# generated using pymatgen data_MgTi8O16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.20360833 _cell_length_b 5.64821620 _cell_length_c 9.37788226 _cell_angle_alpha 91.93465046 _cell_angle_beta 91.09249874 _cell_angle_gamma 88.40741686 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgTi8O16 _chemical_formula_sum 'Mg1 Ti8 O16' _cell_volume 275.31746384 _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 0.54023700 0.62728600 0.59985900 1.0 Ti Ti1 1 0.09388400 0.36110800 0.63219100 1.0 Ti Ti2 1 0.65053400 0.60545700 0.89565300 1.0 Ti Ti3 1 0.38860600 0.92873800 0.35375000 1.0 Ti Ti4 1 0.89062300 0.10922000 0.12588900 1.0 Ti Ti5 1 0.91474700 0.61401500 0.37127000 1.0 Ti Ti6 1 0.38378100 0.41481400 0.13547400 1.0 Ti Ti7 1 0.63095700 0.12375300 0.63500700 1.0 Ti Ti8 1 0.14553200 0.89125200 0.87000800 1.0 O O9 1 0.45157500 0.38256800 0.73554300 1.0 O O10 1 0.93791100 0.60367200 0.76456400 1.0 O O11 1 0.05557600 0.88649700 0.26878300 1.0 O O12 1 0.55385300 0.12331800 0.23248400 1.0 O O13 1 0.54998900 0.62270100 0.26577600 1.0 O O14 1 0.05833400 0.38605300 0.23391600 1.0 O O15 1 0.95596900 0.09163400 0.73621800 1.0 O O16 1 0.46019900 0.86792600 0.76169900 1.0 O O17 1 0.82247900 0.84801700 0.99593200 1.0 O O18 1 0.29830900 0.13763400 0.50976100 1.0 O O19 1 0.69375700 0.34531900 0.01582900 1.0 O O20 1 0.20200800 0.63137700 0.49452700 1.0 O O21 1 0.19116700 0.13742900 0.00992700 1.0 O O22 1 0.69518100 0.86504000 0.48572000 1.0 O O23 1 0.31581900 0.64039700 0.98947500 1.0 O O24 1 0.78147300 0.37382400 0.50931700 1.0