# generated using pymatgen data_Ti6BeBi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.20480572 _cell_length_b 7.20480695 _cell_length_c 3.64838456 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999887 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti6BeBi2 _chemical_formula_sum 'Ti6 Be1 Bi2' _cell_volume 164.01209221 _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 0.37081522 1.00000000 0.00000000 1.0 Ti Ti1 1 0.00000000 0.37081522 0.00000000 1.0 Ti Ti2 1 0.62918478 0.62918478 0.00000000 1.0 Ti Ti3 1 0.77869346 0.00000000 0.50000000 1.0 Ti Ti4 1 0.22130654 0.22130654 0.50000000 1.0 Ti Ti5 1 1.00000000 0.77869346 0.50000000 1.0 Be Be6 1 0.00000000 0.00000000 0.00000000 1.0 Bi Bi7 1 0.66666700 0.33333400 0.50000000 1.0 Bi Bi8 1 0.33333300 0.66666600 0.50000000 1.0