# generated using pymatgen data_Er7Sn23Ir6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.79414173 _cell_length_b 9.79414207 _cell_length_c 9.97988403 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000219 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er7Sn23Ir6 _chemical_formula_sum 'Er7 Sn23 Ir6' _cell_volume 829.06560917 _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 Er Er0 1 0.48177707 0.51822293 0.30795328 1.0 Er Er1 1 0.51822293 0.48177707 0.69204672 1.0 Er Er2 1 0.48177707 0.96355515 0.30795328 1.0 Er Er3 1 0.51822293 0.03644485 0.69204672 1.0 Er Er4 1 0.03644485 0.51822293 0.30795328 1.0 Er Er5 1 0.96355515 0.48177707 0.69204672 1.0 Er Er6 1 0.00000000 0.00000000 0.00000000 1.0 Sn Sn7 1 0.11854544 0.88145456 0.28499082 1.0 Sn Sn8 1 0.88145456 0.11854544 0.71500918 1.0 Sn Sn9 1 0.11854544 0.23708989 0.28499082 1.0 Sn Sn10 1 0.88145456 0.76291011 0.71500918 1.0 Sn Sn11 1 0.76291011 0.88145456 0.28499082 1.0 Sn Sn12 1 0.23708989 0.11854544 0.71500918 1.0 Sn Sn13 1 0.77779574 0.22220426 0.45829130 1.0 Sn Sn14 1 0.22220426 0.77779574 0.54170870 1.0 Sn Sn15 1 0.77779574 0.55559148 0.45829130 1.0 Sn Sn16 1 0.22220426 0.44440852 0.54170870 1.0 Sn Sn17 1 0.44440852 0.22220426 0.45829130 1.0 Sn Sn18 1 0.55559148 0.77779574 0.54170870 1.0 Sn Sn19 1 0.35325172 0.00000000 0.00000000 1.0 Sn Sn20 1 0.64674828 1.00000000 0.00000000 1.0 Sn Sn21 1 0.00000000 0.35325172 0.00000000 1.0 Sn Sn22 1 1.00000000 0.64674828 0.00000000 1.0 Sn Sn23 1 0.64674828 0.64674828 0.00000000 1.0 Sn Sn24 1 0.35325172 0.35325172 0.00000000 1.0 Sn Sn25 1 0.33333300 0.66666700 0.12403827 1.0 Sn Sn26 1 0.66666700 0.33333300 0.87596173 1.0 Sn Sn27 1 0.33333300 0.66666700 0.83013642 1.0 Sn Sn28 1 0.66666700 0.33333300 0.16986358 1.0 Sn Sn29 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir30 1 0.83070978 0.16929022 0.19931262 1.0 Ir Ir31 1 0.16929022 0.83070978 0.80068738 1.0 Ir Ir32 1 0.83070978 0.66142057 0.19931262 1.0 Ir Ir33 1 0.16929022 0.33857943 0.80068738 1.0 Ir Ir34 1 0.33857943 0.16929022 0.19931262 1.0 Ir Ir35 1 0.66142057 0.83070978 0.80068738 1.0