# generated using pymatgen data_Tm5Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.26796150 _cell_length_b 10.66985193 _cell_length_c 10.66985193 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm5Ir3 _chemical_formula_sum 'Tm20 Ir12' _cell_volume 713.58071656 _cell_formula_units_Z 4 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 0.38026279 0.83737860 0.54152634 1.0 Tm Tm1 1 0.88026279 0.66262140 0.54152634 1.0 Tm Tm2 1 0.88026279 0.83737860 0.95847366 1.0 Tm Tm3 1 0.38026279 0.66262140 0.95847366 1.0 Tm Tm4 1 0.88026279 0.54152634 0.83737860 1.0 Tm Tm5 1 0.38026279 0.95847366 0.83737860 1.0 Tm Tm6 1 0.38026279 0.54152634 0.66262140 1.0 Tm Tm7 1 0.88026279 0.95847366 0.66262140 1.0 Tm Tm8 1 0.61973721 0.16262140 0.45847366 1.0 Tm Tm9 1 0.11973721 0.33737860 0.45847366 1.0 Tm Tm10 1 0.11973721 0.16262140 0.04152634 1.0 Tm Tm11 1 0.61973721 0.33737860 0.04152634 1.0 Tm Tm12 1 0.11973721 0.45847366 0.16262140 1.0 Tm Tm13 1 0.61973721 0.04152634 0.16262140 1.0 Tm Tm14 1 0.61973721 0.45847366 0.33737860 1.0 Tm Tm15 1 0.11973721 0.04152634 0.33737860 1.0 Tm Tm16 1 0.50000000 0.75000000 0.25000000 1.0 Tm Tm17 1 0.00000000 0.75000000 0.25000000 1.0 Tm Tm18 1 0.00000000 0.25000000 0.75000000 1.0 Tm Tm19 1 0.50000000 0.25000000 0.75000000 1.0 Ir Ir20 1 0.25000000 0.90361793 0.09638207 1.0 Ir Ir21 1 0.75000000 0.59638207 0.09638207 1.0 Ir Ir22 1 0.75000000 0.90361793 0.40361793 1.0 Ir Ir23 1 0.25000000 0.59638207 0.40361793 1.0 Ir Ir24 1 0.75000000 0.09638207 0.90361793 1.0 Ir Ir25 1 0.25000000 0.40361793 0.90361793 1.0 Ir Ir26 1 0.25000000 0.09638207 0.59638207 1.0 Ir Ir27 1 0.75000000 0.40361793 0.59638207 1.0 Ir Ir28 1 0.12686915 0.75000000 0.75000000 1.0 Ir Ir29 1 0.62686915 0.75000000 0.75000000 1.0 Ir Ir30 1 0.87313085 0.25000000 0.25000000 1.0 Ir Ir31 1 0.37313085 0.25000000 0.25000000 1.0