# generated using pymatgen data_TmZr(B4Ir3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.62851188 _cell_length_b 7.62851118 _cell_length_c 3.52791385 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000730 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmZr(B4Ir3)2 _chemical_formula_sum 'Tm1 Zr1 B8 Ir6' _cell_volume 177.79853773 _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 0.33333300 0.66666700 0.25000000 1.0 Zr Zr1 1 0.66666700 0.33333300 0.75000000 1.0 B B2 1 0.39672440 0.94966083 0.75000000 1.0 B B3 1 0.05033917 0.44706257 0.75000000 1.0 B B4 1 0.55293743 0.60327560 0.75000000 1.0 B B5 1 0.60301514 0.05221854 0.25000000 1.0 B B6 1 0.94778146 0.55079660 0.25000000 1.0 B B7 1 0.44920340 0.39698486 0.25000000 1.0 B B8 1 0.00000000 0.00000000 0.50126339 1.0 B B9 1 0.00000000 0.00000000 0.99873661 1.0 Ir Ir10 1 0.07171434 0.74446280 0.75000000 1.0 Ir Ir11 1 0.25553720 0.32725154 0.75000000 1.0 Ir Ir12 1 0.67274846 0.92828566 0.75000000 1.0 Ir Ir13 1 0.92458211 0.25477693 0.25000000 1.0 Ir Ir14 1 0.74522307 0.66980518 0.25000000 1.0 Ir Ir15 1 0.33019482 0.07541789 0.25000000 1.0