# generated using pymatgen data_Dy3Hf(Al3Ir)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.48455715 _cell_length_b 7.47596671 _cell_length_c 9.34586851 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.60316520 _symmetry_Int_Tables_number 1 _chemical_formula_structural Dy3Hf(Al3Ir)6 _chemical_formula_sum 'Dy3 Hf1 Al18 Ir6' _cell_volume 454.68073939 _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 Dy Dy0 1 0.00542114 0.32752932 0.25000000 1.0 Dy Dy1 1 0.67116589 0.99476564 0.75000000 1.0 Dy Dy2 1 0.32934715 0.00630910 0.25000000 1.0 Hf Hf3 1 0.99589680 0.67277301 0.75000000 1.0 Al Al4 1 0.12814882 0.12489005 0.75000000 1.0 Al Al5 1 0.86982282 0.86860207 0.25000000 1.0 Al Al6 1 0.00064688 0.33806007 0.57768556 1.0 Al Al7 1 0.99892455 0.66501525 0.43040472 1.0 Al Al8 1 0.99892455 0.66501525 0.06959528 1.0 Al Al9 1 0.33230130 0.99848930 0.92228120 1.0 Al Al10 1 0.00064688 0.33806007 0.92231444 1.0 Al Al11 1 0.66468020 0.99774133 0.07343562 1.0 Al Al12 1 0.66468020 0.99774133 0.42656438 1.0 Al Al13 1 0.33230130 0.99848930 0.57771880 1.0 Al Al14 1 0.33412361 0.33429737 0.04846017 1.0 Al Al15 1 0.66898632 0.66654610 0.94311217 1.0 Al Al16 1 0.66898632 0.66654610 0.55688783 1.0 Al Al17 1 0.33412361 0.33429737 0.45153983 1.0 Al Al18 1 0.33481689 0.54844814 0.75000000 1.0 Al Al19 1 0.66044080 0.45269543 0.25000000 1.0 Al Al20 1 0.55463325 0.34498242 0.75000000 1.0 Al Al21 1 0.45164946 0.65941161 0.25000000 1.0 Ir Ir22 1 0.67276355 0.32852647 0.50141344 1.0 Ir Ir23 1 0.32767035 0.67239122 0.50198113 1.0 Ir Ir24 1 0.32767035 0.67239122 0.99801887 1.0 Ir Ir25 1 0.67276355 0.32852647 0.99858656 1.0 Ir Ir26 1 0.99923174 0.99873002 0.50183843 1.0 Ir Ir27 1 0.99923174 0.99873002 0.99816157 1.0