# generated using pymatgen data_Ta5B6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.14929914 _cell_length_b 3.28700842 _cell_length_c 11.44303366 _cell_angle_alpha 90.00000000 _cell_angle_beta 97.90945079 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta5B6 _chemical_formula_sum 'Ta5 B6' _cell_volume 117.32878927 _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 0.19434955 0.50000000 0.38869910 1.0 Ta Ta1 1 0.80565045 0.50000000 0.61130090 1.0 Ta Ta2 1 0.38561586 -0.00000000 0.77122871 1.0 Ta Ta3 1 0.61438414 0.00000000 0.22877129 1.0 Ta Ta4 1 -0.00000000 -0.00000000 0.00000000 1.0 B B5 1 0.46038993 0.50000000 0.92077785 1.0 B B6 1 0.53961007 0.50000000 0.07922215 1.0 B B7 1 0.27328549 -0.00000000 0.54657198 1.0 B B8 1 0.72671451 -0.00000000 0.45342802 1.0 B B9 1 0.08246733 0.50000000 0.16493566 1.0 B B10 1 0.91753267 0.50000000 0.83506434 1.0