# generated using pymatgen data_Hf3Zr6TiSn6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.43351823 _cell_length_b 8.43351971 _cell_length_c 5.71688183 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999419 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Zr6TiSn6 _chemical_formula_sum 'Hf3 Zr6 Ti1 Sn6' _cell_volume 352.13364669 _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 0.33333300 0.66666700 0.00000000 1.0 Hf Hf1 1 0.33333300 0.66666700 0.50000000 1.0 Hf Hf2 1 0.66666700 0.33333300 0.50000000 1.0 Zr Zr3 1 0.75307460 0.75511640 0.74757462 1.0 Zr Zr4 1 0.24488360 0.99795820 0.74757462 1.0 Zr Zr5 1 0.00204180 0.24692540 0.74757462 1.0 Zr Zr6 1 0.24488360 0.24692540 0.25242538 1.0 Zr Zr7 1 0.75307460 0.99795820 0.25242538 1.0 Zr Zr8 1 0.00204180 0.75511640 0.25242538 1.0 Ti Ti9 1 0.66666700 0.33333300 0.00000000 1.0 Sn Sn10 1 0.39745298 0.39286770 0.75494522 1.0 Sn Sn11 1 0.60713230 0.00458528 0.75494522 1.0 Sn Sn12 1 0.99541472 0.60254702 0.75494522 1.0 Sn Sn13 1 0.60713230 0.60254702 0.24505478 1.0 Sn Sn14 1 0.39745298 0.00458528 0.24505478 1.0 Sn Sn15 1 0.99541472 0.39286770 0.24505478 1.0