# generated using pymatgen data_MgTi _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.90237600 _cell_length_b 5.24795200 _cell_length_c 6.05732000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgTi _chemical_formula_sum 'Mg4 Ti4' _cell_volume 155.83930012 _cell_formula_units_Z 4 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 0.25000000 0.08374500 0.87480800 1.0 Mg Mg1 1 0.25000000 0.58374500 0.62519200 1.0 Mg Mg2 1 0.75000000 0.41625500 0.37480800 1.0 Mg Mg3 1 0.75000000 0.91625500 0.12519200 1.0 Ti Ti4 1 0.25000000 0.08463800 0.37430100 1.0 Ti Ti5 1 0.25000000 0.58463800 0.12569900 1.0 Ti Ti6 1 0.75000000 0.41536200 0.87430100 1.0 Ti Ti7 1 0.75000000 0.91536200 0.62569900 1.0