# generated using pymatgen data_LiMg6Ti _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.99187600 _cell_length_b 6.39249400 _cell_length_c 10.84369800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMg6Ti _chemical_formula_sum 'Li2 Mg12 Ti2' _cell_volume 346.02823035 _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 Li Li0 1 0.50000000 0.50000000 0.83451300 1.0 Li Li1 1 0.50000000 0.00000000 0.33451300 1.0 Mg Mg2 1 0.50000000 0.25229600 0.08272500 1.0 Mg Mg3 1 0.50000000 0.74770400 0.08272500 1.0 Mg Mg4 1 0.00000000 0.24636200 0.91325000 1.0 Mg Mg5 1 0.00000000 0.75363800 0.91325000 1.0 Mg Mg6 1 0.00000000 0.50000000 0.17098400 1.0 Mg Mg7 1 0.00000000 0.50000000 0.66847300 1.0 Mg Mg8 1 0.50000000 0.75229600 0.58272500 1.0 Mg Mg9 1 0.50000000 0.24770400 0.58272500 1.0 Mg Mg10 1 0.00000000 0.74636200 0.41325000 1.0 Mg Mg11 1 0.00000000 0.25363800 0.41325000 1.0 Mg Mg12 1 0.00000000 0.00000000 0.67098400 1.0 Mg Mg13 1 0.00000000 0.00000000 0.16847300 1.0 Ti Ti14 1 0.50000000 0.50000000 0.33408300 1.0 Ti Ti15 1 0.50000000 0.00000000 0.83408300 1.0