# generated using pymatgen data_Sr2Nb5O9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.19962800 _cell_length_b 4.19962800 _cell_length_c 12.18683600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2Nb5O9 _chemical_formula_sum 'Sr2 Nb5 O9' _cell_volume 214.93770730 _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 Sr Sr0 1 0.00000000 0.00000000 0.16929400 1.0 Sr Sr1 1 0.00000000 0.00000000 0.83070600 1.0 Nb Nb2 1 0.50000000 0.50000000 0.33541100 1.0 Nb Nb3 1 0.50000000 0.00000000 0.50000000 1.0 Nb Nb4 1 0.00000000 0.50000000 0.50000000 1.0 Nb Nb5 1 0.50000000 0.50000000 0.66458900 1.0 Nb Nb6 1 0.50000000 0.50000000 0.00000000 1.0 O O7 1 0.00000000 0.00000000 0.50000000 1.0 O O8 1 0.00000000 0.50000000 0.67711100 1.0 O O9 1 0.50000000 0.00000000 0.67711100 1.0 O O10 1 0.00000000 0.50000000 0.32288900 1.0 O O11 1 0.50000000 0.00000000 0.32288900 1.0 O O12 1 0.50000000 0.50000000 0.83811600 1.0 O O13 1 0.50000000 0.50000000 0.16188400 1.0 O O14 1 0.50000000 0.00000000 0.00000000 1.0 O O15 1 0.00000000 0.50000000 0.00000000 1.0