# generated using pymatgen data_Er16Tm3MgIr12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.67246274 _cell_length_b 10.67246274 _cell_length_c 6.25137908 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er16Tm3MgIr12 _chemical_formula_sum 'Er16 Tm3 Mg1 Ir12' _cell_volume 712.04120947 _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 0.28301488 0.08338664 0.38144696 1.0 Er Er1 1 0.29112225 0.91125189 0.88169158 1.0 Er Er2 1 0.70887775 0.08874811 0.88169158 1.0 Er Er3 1 0.71698512 0.91661336 0.38144696 1.0 Er Er4 1 0.58940738 0.79223074 0.88195175 1.0 Er Er5 1 0.58608993 0.20835110 0.37960399 1.0 Er Er6 1 0.41391007 0.79164890 0.37960399 1.0 Er Er7 1 0.41059262 0.20776926 0.88195175 1.0 Er Er8 1 0.20835110 0.41391007 0.62039601 1.0 Er Er9 1 0.20776926 0.58940738 0.11804825 1.0 Er Er10 1 0.79223074 0.41059262 0.11804825 1.0 Er Er11 1 0.79164890 0.58608993 0.62039601 1.0 Er Er12 1 0.91125189 0.70887775 0.11830842 1.0 Er Er13 1 0.91661336 0.28301488 0.61855304 1.0 Er Er14 1 0.08338664 0.71698512 0.61855304 1.0 Er Er15 1 0.08874811 0.29112225 0.11830842 1.0 Tm Tm16 1 0.00000000 0.00000000 0.00000000 1.0 Tm Tm17 1 0.50000000 0.50000000 0.00000000 1.0 Tm Tm18 1 0.50000000 0.50000000 0.50000000 1.0 Mg Mg19 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir20 1 0.84683238 0.15475762 0.24620928 1.0 Ir Ir21 1 0.84524238 0.84683238 0.75379072 1.0 Ir Ir22 1 0.15475762 0.15316762 0.75379072 1.0 Ir Ir23 1 0.15316762 0.84524238 0.24620928 1.0 Ir Ir24 1 0.65358074 0.34621916 0.74807565 1.0 Ir Ir25 1 0.65378084 0.65358074 0.25192435 1.0 Ir Ir26 1 0.34621916 0.34641926 0.25192435 1.0 Ir Ir27 1 0.34641926 0.65378084 0.74807565 1.0 Ir Ir28 1 0.50000000 0.00000000 0.12889465 1.0 Ir Ir29 1 0.50000000 0.00000000 0.62437013 1.0 Ir Ir30 1 0.00000000 0.50000000 0.87110535 1.0 Ir Ir31 1 0.00000000 0.50000000 0.37562987 1.0