# generated using pymatgen data_MgTi2O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.11490758 _cell_length_b 4.11490758 _cell_length_c 5.13653606 _cell_angle_alpha 113.62199716 _cell_angle_beta 113.62199716 _cell_angle_gamma 89.99486006 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgTi2O4 _chemical_formula_sum 'Mg1 Ti2 O4' _cell_volume 71.66308485 _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 0.12581400 0.37418600 0.75000000 1.0 Ti Ti1 1 0.37528300 0.12471700 0.25000000 1.0 Ti Ti2 1 0.62568900 0.87431100 0.75000000 1.0 O O3 1 0.62090600 0.36940500 0.74021400 1.0 O O4 1 0.37464400 0.62436000 0.24920500 1.0 O O5 1 0.13059500 0.87909400 0.75978600 1.0 O O6 1 0.87564000 0.12535600 0.25079500 1.0