# generated using pymatgen data_Ta2Nb(AlCo2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.19902716 _cell_length_b 5.91375059 _cell_length_c 12.59943121 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta2Nb(AlCo2)3 _chemical_formula_sum 'Ta4 Nb2 Al6 Co12' _cell_volume 312.86906754 _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 Ta Ta0 1 1.00000000 0.00000000 0.00009901 1.0 Ta Ta1 1 0.50010433 0.50000000 0.16672024 1.0 Ta Ta2 1 0.00010433 0.00000000 0.33328076 1.0 Ta Ta3 1 0.50000000 0.50000000 0.49990099 1.0 Nb Nb4 1 0.99990630 0.00000000 0.66669594 1.0 Nb Nb5 1 0.49990830 0.50000000 0.83330406 1.0 Al Al6 1 0.99999595 0.50000000 0.00041036 1.0 Al Al7 1 0.50014061 0.00000000 0.16682392 1.0 Al Al8 1 0.00014061 0.50000000 0.33317608 1.0 Al Al9 1 0.49999595 0.00000000 0.49958964 1.0 Al Al10 1 0.99985054 0.50000000 0.66635391 1.0 Al Al11 1 0.49985054 0.00000000 0.83364609 1.0 Co Co12 1 0.50000042 0.24921643 0.00111338 1.0 Co Co13 1 0.50000042 0.75078257 0.00111338 1.0 Co Co14 1 0.00014111 0.25014262 0.16686940 1.0 Co Co15 1 0.00014111 0.74985738 0.16686940 1.0 Co Co16 1 0.50013911 0.24985738 0.33313060 1.0 Co Co17 1 0.50013911 0.75014162 0.33313060 1.0 Co Co18 1 0.00000042 0.25078257 0.49888662 1.0 Co Co19 1 0.00000042 0.74921643 0.49888662 1.0 Co Co20 1 0.49985861 0.25099965 0.66568250 1.0 Co Co21 1 0.49985861 0.74899935 0.66568250 1.0 Co Co22 1 0.99985861 0.24900035 0.83431750 1.0 Co Co23 1 0.99985861 0.75099965 0.83431750 1.0