# generated using pymatgen data_Ta6Nb8Ga3As5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.52534362 _cell_length_b 7.93042571 _cell_length_c 14.27509375 _cell_angle_alpha 104.03962260 _cell_angle_beta 90.00000000 _cell_angle_gamma 102.84221525 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta6Nb8Ga3As5 _chemical_formula_sum 'Ta6 Nb8 Ga3 As5' _cell_volume 376.87518358 _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 0.00026106 0.00052112 0.99995144 1.0 Ta Ta1 1 0.49952087 0.99904275 0.50006736 1.0 Ta Ta2 1 0.42858186 0.85716272 0.82610182 1.0 Ta Ta3 1 0.57025896 0.14051892 0.17122890 1.0 Ta Ta4 1 0.19690158 0.39380416 0.30803445 1.0 Ta Ta5 1 0.80216734 0.60433467 0.69362370 1.0 Nb Nb6 1 0.20996046 0.41992091 0.79564536 1.0 Nb Nb7 1 0.79065979 0.58132059 0.20504835 1.0 Nb Nb8 1 0.33605970 0.67212040 0.03306103 1.0 Nb Nb9 1 0.66407197 0.32814493 0.96664928 1.0 Nb Nb10 1 0.00006224 0.00012547 0.66114337 1.0 Nb Nb11 1 0.00183836 0.00367871 0.33776941 1.0 Nb Nb12 1 0.17839594 0.35679088 0.54837317 1.0 Nb Nb13 1 0.82132359 0.64264919 0.45169463 1.0 Ga Ga14 1 0.17579635 0.35159071 0.10748054 1.0 Ga Ga15 1 0.82509911 0.65020121 0.89274106 1.0 Ga Ga16 1 0.36902186 0.73804671 0.59776820 1.0 As As17 1 0.63127237 0.26254575 0.40341798 1.0 As As18 1 0.37329304 0.74658508 0.33434991 1.0 As As19 1 0.62603868 0.25207936 0.66662186 1.0 As As20 1 0.06191242 0.12382484 0.84692714 1.0 As As21 1 0.93749846 0.87499491 0.15230004 1.0