# generated using pymatgen data_Hf3ZrScSn3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.42477662 _cell_length_b 8.46298195 _cell_length_c 5.78231626 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.15010597 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3ZrScSn3 _chemical_formula_sum 'Hf6 Zr2 Sc2 Sn6' _cell_volume 356.49660075 _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 1.00000000 0.25281083 0.75000000 1.0 Hf Hf1 1 0.00000000 0.75168839 0.25000000 1.0 Hf Hf2 1 0.66721097 0.33180073 0.00031152 1.0 Hf Hf3 1 0.33278903 0.66459077 0.00031152 1.0 Hf Hf4 1 0.33278903 0.66459077 0.49968848 1.0 Hf Hf5 1 0.66721097 0.33180073 0.49968848 1.0 Zr Zr6 1 0.24199790 0.24268438 0.25000000 1.0 Zr Zr7 1 0.75800210 0.00068648 0.25000000 1.0 Sc Sc8 1 0.75592041 0.75723873 0.75000000 1.0 Sc Sc9 1 0.24407959 0.00131931 0.75000000 1.0 Sn Sn10 1 0.39281547 0.39156397 0.75000000 1.0 Sn Sn11 1 0.60718453 0.99874750 0.75000000 1.0 Sn Sn12 1 0.00000000 0.61106596 0.75000000 1.0 Sn Sn13 1 0.60932292 0.60779415 0.25000000 1.0 Sn Sn14 1 0.39067708 0.99847123 0.25000000 1.0 Sn Sn15 1 1.00000000 0.39314306 0.25000000 1.0