# generated using pymatgen data_Hf5Zr(Ti2Sn3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.27060620 _cell_length_b 8.27060609 _cell_length_c 5.54188394 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.31151630 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf5Zr(Ti2Sn3)2 _chemical_formula_sum 'Hf5 Zr1 Ti4 Sn6' _cell_volume 327.25846659 _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 0.24215597 0.00053138 0.75000000 1.0 Hf Hf1 1 0.00053138 0.24215597 0.75000000 1.0 Hf Hf2 1 0.23601303 0.23601303 0.25000000 1.0 Hf Hf3 1 0.75843784 0.00029048 0.25000000 1.0 Hf Hf4 1 0.00029048 0.75843784 0.25000000 1.0 Zr Zr5 1 0.76250014 0.76250014 0.75000000 1.0 Ti Ti6 1 0.66667288 0.33372606 0.00009831 1.0 Ti Ti7 1 0.33372606 0.66667288 0.00009831 1.0 Ti Ti8 1 0.33372606 0.66667288 0.49990169 1.0 Ti Ti9 1 0.66667288 0.33372606 0.49990169 1.0 Sn Sn10 1 0.39936795 0.39936795 0.75000000 1.0 Sn Sn11 1 0.60002788 0.00120191 0.75000000 1.0 Sn Sn12 1 0.00120191 0.60002788 0.75000000 1.0 Sn Sn13 1 0.59881755 0.59881755 0.25000000 1.0 Sn Sn14 1 0.39991885 0.99993713 0.25000000 1.0 Sn Sn15 1 0.99993713 0.39991885 0.25000000 1.0