# generated using pymatgen data_Ti4NiBi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.78205400 _cell_length_b 7.90814118 _cell_length_c 7.90813956 _cell_angle_alpha 84.75494480 _cell_angle_beta 72.40118155 _cell_angle_gamma 72.40118302 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti4NiBi2 _chemical_formula_sum 'Ti8 Ni2 Bi4' _cell_volume 271.72429084 _cell_formula_units_Z 2 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 0.08034278 0.11576328 0.72355216 1.0 Ti Ti1 1 0.80389494 0.27644784 0.11576328 1.0 Ti Ti2 1 0.30389494 0.11576328 0.27644784 1.0 Ti Ti3 1 0.58034278 0.72355216 0.11576328 1.0 Ti Ti4 1 0.19610506 0.72355216 0.88423672 1.0 Ti Ti5 1 0.91965722 0.88423672 0.27644784 1.0 Ti Ti6 1 0.41965722 0.27644784 0.88423672 1.0 Ti Ti7 1 0.69610506 0.88423672 0.72355216 1.0 Ni Ni8 1 0.75000000 -0.00000000 0.00000000 1.0 Ni Ni9 1 0.25000000 -0.00000000 0.00000000 1.0 Bi Bi10 1 0.35794788 0.78410424 0.50000000 1.0 Bi Bi11 1 0.64205212 0.21589576 0.50000000 1.0 Bi Bi12 1 0.14205212 0.50000000 0.21589576 1.0 Bi Bi13 1 0.85794788 0.50000000 0.78410424 1.0