# generated using pymatgen data_Ta6Al3Zn8Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.71525337 _cell_length_b 8.71525177 _cell_length_c 8.10282809 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999129 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta6Al3Zn8Ir _chemical_formula_sum 'Ta12 Al6 Zn16 Ir2' _cell_volume 533.00004984 _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 0.33157397 1.00000000 0.06911450 1.0 Ta Ta1 1 0.66842603 0.00000000 0.93088550 1.0 Ta Ta2 1 1.00000000 0.33157397 0.06911450 1.0 Ta Ta3 1 0.66842603 0.00000000 0.56911450 1.0 Ta Ta4 1 1.00000000 0.33157397 0.43088550 1.0 Ta Ta5 1 0.00000000 0.66842603 0.93088550 1.0 Ta Ta6 1 0.33157397 1.00000000 0.43088550 1.0 Ta Ta7 1 0.00000000 0.66842603 0.56911450 1.0 Ta Ta8 1 0.66842603 0.66842603 0.06911450 1.0 Ta Ta9 1 0.33157397 0.33157397 0.93088550 1.0 Ta Ta10 1 0.33157397 0.33157397 0.56911450 1.0 Ta Ta11 1 0.66842603 0.66842603 0.43088550 1.0 Al Al12 1 0.17307108 0.00000000 0.75000000 1.0 Al Al13 1 0.82692892 1.00000000 0.25000000 1.0 Al Al14 1 0.00000000 0.17307108 0.75000000 1.0 Al Al15 1 1.00000000 0.82692892 0.25000000 1.0 Al Al16 1 0.82692892 0.82692892 0.75000000 1.0 Al Al17 1 0.17307108 0.17307108 0.25000000 1.0 Zn Zn18 1 0.16198233 0.49651865 0.75000000 1.0 Zn Zn19 1 0.83801767 0.50348135 0.25000000 1.0 Zn Zn20 1 0.50348135 0.66546467 0.75000000 1.0 Zn Zn21 1 0.49651865 0.16198233 0.75000000 1.0 Zn Zn22 1 0.49651865 0.33453533 0.25000000 1.0 Zn Zn23 1 0.50348135 0.83801767 0.25000000 1.0 Zn Zn24 1 0.33453533 0.83801767 0.75000000 1.0 Zn Zn25 1 0.66546467 0.50348135 0.75000000 1.0 Zn Zn26 1 0.66546467 0.16198233 0.25000000 1.0 Zn Zn27 1 0.33453533 0.49651865 0.25000000 1.0 Zn Zn28 1 0.83801767 0.33453533 0.75000000 1.0 Zn Zn29 1 0.16198233 0.66546467 0.25000000 1.0 Zn Zn30 1 0.33333300 0.66666700 0.50000000 1.0 Zn Zn31 1 0.66666700 0.33333300 0.50000000 1.0 Zn Zn32 1 0.66666700 0.33333300 0.00000000 1.0 Zn Zn33 1 0.33333300 0.66666700 0.00000000 1.0 Ir Ir34 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.00000000 1.0