# generated using pymatgen data_Mg2Ti(SbRu2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.41726008 _cell_length_b 6.25697959 _cell_length_c 13.26798643 _cell_angle_alpha 89.99982859 _cell_angle_beta 89.99462302 _cell_angle_gamma 89.99954761 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2Ti(SbRu2)3 _chemical_formula_sum 'Mg4 Ti2 Sb6 Ru12' _cell_volume 366.70997714 _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 0.99891686 0.00000001 0.33237847 1.0 Mg Mg1 1 0.49981716 0.50000072 0.50110889 1.0 Mg Mg2 1 0.00090085 0.99999537 0.66547363 1.0 Mg Mg3 1 0.50074356 0.50000390 0.83426059 1.0 Ti Ti4 1 0.00000426 0.99999998 0.99851390 1.0 Ti Ti5 1 0.49981823 0.50000244 0.16835403 1.0 Sb Sb6 1 0.00001492 0.50000250 0.99778226 1.0 Sb Sb7 1 0.49992295 0.00000259 0.16899105 1.0 Sb Sb8 1 0.99946181 0.50000196 0.33661481 1.0 Sb Sb9 1 0.49995486 0.99999716 0.50174949 1.0 Sb Sb10 1 0.00013871 0.50000739 0.66476889 1.0 Sb Sb11 1 0.50051175 0.99997900 0.82999448 1.0 Ru Ru12 1 0.50000347 0.24520260 0.00333334 1.0 Ru Ru13 1 0.49999965 0.75480082 0.00333323 1.0 Ru Ru14 1 0.99984677 0.25480889 0.16350612 1.0 Ru Ru15 1 0.99985018 0.74519445 0.16350546 1.0 Ru Ru16 1 0.49959172 0.25384093 0.32888613 1.0 Ru Ru17 1 0.49958718 0.74615869 0.32888659 1.0 Ru Ru18 1 0.99992254 0.24830829 0.49838533 1.0 Ru Ru19 1 0.99992266 0.75168883 0.49838603 1.0 Ru Ru20 1 0.50026063 0.25169283 0.66810315 1.0 Ru Ru21 1 0.50026026 0.74830340 0.66810299 1.0 Ru Ru22 1 0.00027279 0.24614762 0.83778932 1.0 Ru Ru23 1 0.00027425 0.75385364 0.83778982 1.0