# generated using pymatgen data_Hf3Ti3ZnSn4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.33397082 _cell_length_b 9.33397046 _cell_length_c 5.74979936 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999777 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Ti3ZnSn4 _chemical_formula_sum 'Hf6 Ti6 Zn2 Sn8' _cell_volume 433.82661549 _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 0.85146981 0.70293862 0.75000000 1.0 Hf Hf1 1 0.14853019 0.85146981 0.25000000 1.0 Hf Hf2 1 0.70293862 0.85146981 0.25000000 1.0 Hf Hf3 1 0.29706138 0.14853019 0.75000000 1.0 Hf Hf4 1 0.85146981 0.14853019 0.75000000 1.0 Hf Hf5 1 0.14853019 0.29706138 0.25000000 1.0 Ti Ti6 1 0.50000000 0.00000000 0.50000000 1.0 Ti Ti7 1 0.50000000 0.50000000 0.00000000 1.0 Ti Ti8 1 0.00000000 0.50000000 0.00000000 1.0 Ti Ti9 1 0.00000000 0.50000000 0.50000000 1.0 Ti Ti10 1 0.50000000 0.00000000 0.00000000 1.0 Ti Ti11 1 0.50000000 0.50000000 0.50000000 1.0 Zn Zn12 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn13 1 0.00000000 0.00000000 0.00000000 1.0 Sn Sn14 1 0.20450415 0.40900929 0.75000000 1.0 Sn Sn15 1 0.79549585 0.20450415 0.25000000 1.0 Sn Sn16 1 0.40900929 0.20450415 0.25000000 1.0 Sn Sn17 1 0.59099071 0.79549585 0.75000000 1.0 Sn Sn18 1 0.20450415 0.79549585 0.75000000 1.0 Sn Sn19 1 0.79549585 0.59099071 0.25000000 1.0 Sn Sn20 1 0.66666700 0.33333300 0.75000000 1.0 Sn Sn21 1 0.33333300 0.66666700 0.25000000 1.0