# generated using pymatgen data_Nb4O5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.84182088 _cell_length_b 6.71561854 _cell_length_c 6.71561854 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb4O5 _chemical_formula_sum 'Nb8 O10' _cell_volume 218.36385753 _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 Nb Nb0 1 0.54570458 0.75000000 0.54612267 1.0 Nb Nb1 1 0.04570458 0.95387733 0.75000000 1.0 Nb Nb2 1 0.45429542 0.25000000 0.04612267 1.0 Nb Nb3 1 0.04570458 0.54612267 0.75000000 1.0 Nb Nb4 1 0.45429542 0.25000000 0.45387733 1.0 Nb Nb5 1 0.95429542 0.45387733 0.25000000 1.0 Nb Nb6 1 0.54570458 0.75000000 0.95387733 1.0 Nb Nb7 1 0.95429542 0.04612267 0.25000000 1.0 O O8 1 0.75000000 0.03642224 0.53642224 1.0 O O9 1 0.75000000 0.46357776 0.53642224 1.0 O O10 1 0.75000000 0.75000000 0.25000000 1.0 O O11 1 0.75000000 0.03642224 0.96357776 1.0 O O12 1 0.25000000 0.53642224 0.03642224 1.0 O O13 1 0.75000000 0.46357776 0.96357776 1.0 O O14 1 0.25000000 0.53642224 0.46357776 1.0 O O15 1 0.25000000 0.96357776 0.03642224 1.0 O O16 1 0.25000000 0.96357776 0.46357776 1.0 O O17 1 0.25000000 0.25000000 0.75000000 1.0