# generated using pymatgen data_Ti(SnO2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.53328795 _cell_length_b 8.53328795 _cell_length_c 5.93015972 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti(SnO2)2 _chemical_formula_sum 'Ti4 Sn8 O16' _cell_volume 431.81645953 _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 Ti Ti0 1 0.00000000 0.50000000 0.25000000 1.0 Ti Ti1 1 0.50000000 0.00000000 0.75000000 1.0 Ti Ti2 1 0.00000000 0.50000000 0.75000000 1.0 Ti Ti3 1 0.50000000 0.00000000 0.25000000 1.0 Sn Sn4 1 0.35253059 0.33723711 0.50000000 1.0 Sn Sn5 1 0.64746941 0.66276289 0.50000000 1.0 Sn Sn6 1 0.66276289 0.35253059 -0.00000000 1.0 Sn Sn7 1 0.33723711 0.64746941 0.00000000 1.0 Sn Sn8 1 0.83723711 0.85253059 -0.00000000 1.0 Sn Sn9 1 0.85253059 0.16276289 0.50000000 1.0 Sn Sn10 1 0.14746941 0.83723711 0.50000000 1.0 Sn Sn11 1 0.16276289 0.14746941 0.00000000 1.0 O O12 1 0.40230100 0.88022950 0.50000000 1.0 O O13 1 0.59769900 0.11977050 0.50000000 1.0 O O14 1 0.11977050 0.40230100 0.00000000 1.0 O O15 1 0.88022950 0.59769900 -0.00000000 1.0 O O16 1 0.38022950 0.90230100 -0.00000000 1.0 O O17 1 0.90230100 0.61977050 0.50000000 1.0 O O18 1 0.09769900 0.38022950 0.50000000 1.0 O O19 1 0.61977050 0.09769900 0.00000000 1.0 O O20 1 0.16357186 0.66357186 0.75000000 1.0 O O21 1 0.66357186 0.83642814 0.25000000 1.0 O O22 1 0.33642814 0.16357186 0.25000000 1.0 O O23 1 0.83642814 0.33642814 0.75000000 1.0 O O24 1 0.16357186 0.66357186 0.25000000 1.0 O O25 1 0.66357186 0.83642814 0.75000000 1.0 O O26 1 0.33642814 0.16357186 0.75000000 1.0 O O27 1 0.83642814 0.33642814 0.25000000 1.0