# generated using pymatgen data_Ta3Zn3(IrRh2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.08154496 _cell_length_b 7.07010686 _cell_length_c 12.20749182 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00001547 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta3Zn3(IrRh2)2 _chemical_formula_sum 'Ta6 Zn6 Ir4 Rh8' _cell_volume 352.27109103 _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 0.00000086 0.50000000 0.99970734 1.0 Ta Ta1 1 0.50000259 0.00000000 0.16700748 1.0 Ta Ta2 1 0.00000175 0.50000000 0.33403035 1.0 Ta Ta3 1 0.49999945 0.00000000 0.50060616 1.0 Ta Ta4 1 0.99999776 0.50000000 0.66601702 1.0 Ta Ta5 1 0.49999808 0.00000000 0.83263907 1.0 Zn Zn6 1 0.00000067 0.00000000 0.99856407 1.0 Zn Zn7 1 0.50000319 0.50000000 0.16815920 1.0 Zn Zn8 1 0.99999966 0.00000000 0.33455745 1.0 Zn Zn9 1 0.49999980 0.50000000 0.49990676 1.0 Zn Zn10 1 0.99999794 0.00000000 0.66671148 1.0 Zn Zn11 1 0.49999800 0.50000000 0.83211772 1.0 Ir Ir12 1 0.50000112 0.24926638 0.99926633 1.0 Ir Ir13 1 0.50000112 0.75073462 0.99926633 1.0 Ir Ir14 1 0.00000281 0.25073074 0.16743581 1.0 Ir Ir15 1 0.00000281 0.74926826 0.16743581 1.0 Rh Rh16 1 0.50000123 0.25002529 0.33470561 1.0 Rh Rh17 1 0.50000123 0.74997471 0.33470561 1.0 Rh Rh18 1 0.00000013 0.24920373 0.50065575 1.0 Rh Rh19 1 0.00000013 0.75079627 0.50065575 1.0 Rh Rh20 1 0.49999894 0.25080030 0.66595950 1.0 Rh Rh21 1 0.49999894 0.74919970 0.66595950 1.0 Rh Rh22 1 0.99999740 0.24997114 0.83196194 1.0 Rh Rh23 1 0.99999740 0.75002786 0.83196194 1.0