# generated using pymatgen data_InBi3Te4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.46782200 _cell_length_b 7.69950900 _cell_length_c 24.28373274 _cell_angle_alpha 89.46069465 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural InBi3Te4 _chemical_formula_sum 'In3 Bi9 Te12' _cell_volume 835.32426768 _cell_formula_units_Z 3 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 In In0 1 0.50000000 0.99946800 0.12152800 1.0 In In1 1 0.00000000 0.50037700 0.12123100 1.0 In In2 1 0.50000000 0.00078000 0.87809500 1.0 Bi Bi3 1 0.00000000 0.50076200 0.87637000 1.0 Bi Bi4 1 0.50000000 0.66595200 0.53482700 1.0 Bi Bi5 1 0.00000000 0.16640700 0.53482900 1.0 Bi Bi6 1 0.00000000 0.83454600 0.46495300 1.0 Bi Bi7 1 0.50000000 0.33350200 0.46459000 1.0 Bi Bi8 1 0.50000000 0.66673200 0.28943600 1.0 Bi Bi9 1 0.00000000 0.16671700 0.28908200 1.0 Bi Bi10 1 0.00000000 0.83321200 0.70984900 1.0 Bi Bi11 1 0.50000000 0.33379500 0.71026700 1.0 Te Te12 1 0.50000000 0.67188100 0.79185800 1.0 Te Te13 1 0.00000000 0.15860100 0.79409100 1.0 Te Te14 1 0.00000000 0.83380700 0.20523800 1.0 Te Te15 1 0.50000000 0.33348600 0.20513200 1.0 Te Te16 1 0.50000000 0.66824900 0.06151300 1.0 Te Te17 1 0.00000000 0.16665600 0.06209600 1.0 Te Te18 1 0.00000000 0.83925700 0.94143800 1.0 Te Te19 1 0.50000000 0.32742000 0.94439300 1.0 Te Te20 1 0.50000000 0.99844400 0.36186800 1.0 Te Te21 1 0.00000000 0.49820500 0.36210300 1.0 Te Te22 1 0.50000000 0.00093300 0.63743500 1.0 Te Te23 1 0.00000000 0.50081100 0.63777800 1.0