# generated using pymatgen data_Ti6Bi2P _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.27000648 _cell_length_b 7.27000570 _cell_length_c 3.58840978 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999442 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti6Bi2P _chemical_formula_sum 'Ti6 Bi2 P1' _cell_volume 164.24881197 _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 1.00000000 0.23300958 0.50000000 1.0 Ti Ti1 1 0.23300958 1.00000000 0.50000000 1.0 Ti Ti2 1 0.76699042 0.76699042 0.50000000 1.0 Ti Ti3 1 0.64140497 1.00000000 0.00000000 1.0 Ti Ti4 1 0.35859503 0.35859503 0.00000000 1.0 Ti Ti5 1 1.00000000 0.64140497 0.00000000 1.0 Bi Bi6 1 0.66666700 0.33333300 0.50000000 1.0 Bi Bi7 1 0.33333300 0.66666700 0.50000000 1.0 P P8 1 0.00000000 0.00000000 0.00000000 1.0