# generated using pymatgen data_Tm20(Ir3Os)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.62789345 _cell_length_b 10.62789345 _cell_length_c 6.31252615 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm20(Ir3Os)3 _chemical_formula_sum 'Tm20 Ir9 Os3' _cell_volume 713.01320597 _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 Tm Tm0 1 0.29372710 0.08563178 0.37879632 1.0 Tm Tm1 1 0.29369363 0.91491279 0.87928660 1.0 Tm Tm2 1 0.70630637 0.08508721 0.87928660 1.0 Tm Tm3 1 0.70627290 0.91436822 0.37879632 1.0 Tm Tm4 1 0.58508721 0.79369363 0.87928660 1.0 Tm Tm5 1 0.58563178 0.20627290 0.37879632 1.0 Tm Tm6 1 0.41436822 0.79372710 0.37879632 1.0 Tm Tm7 1 0.41491279 0.20630637 0.87928660 1.0 Tm Tm8 1 0.20846972 0.41414184 0.62385627 1.0 Tm Tm9 1 0.20738069 0.58658893 0.11927944 1.0 Tm Tm10 1 0.79261931 0.41341107 0.11927944 1.0 Tm Tm11 1 0.79153028 0.58585816 0.62385627 1.0 Tm Tm12 1 0.91341107 0.70738069 0.11927944 1.0 Tm Tm13 1 0.91414184 0.29153028 0.62385627 1.0 Tm Tm14 1 0.08585816 0.70846972 0.62385627 1.0 Tm Tm15 1 0.08658893 0.29261931 0.11927944 1.0 Tm Tm16 1 0.00000000 0.00000000 0.49821037 1.0 Tm Tm17 1 0.00000000 0.00000000 0.99857339 1.0 Tm Tm18 1 0.50000000 0.50000000 0.99857339 1.0 Tm Tm19 1 0.50000000 0.50000000 0.49821037 1.0 Ir Ir20 1 0.84856284 0.15376297 0.24967476 1.0 Ir Ir21 1 0.84772702 0.84693985 0.74907932 1.0 Ir Ir22 1 0.15227298 0.15306015 0.74907932 1.0 Ir Ir23 1 0.15143716 0.84623703 0.24967476 1.0 Ir Ir24 1 0.65306015 0.34772702 0.74907932 1.0 Ir Ir25 1 0.65376297 0.65143716 0.24967476 1.0 Ir Ir26 1 0.34623703 0.34856284 0.24967476 1.0 Ir Ir27 1 0.34693985 0.65227298 0.74907932 1.0 Ir Ir28 1 0.00000000 0.50000000 0.37522580 1.0 Os Os29 1 0.50000000 0.00000000 0.12984874 1.0 Os Os30 1 0.50000000 0.00000000 0.62927105 1.0 Os Os31 1 0.00000000 0.50000000 0.87219506 1.0