# generated using pymatgen data_SmNbO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.43388108 _cell_length_b 7.43388108 _cell_length_c 7.43388108 _cell_angle_alpha 129.97620251 _cell_angle_beta 129.97620251 _cell_angle_gamma 73.44481176 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmNbO2 _chemical_formula_sum 'Sm4 Nb4 O8' _cell_volume 235.45953456 _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 Sm Sm0 1 0.87500000 0.62500000 0.25000000 1.0 Sm Sm1 1 0.37500000 0.62500000 0.75000000 1.0 Sm Sm2 1 0.37500000 0.62500000 0.25000000 1.0 Sm Sm3 1 0.37500000 0.12500000 0.75000000 1.0 Nb Nb4 1 0.37500000 0.12500000 0.25000000 1.0 Nb Nb5 1 0.87500000 0.12500000 0.75000000 1.0 Nb Nb6 1 0.87500000 0.12500000 0.25000000 1.0 Nb Nb7 1 0.87500000 0.62500000 0.75000000 1.0 O O8 1 0.17592200 0.39843200 0.22251000 1.0 O O9 1 0.17592200 0.95341100 0.77749000 1.0 O O10 1 0.14843200 0.42592200 0.72251000 1.0 O O11 1 0.57407800 0.85156800 0.27749000 1.0 O O12 1 0.70341100 0.42592200 0.27749000 1.0 O O13 1 0.57407800 0.29658900 0.72251000 1.0 O O14 1 0.60156800 0.82407800 0.77749000 1.0 O O15 1 0.04658900 0.82407800 0.22251000 1.0