# generated using pymatgen data_Mg14TiFe _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.29007290 _cell_length_b 6.11577672 _cell_length_c 9.98691788 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.08753114 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg14TiFe _chemical_formula_sum 'Mg14 Ti1 Fe1' _cell_volume 335.72957784 _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 0.16497812 0.33248856 0.62500000 1.0 Mg Mg1 1 0.16890513 0.83445206 0.62500000 1.0 Mg Mg2 1 0.66129558 0.33595772 0.12500000 1.0 Mg Mg3 1 0.66274548 0.32929648 0.62500000 1.0 Mg Mg4 1 0.66129558 0.82533686 0.12500000 1.0 Mg Mg5 1 0.66274548 0.83344800 0.62500000 1.0 Mg Mg6 1 0.32714562 0.16760745 0.35885470 1.0 Mg Mg7 1 0.32714562 0.16760745 0.89114530 1.0 Mg Mg8 1 0.32714562 0.65953916 0.35885470 1.0 Mg Mg9 1 0.32714562 0.65953916 0.89114530 1.0 Mg Mg10 1 0.85387854 0.17693977 0.35748215 1.0 Mg Mg11 1 0.85387854 0.17693977 0.89251785 1.0 Mg Mg12 1 0.84406817 0.67203459 0.37526671 1.0 Mg Mg13 1 0.84406817 0.67203459 0.87473329 1.0 Ti Ti14 1 0.15184786 0.82592343 0.12500000 1.0 Fe Fe15 1 0.16171088 0.33085494 0.12500000 1.0