# generated using pymatgen data_HfTa(GaIr2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.13893082 _cell_length_b 7.26604408 _cell_length_c 12.21157905 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00002097 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfTa(GaIr2)2 _chemical_formula_sum 'Hf3 Ta3 Ga6 Ir12' _cell_volume 367.24679986 _cell_formula_units_Z 3 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 Hf Hf0 1 0.49999608 0.00000000 0.49772596 1.0 Hf Hf1 1 0.99999320 0.49999900 0.66668870 1.0 Hf Hf2 1 0.49999991 0.00000000 0.83563222 1.0 Ta Ta3 1 0.00000304 0.49999900 0.00159506 1.0 Ta Ta4 1 0.50000291 0.00000000 0.16663408 1.0 Ta Ta5 1 0.99999986 0.49999900 0.33170733 1.0 Ga Ga6 1 0.00000551 0.00000000 0.00154010 1.0 Ga Ga7 1 0.49999573 0.49999900 0.16660760 1.0 Ga Ga8 1 0.00001704 0.00000000 0.33176713 1.0 Ga Ga9 1 0.49999516 0.49999900 0.49924828 1.0 Ga Ga10 1 0.99999735 0.00000000 0.66670939 1.0 Ga Ga11 1 0.49999838 0.49999900 0.83413640 1.0 Ir Ir12 1 0.50000211 0.25837047 0.00423636 1.0 Ir Ir13 1 0.50000211 0.74162953 0.00423636 1.0 Ir Ir14 1 0.00000856 0.24547896 0.16665276 1.0 Ir Ir15 1 0.00000856 0.75452204 0.16665276 1.0 Ir Ir16 1 0.49999905 0.25839604 0.32907765 1.0 Ir Ir17 1 0.49999905 0.74160396 0.32907765 1.0 Ir Ir18 1 0.99999570 0.25192526 0.49549243 1.0 Ir Ir19 1 0.99999570 0.74807474 0.49549243 1.0 Ir Ir20 1 0.49999281 0.24998857 0.66668735 1.0 Ir Ir21 1 0.49999281 0.75001143 0.66668735 1.0 Ir Ir22 1 0.99999819 0.25190172 0.83786032 1.0 Ir Ir23 1 0.99999819 0.74809928 0.83786032 1.0