# generated using pymatgen data_TeO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.41754019 _cell_length_b 5.62679509 _cell_length_c 12.31044051 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TeO2 _chemical_formula_sum 'Te8 O16' _cell_volume 375.26394118 _cell_formula_units_Z 8 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 Te Te0 1 0.52298075 0.12026414 0.38355450 1.0 Te Te1 1 0.02298075 0.37973586 0.61644550 1.0 Te Te2 1 0.47701925 0.62026414 0.11644550 1.0 Te Te3 1 0.97701925 0.87973586 0.88355450 1.0 Te Te4 1 0.47701925 0.87973586 0.61644550 1.0 Te Te5 1 0.97701925 0.62026414 0.38355450 1.0 Te Te6 1 0.52298075 0.37973586 0.88355450 1.0 Te Te7 1 0.02298075 0.12026414 0.11644550 1.0 O O8 1 0.72066706 0.41192524 0.33483723 1.0 O O9 1 0.22066706 0.08807476 0.66516277 1.0 O O10 1 0.27933294 0.91192524 0.16516277 1.0 O O11 1 0.77933294 0.58807476 0.83483723 1.0 O O12 1 0.27933294 0.58807476 0.66516277 1.0 O O13 1 0.77933294 0.91192524 0.33483723 1.0 O O14 1 0.72066706 0.08807476 0.83483723 1.0 O O15 1 0.22066706 0.41192524 0.16516277 1.0 O O16 1 0.35837531 0.66605270 0.97253835 1.0 O O17 1 0.85837531 0.83394730 0.02746165 1.0 O O18 1 0.64162469 0.16605270 0.52746165 1.0 O O19 1 0.14162469 0.33394730 0.47253935 1.0 O O20 1 0.64162469 0.33394730 0.02746165 1.0 O O21 1 0.14162469 0.16605270 0.97253835 1.0 O O22 1 0.35837531 0.83394730 0.47253935 1.0 O O23 1 0.85837531 0.66605270 0.52746165 1.0