# generated using pymatgen data_Sr2HfThBi5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.91008685 _cell_length_b 9.93702342 _cell_length_c 6.64509939 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.91037349 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2HfThBi5 _chemical_formula_sum 'Sr4 Hf2 Th2 Bi10' _cell_volume 567.22766652 _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 Sr Sr0 1 0.98731834 0.60777606 0.25000000 1.0 Sr Sr1 1 0.01268166 0.39222394 0.75000000 1.0 Sr Sr2 1 0.37954227 0.39222394 0.25000000 1.0 Sr Sr3 1 0.62045773 0.60777606 0.75000000 1.0 Hf Hf4 1 0.00000000 0.00000000 0.00000000 1.0 Hf Hf5 1 0.00000000 0.00000000 0.50000000 1.0 Th Th6 1 0.62258677 0.00000000 0.25000000 1.0 Th Th7 1 0.37741323 1.00000000 0.75000000 1.0 Bi Bi8 1 0.26001254 1.00000000 0.25000000 1.0 Bi Bi9 1 0.73998746 0.00000000 0.75000000 1.0 Bi Bi10 1 0.99385307 0.24771527 0.25000000 1.0 Bi Bi11 1 0.00614693 0.75228473 0.75000000 1.0 Bi Bi12 1 0.74613780 0.75228473 0.25000000 1.0 Bi Bi13 1 0.25386220 0.24771527 0.75000000 1.0 Bi Bi14 1 0.34508704 0.69017507 0.00000000 1.0 Bi Bi15 1 0.65491296 0.30982493 0.00000000 1.0 Bi Bi16 1 0.65491296 0.30982493 0.50000000 1.0 Bi Bi17 1 0.34508704 0.69017507 0.50000000 1.0