# generated using pymatgen data_Ti8Pb8O23 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.95337000 _cell_length_b 11.51237100 _cell_length_c 12.54621178 _cell_angle_alpha 66.30292223 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti8Pb8O23 _chemical_formula_sum 'Ti8 Pb8 O23' _cell_volume 522.86557415 _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 Ti Ti0 1 0.50000000 0.14627900 0.73584700 1.0 Ti Ti1 1 0.50000000 0.38981400 0.24046500 1.0 Ti Ti2 1 0.50000000 0.76467200 0.98993400 1.0 Ti Ti3 1 0.50000000 0.26523800 0.99061100 1.0 Ti Ti4 1 0.50000000 0.51204300 0.49229900 1.0 Ti Ti5 1 0.50000000 0.01418700 0.48969000 1.0 Ti Ti6 1 0.50000000 0.63976300 0.74059000 1.0 Ti Ti7 1 0.50000000 0.88850000 0.24006200 1.0 Pb Pb8 1 0.00000000 0.87668100 0.74998100 1.0 Pb Pb9 1 0.00000000 0.74851400 0.50057300 1.0 Pb Pb10 1 0.00000000 0.37923100 0.75062200 1.0 Pb Pb11 1 0.00000000 0.25156200 0.49579400 1.0 Pb Pb12 1 0.00000000 0.12386400 0.24971000 1.0 Pb Pb13 1 0.00000000 0.62462000 0.25093400 1.0 Pb Pb14 1 0.00000000 0.50062700 0.00034500 1.0 Pb Pb15 1 0.00000000 0.00072600 0.99827000 1.0 O O16 1 0.50000000 0.60463400 0.59598200 1.0 O O17 1 0.50000000 0.98449600 0.84376300 1.0 O O18 1 0.50000000 0.73040100 0.84640300 1.0 O O19 1 0.50000000 0.47858500 0.84630000 1.0 O O20 1 0.50000000 0.85431400 0.59684700 1.0 O O21 1 0.50000000 0.98119200 0.34733800 1.0 O O22 1 0.50000000 0.72809900 0.34757300 1.0 O O23 1 0.50000000 0.85555600 0.09652600 1.0 O O24 1 0.50000000 0.60441800 0.09676200 1.0 O O25 1 0.50000000 0.22971300 0.84341500 1.0 O O26 1 0.50000000 0.48001000 0.34700500 1.0 O O27 1 0.50000000 0.34900000 0.60061800 1.0 O O28 1 0.50000000 0.10734100 0.59851700 1.0 O O29 1 0.50000000 0.23021500 0.34807800 1.0 O O30 1 0.50000000 0.35494000 0.09569100 1.0 O O31 1 0.50000000 0.10477300 0.09736800 1.0 O O32 1 0.00000000 0.91798300 0.22259300 1.0 O O33 1 0.00000000 0.29226800 0.96872900 1.0 O O34 1 0.00000000 0.79455200 0.97032100 1.0 O O35 1 0.00000000 0.04476500 0.47349900 1.0 O O36 1 0.00000000 0.54060100 0.47277500 1.0 O O37 1 0.00000000 0.66725200 0.72107900 1.0 O O38 1 0.00000000 0.41798700 0.22081700 1.0