# generated using pymatgen data_Hf(Ti2Se5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.60344647 _cell_length_b 3.60345583 _cell_length_c 31.51444813 _cell_angle_alpha 89.99608027 _cell_angle_beta 89.99822215 _cell_angle_gamma 119.99725852 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf(Ti2Se5)2 _chemical_formula_sum 'Hf1 Ti4 Se10' _cell_volume 354.39665147 _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 0.00003081 -0.00006195 0.99995927 1.0 Ti Ti1 1 0.00010404 0.00002966 0.79867104 1.0 Ti Ti2 1 0.00001060 0.00006393 0.59967933 1.0 Ti Ti3 1 -0.00000635 0.99992566 0.40038040 1.0 Ti Ti4 1 0.99996784 -0.00001173 0.20130236 1.0 Se Se5 1 0.66693948 0.33354212 0.75099275 1.0 Se Se6 1 0.66685035 0.33346111 0.55194463 1.0 Se Se7 1 0.66647610 0.33336022 0.35259934 1.0 Se Se8 1 0.66662777 0.33330192 0.15358062 1.0 Se Se9 1 0.66667685 0.33320922 0.94859008 1.0 Se Se10 1 0.33357542 0.66685968 0.64742101 1.0 Se Se11 1 0.33297399 0.66646309 0.44814387 1.0 Se Se12 1 0.33310197 0.66648747 0.24900588 1.0 Se Se13 1 0.33331994 0.66666662 0.05133214 1.0 Se Se14 1 0.33335019 0.66670498 0.84639727 1.0