# generated using pymatgen data_Hf2TiMo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.28073332 _cell_length_b 5.39708360 _cell_length_c 5.28073353 _cell_angle_alpha 60.71060538 _cell_angle_beta 59.99999865 _cell_angle_gamma 60.71061280 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf2TiMo3 _chemical_formula_sum 'Hf2 Ti1 Mo3' _cell_volume 107.55107605 _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 0.50114777 0.49655668 0.50114777 1.0 Hf Hf1 1 0.74885223 0.75344332 0.74885223 1.0 Ti Ti2 1 0.12500000 0.62500000 0.12500000 1.0 Mo Mo3 1 0.12500000 0.12500000 0.12500000 1.0 Mo Mo4 1 0.62500000 0.12500000 0.12500000 1.0 Mo Mo5 1 0.12500000 0.12500000 0.62500000 1.0