# generated using pymatgen data_Mg5Ta6SbRu12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.42410987 _cell_length_b 6.23415713 _cell_length_c 13.25091871 _cell_angle_alpha 90.00005807 _cell_angle_beta 89.99977869 _cell_angle_gamma 90.00000651 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg5Ta6SbRu12 _chemical_formula_sum 'Mg5 Ta6 Sb1 Ru12' _cell_volume 365.46823639 _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 Mg Mg0 1 0.49998954 0.99999930 0.16812837 1.0 Mg Mg1 1 0.99998870 0.50000162 0.33451705 1.0 Mg Mg2 1 0.49999884 0.99999827 0.50003887 1.0 Mg Mg3 1 0.00001135 0.50000203 0.66549667 1.0 Mg Mg4 1 0.50000995 0.99999912 0.83185579 1.0 Ta Ta5 1 0.99999965 0.99999970 0.99998438 1.0 Ta Ta6 1 0.49998796 0.50000119 0.17296424 1.0 Ta Ta7 1 0.99999496 0.99999978 0.33598472 1.0 Ta Ta8 1 0.49999961 0.49999859 0.50000744 1.0 Ta Ta9 1 0.00000337 0.00000020 0.66402271 1.0 Ta Ta10 1 0.50001166 0.50000101 0.82702925 1.0 Sb Sb11 1 0.99999952 0.50000058 0.99998987 1.0 Ru Ru12 1 0.50000015 0.24845932 0.99998747 1.0 Ru Ru13 1 0.49999944 0.75154131 0.99998766 1.0 Ru Ru14 1 0.99999005 0.24949145 0.16680847 1.0 Ru Ru15 1 0.99998703 0.75050951 0.16680883 1.0 Ru Ru16 1 0.49999424 0.25013367 0.33320636 1.0 Ru Ru17 1 0.49999435 0.74986713 0.33320627 1.0 Ru Ru18 1 0.00000057 0.25080677 0.50000413 1.0 Ru Ru19 1 0.99999904 0.74919399 0.50000395 1.0 Ru Ru20 1 0.50000544 0.25014484 0.66679985 1.0 Ru Ru21 1 0.50000562 0.74985607 0.66679981 1.0 Ru Ru22 1 0.00001284 0.24948503 0.83318385 1.0 Ru Ru23 1 0.00001212 0.75051554 0.83318399 1.0