# generated using pymatgen data_Tm2O3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.99450822 _cell_length_b 8.99450682 _cell_length_c 8.99450773 _cell_angle_alpha 109.47122043 _cell_angle_beta 109.47121728 _cell_angle_gamma 109.47122392 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2O3 _chemical_formula_sum 'Tm16 O24' _cell_volume 560.15767216 _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 Tm Tm0 1 0.50000000 0.50000000 0.50000000 1.0 Tm Tm1 1 0.00000000 0.00000000 0.50000000 1.0 Tm Tm2 1 0.50000000 0.00000000 0.00000000 1.0 Tm Tm3 1 0.00000000 0.50000000 0.00000000 1.0 Tm Tm4 1 0.25000000 0.21701140 0.96701140 1.0 Tm Tm5 1 0.28298860 0.53298860 0.75000000 1.0 Tm Tm6 1 0.53298860 0.75000000 0.28298860 1.0 Tm Tm7 1 0.21701140 0.96701140 0.25000000 1.0 Tm Tm8 1 0.96701140 0.25000000 0.21701140 1.0 Tm Tm9 1 0.75000000 0.28298860 0.53298860 1.0 Tm Tm10 1 0.75000000 0.78298860 0.03298860 1.0 Tm Tm11 1 0.71701140 0.46701140 0.25000000 1.0 Tm Tm12 1 0.46701140 0.25000000 0.71701140 1.0 Tm Tm13 1 0.78298860 0.03298860 0.75000000 1.0 Tm Tm14 1 0.03298860 0.75000000 0.78298860 1.0 Tm Tm15 1 0.25000000 0.71701140 0.46701140 1.0 O O16 1 0.53172806 0.77111375 0.54346560 1.0 O O17 1 0.98826147 0.95653440 0.72764816 1.0 O O18 1 0.26061531 0.77235184 0.72888625 1.0 O O19 1 0.51173853 0.23938469 0.96827194 1.0 O O20 1 0.95653440 0.72764816 0.98826147 1.0 O O21 1 0.72888625 0.26061531 0.77235184 1.0 O O22 1 0.23938469 0.96827194 0.51173853 1.0 O O23 1 0.54346560 0.53172806 0.77111375 1.0 O O24 1 0.77111375 0.54346560 0.53172806 1.0 O O25 1 0.72764816 0.98826147 0.95653440 1.0 O O26 1 0.77235184 0.72888625 0.26061531 1.0 O O27 1 0.96827194 0.51173853 0.23938469 1.0 O O28 1 0.46827194 0.22888625 0.45653440 1.0 O O29 1 0.01173853 0.04346560 0.27235184 1.0 O O30 1 0.73938469 0.22764816 0.27111375 1.0 O O31 1 0.48826147 0.76061531 0.03172806 1.0 O O32 1 0.04346560 0.27235184 0.01173853 1.0 O O33 1 0.27111375 0.73938469 0.22764816 1.0 O O34 1 0.76061531 0.03172806 0.48826147 1.0 O O35 1 0.45653440 0.46827194 0.22888625 1.0 O O36 1 0.22888625 0.45653440 0.46827194 1.0 O O37 1 0.27235184 0.01173853 0.04346560 1.0 O O38 1 0.22764816 0.27111375 0.73938469 1.0 O O39 1 0.03172806 0.48826147 0.76061531 1.0