# generated using pymatgen data_HfTh3(Ga3Pd)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.50808347 _cell_length_b 8.50808280 _cell_length_c 8.50808239 _cell_angle_alpha 89.80889031 _cell_angle_beta 89.80889667 _cell_angle_gamma 89.80890028 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfTh3(Ga3Pd)8 _chemical_formula_sum 'Hf1 Th3 Ga24 Pd8' _cell_volume 615.86837792 _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 Hf Hf0 1 0.50000000 0.50000000 0.50000000 1.0 Th Th1 1 0.00000000 0.50000000 0.00000000 1.0 Th Th2 1 0.50000000 0.00000000 0.00000000 1.0 Th Th3 1 0.00000000 0.00000000 0.50000000 1.0 Ga Ga4 1 0.99162150 0.64156251 0.64156251 1.0 Ga Ga5 1 0.64156251 0.64156251 0.99162150 1.0 Ga Ga6 1 0.64156251 0.99162150 0.64156251 1.0 Ga Ga7 1 0.00837850 0.35843749 0.35843749 1.0 Ga Ga8 1 0.35843749 0.35843749 0.00837850 1.0 Ga Ga9 1 0.35843749 0.00837850 0.35843749 1.0 Ga Ga10 1 0.73577718 0.50000000 0.26422282 1.0 Ga Ga11 1 0.26422282 0.50000000 0.73577718 1.0 Ga Ga12 1 0.50000000 0.26422282 0.73577718 1.0 Ga Ga13 1 0.50000000 0.73577718 0.26422282 1.0 Ga Ga14 1 0.26422282 0.73577718 0.50000000 1.0 Ga Ga15 1 0.73577718 0.26422282 0.50000000 1.0 Ga Ga16 1 0.83992994 0.13945010 0.83992994 1.0 Ga Ga17 1 0.13945010 0.83992994 0.83992994 1.0 Ga Ga18 1 0.83992994 0.83992994 0.13945010 1.0 Ga Ga19 1 0.16007006 0.86054990 0.16007006 1.0 Ga Ga20 1 0.86054990 0.16007006 0.16007006 1.0 Ga Ga21 1 0.16007006 0.16007006 0.86054990 1.0 Ga Ga22 1 0.73233313 0.49007115 0.73233313 1.0 Ga Ga23 1 0.49007115 0.73233313 0.73233313 1.0 Ga Ga24 1 0.73233313 0.73233313 0.49007115 1.0 Ga Ga25 1 0.26766687 0.50992885 0.26766687 1.0 Ga Ga26 1 0.50992885 0.26766687 0.26766687 1.0 Ga Ga27 1 0.26766687 0.26766687 0.50992885 1.0 Pd Pd28 1 0.83672327 0.83672327 0.83672327 1.0 Pd Pd29 1 0.16327673 0.16327673 0.16327673 1.0 Pd Pd30 1 0.66692849 0.33307151 1.00000000 1.0 Pd Pd31 1 0.00000000 0.33307151 0.66692849 1.0 Pd Pd32 1 0.33307151 0.00000000 0.66692849 1.0 Pd Pd33 1 0.33307151 0.66692849 0.00000000 1.0 Pd Pd34 1 1.00000000 0.66692849 0.33307151 1.0 Pd Pd35 1 0.66692849 1.00000000 0.33307151 1.0