# generated using pymatgen data_Mg2Ta(NbOs2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.47335387 _cell_length_b 6.31844105 _cell_length_c 13.37920376 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.99976531 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2Ta(NbOs2)3 _chemical_formula_sum 'Mg4 Ta2 Nb6 Os12' _cell_volume 378.15814651 _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 Mg Mg0 1 0.99996064 0.50000000 0.33518395 1.0 Mg Mg1 1 0.49999957 0.00000000 0.50122160 1.0 Mg Mg2 1 0.00001837 0.50000000 0.66548781 1.0 Mg Mg3 1 0.50003667 0.00000000 0.83148168 1.0 Ta Ta4 1 0.99999873 0.50000000 0.99631867 1.0 Ta Ta5 1 0.49998282 0.00000000 0.17032255 1.0 Nb Nb6 1 0.99999689 0.00000000 0.99344876 1.0 Nb Nb7 1 0.49998864 0.50000000 0.17319034 1.0 Nb Nb8 1 0.99998769 0.00000000 0.34355842 1.0 Nb Nb9 1 0.50000189 0.50000000 0.50283193 1.0 Nb Nb10 1 0.00001742 0.00000000 0.66385890 1.0 Nb Nb11 1 0.50001528 0.50000000 0.82311638 1.0 Os Os12 1 0.49999769 0.25314844 0.00348848 1.0 Os Os13 1 0.49999769 0.74685156 0.00348848 1.0 Os Os14 1 0.99998707 0.24685325 0.16314692 1.0 Os Os15 1 0.99998707 0.75314675 0.16314692 1.0 Os Os16 1 0.49998384 0.24780775 0.32962573 1.0 Os Os17 1 0.49998384 0.75219225 0.32962573 1.0 Os Os18 1 0.00000028 0.25025328 0.49975099 1.0 Os Os19 1 0.00000028 0.74974772 0.49975099 1.0 Os Os20 1 0.50001458 0.24975378 0.66694412 1.0 Os Os21 1 0.50001458 0.75024622 0.66694412 1.0 Os Os22 1 0.00001524 0.25218908 0.83703376 1.0 Os Os23 1 0.00001524 0.74781092 0.83703376 1.0