1 0.26081483 0.77261287 0.72856608 1.0 O O35 1 0.51179603 0.23918517 0.96775125 1.0 O O36 1 0.95595522 0.72738713 0.98820397 1.0 O O37 1 0.72856608 0.26081483 0.77261287 1.0 O O38 1 0.23918517 0.96775125 0.51179603 1.0 O O39 1 0.54404478 0.53224875 0.77143392 1.0