# generated using pymatgen data_SrNbO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.70922761 _cell_length_b 5.70973949 _cell_length_c 8.19387064 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrNbO3 _chemical_formula_sum 'Sr4 Nb4 O12' _cell_volume 267.10545309 _cell_formula_units_Z 4 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 0.00021063 1.0 Sr Sr1 1 -0.00000000 -0.00000000 0.50083206 1.0 Sr Sr2 1 0.50000000 0.50000000 0.49916794 1.0 Sr Sr3 1 0.50000000 0.50000000 -0.00021063 1.0 Nb Nb4 1 0.50000000 -0.00000000 0.24996899 1.0 Nb Nb5 1 0.50000000 -0.00000000 0.74983014 1.0 Nb Nb6 1 -0.00000000 0.50000000 0.25016986 1.0 Nb Nb7 1 -0.00000000 0.50000000 0.75003101 1.0 O O8 1 0.28823381 0.28829012 0.24998955 1.0 O O9 1 0.50000000 -0.00000000 0.49995125 1.0 O O10 1 0.71188178 0.71187182 0.74989253 1.0 O O11 1 0.78823381 0.21170988 0.75001045 1.0 O O12 1 -0.00000000 0.50000000 0.00000750 1.0 O O13 1 -0.00000000 0.50000000 0.50004875 1.0 O O14 1 0.21188178 0.78812818 0.25010747 1.0 O O15 1 0.28811822 0.28812818 0.74989253 1.0 O O16 1 0.50000000 -0.00000000 -0.00000750 1.0 O O17 1 0.71176619 0.71170988 0.24998955 1.0 O O18 1 0.78811822 0.21187182 0.25010747 1.0 O O19 1 0.21176619 0.78829012 0.75001045 1.0