# generated using pymatgen data_Hf4TiSi4Mo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.49681740 _cell_length_b 6.91272720 _cell_length_c 8.21423674 _cell_angle_alpha 90.29812023 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4TiSi4Mo3 _chemical_formula_sum 'Hf4 Ti1 Si4 Mo3' _cell_volume 198.55631758 _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 0.25000000 0.03951587 0.32993313 1.0 Hf Hf1 1 0.75000000 0.95475023 0.66519873 1.0 Hf Hf2 1 0.25000000 0.54552947 0.16558915 1.0 Hf Hf3 1 0.75000000 0.45374149 0.83351083 1.0 Ti Ti4 1 0.75000000 0.37359539 0.43893079 1.0 Si Si5 1 0.25000000 0.25538391 0.63917908 1.0 Si Si6 1 0.75000000 0.74438989 0.36347999 1.0 Si Si7 1 0.25000000 0.75701504 0.86254225 1.0 Si Si8 1 0.75000000 0.24430488 0.13871241 1.0 Mo Mo9 1 0.25000000 0.63334116 0.56224303 1.0 Mo Mo10 1 0.75000000 0.86724742 0.06176546 1.0 Mo Mo11 1 0.25000000 0.13118525 0.93891614 1.0