# generated using pymatgen data_TbEr6Sn23Ir6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.79914065 _cell_length_b 9.79914029 _cell_length_c 9.97844906 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000122 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbEr6Sn23Ir6 _chemical_formula_sum 'Tb1 Er6 Sn23 Ir6' _cell_volume 829.79275334 _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 Tb Tb0 1 0.00000000 0.00000000 0.00000000 1.0 Er Er1 1 0.48186562 0.51813438 0.30791870 1.0 Er Er2 1 0.51813438 0.48186562 0.69208130 1.0 Er Er3 1 0.48186562 0.96373224 0.30791870 1.0 Er Er4 1 0.51813438 0.03626776 0.69208130 1.0 Er Er5 1 0.03626776 0.51813438 0.30791870 1.0 Er Er6 1 0.96373224 0.48186562 0.69208130 1.0 Sn Sn7 1 0.11857746 0.88142254 0.28547156 1.0 Sn Sn8 1 0.88142254 0.11857746 0.71452844 1.0 Sn Sn9 1 0.11857746 0.23715292 0.28547156 1.0 Sn Sn10 1 0.88142254 0.76284708 0.71452844 1.0 Sn Sn11 1 0.76284708 0.88142254 0.28547156 1.0 Sn Sn12 1 0.23715292 0.11857746 0.71452844 1.0 Sn Sn13 1 0.77778963 0.22221037 0.45838942 1.0 Sn Sn14 1 0.22221037 0.77778963 0.54161058 1.0 Sn Sn15 1 0.77778963 0.55557826 0.45838942 1.0 Sn Sn16 1 0.22221037 0.44442174 0.54161058 1.0 Sn Sn17 1 0.44442174 0.22221037 0.45838942 1.0 Sn Sn18 1 0.55557826 0.77778963 0.54161058 1.0 Sn Sn19 1 0.35328440 0.00000000 0.00000000 1.0 Sn Sn20 1 0.64671560 0.00000000 0.00000000 1.0 Sn Sn21 1 0.00000000 0.35328440 0.00000000 1.0 Sn Sn22 1 1.00000000 0.64671560 0.00000000 1.0 Sn Sn23 1 0.64671560 0.64671560 0.00000000 1.0 Sn Sn24 1 0.35328440 0.35328440 0.00000000 1.0 Sn Sn25 1 0.33333300 0.66666700 0.12417909 1.0 Sn Sn26 1 0.66666700 0.33333300 0.87582091 1.0 Sn Sn27 1 0.33333300 0.66666700 0.83022692 1.0 Sn Sn28 1 0.66666700 0.33333300 0.16977308 1.0 Sn Sn29 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir30 1 0.83045469 0.16954531 0.19965831 1.0 Ir Ir31 1 0.16954531 0.83045469 0.80034169 1.0 Ir Ir32 1 0.83045469 0.66091138 0.19965831 1.0 Ir Ir33 1 0.16954531 0.33908862 0.80034169 1.0 Ir Ir34 1 0.33908862 0.16954531 0.19965831 1.0 Ir Ir35 1 0.66091138 0.83045469 0.80034169 1.0