# generated using pymatgen data_Ta8Ti2Si6B _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.52289840 _cell_length_b 7.52289863 _cell_length_c 5.18165921 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999900 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta8Ti2Si6B _chemical_formula_sum 'Ta8 Ti2 Si6 B1' _cell_volume 253.96267283 _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 Ta Ta0 1 0.00000000 0.75480408 0.24759227 1.0 Ta Ta1 1 0.24519592 0.24519592 0.24759227 1.0 Ta Ta2 1 0.75480408 0.00000000 0.24759227 1.0 Ta Ta3 1 1.00000000 0.24519592 0.75240773 1.0 Ta Ta4 1 0.75480408 0.75480408 0.75240773 1.0 Ta Ta5 1 0.24519592 0.00000000 0.75240773 1.0 Ta Ta6 1 0.33333300 0.66666700 0.50000000 1.0 Ta Ta7 1 0.66666700 0.33333300 0.50000000 1.0 Ti Ti8 1 0.66666700 0.33333300 0.00000000 1.0 Ti Ti9 1 0.33333300 0.66666700 0.00000000 1.0 Si Si10 1 1.00000000 0.40065573 0.23979191 1.0 Si Si11 1 0.59934427 0.59934427 0.23979191 1.0 Si Si12 1 0.40065573 0.00000000 0.23979191 1.0 Si Si13 1 0.00000000 0.59934427 0.76020809 1.0 Si Si14 1 0.40065573 0.40065573 0.76020809 1.0 Si Si15 1 0.59934427 0.00000000 0.76020809 1.0 B B16 1 0.00000000 0.00000000 0.50000000 1.0