# generated using pymatgen data_Nb3FeOs2N _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.25997276 _cell_length_b 8.25997178 _cell_length_c 8.25997253 _cell_angle_alpha 59.99999701 _cell_angle_beta 60.00000092 _cell_angle_gamma 59.99999670 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb3FeOs2N _chemical_formula_sum 'Nb12 Fe4 Os8 N4' _cell_volume 398.49306310 _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 Nb Nb0 1 0.80617702 0.80617702 0.19382298 1.0 Nb Nb1 1 0.19382298 0.19382298 0.80617702 1.0 Nb Nb2 1 0.80617702 0.19382298 0.80617702 1.0 Nb Nb3 1 0.19382298 0.80617702 0.19382298 1.0 Nb Nb4 1 0.19382298 0.80617702 0.80617702 1.0 Nb Nb5 1 0.80617702 0.19382298 0.19382298 1.0 Nb Nb6 1 0.44382298 0.44382298 0.05617702 1.0 Nb Nb7 1 0.05617702 0.05617702 0.44382298 1.0 Nb Nb8 1 0.44382298 0.05617702 0.44382298 1.0 Nb Nb9 1 0.05617702 0.44382298 0.05617702 1.0 Nb Nb10 1 0.05617702 0.44382298 0.44382298 1.0 Nb Nb11 1 0.44382298 0.05617702 0.05617702 1.0 Fe Fe12 1 0.12500000 0.62500000 0.62500000 1.0 Fe Fe13 1 0.62500000 0.12500000 0.62500000 1.0 Fe Fe14 1 0.62500000 0.62500000 0.12500000 1.0 Fe Fe15 1 0.62500000 0.62500000 0.62500000 1.0 Os Os16 1 0.74907077 0.41697674 0.41697674 1.0 Os Os17 1 0.41697674 0.74907077 0.41697674 1.0 Os Os18 1 0.41697674 0.41697674 0.74907077 1.0 Os Os19 1 0.41697674 0.41697674 0.41697674 1.0 Os Os20 1 0.50092923 0.83302326 0.83302326 1.0 Os Os21 1 0.83302326 0.50092923 0.83302326 1.0 Os Os22 1 0.83302326 0.83302326 0.50092923 1.0 Os Os23 1 0.83302326 0.83302326 0.83302326 1.0 N N24 1 0.62500000 0.12500000 0.12500000 1.0 N N25 1 0.12500000 0.62500000 0.12500000 1.0 N N26 1 0.12500000 0.12500000 0.62500000 1.0 N N27 1 0.12500000 0.12500000 0.12500000 1.0