# generated using pymatgen data_Hf3Ti2ReSn2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.20555343 _cell_length_b 8.20555475 _cell_length_c 5.54471044 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 121.78472575 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Ti2ReSn2 _chemical_formula_sum 'Hf6 Ti4 Re2 Sn4' _cell_volume 317.34419241 _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 Hf Hf0 1 0.24970546 0.02764313 0.25000000 1.0 Hf Hf1 1 0.75029454 0.97235687 0.75000000 1.0 Hf Hf2 1 0.02764313 0.24970546 0.25000000 1.0 Hf Hf3 1 0.97235687 0.75029454 0.75000000 1.0 Hf Hf4 1 0.75564502 0.75564502 0.25000000 1.0 Hf Hf5 1 0.24435498 0.24435498 0.75000000 1.0 Ti Ti6 1 0.34840424 0.65159576 0.00000000 1.0 Ti Ti7 1 0.65159576 0.34840424 0.00000000 1.0 Ti Ti8 1 0.65159576 0.34840424 0.50000000 1.0 Ti Ti9 1 0.34840424 0.65159576 0.50000000 1.0 Re Re10 1 0.41111892 0.41111892 0.25000000 1.0 Re Re11 1 0.58888108 0.58888108 0.75000000 1.0 Sn Sn12 1 0.61031420 0.01365622 0.25000000 1.0 Sn Sn13 1 0.38968580 0.98634378 0.75000000 1.0 Sn Sn14 1 0.01365622 0.61031420 0.25000000 1.0 Sn Sn15 1 0.98634378 0.38968580 0.75000000 1.0