# generated using pymatgen data_Er5Tm3(B6Ir)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.60372055 _cell_length_b 9.11633765 _cell_length_c 11.44591283 _cell_angle_alpha 90.01512332 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er5Tm3(B6Ir)4 _chemical_formula_sum 'Er5 Tm3 B24 Ir4' _cell_volume 376.02950846 _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 0.00000000 0.32133047 0.41333881 1.0 Er Er1 1 0.00000000 0.67864316 0.58696204 1.0 Er Er2 1 0.00000000 0.82110258 0.08667116 1.0 Er Er3 1 0.00000000 0.17895332 0.91310672 1.0 Er Er4 1 0.00000000 0.94434688 0.37536828 1.0 Tm Tm5 1 0.00000000 0.05569046 0.62490843 1.0 Tm Tm6 1 0.00000000 0.44436466 0.12464951 1.0 Tm Tm7 1 0.00000000 0.55573063 0.87514698 1.0 B B8 1 0.50000000 0.55284562 0.43429188 1.0 B B9 1 0.50000000 0.44693732 0.56584660 1.0 B B10 1 0.50000000 0.05319207 0.06561474 1.0 B B11 1 0.50000000 0.94692523 0.93420837 1.0 B B12 1 0.50000000 0.74912425 0.42102250 1.0 B B13 1 0.50000000 0.25045838 0.57920844 1.0 B B14 1 0.50000000 0.24973745 0.07892939 1.0 B B15 1 0.50000000 0.75028731 0.92090321 1.0 B B16 1 0.50000000 0.79353599 0.26524193 1.0 B B17 1 0.50000000 0.20616513 0.73467757 1.0 B B18 1 0.50000000 0.29399131 0.23446754 1.0 B B19 1 0.50000000 0.70611898 0.76547492 1.0 B B20 1 0.50000000 0.63240304 0.18387942 1.0 B B21 1 0.50000000 0.36756007 0.81601474 1.0 B B22 1 0.50000000 0.13287860 0.31587182 1.0 B B23 1 0.50000000 0.86739424 0.68412532 1.0 B B24 1 0.50000000 0.98193362 0.21319574 1.0 B B25 1 0.50000000 0.01825066 0.78660150 1.0 B B26 1 0.50000000 0.48165634 0.28650727 1.0 B B27 1 0.50000000 0.51829130 0.71343452 1.0 B B28 1 0.50000000 0.61094048 0.03036074 1.0 B B29 1 0.50000000 0.38911982 0.96941495 1.0 B B30 1 0.50000000 0.11196864 0.46964732 1.0 B B31 1 0.50000000 0.88822390 0.53096573 1.0 Ir Ir32 1 0.00000000 0.63845511 0.32103021 1.0 Ir Ir33 1 0.00000000 0.36118978 0.67897426 1.0 Ir Ir34 1 0.00000000 0.13910057 0.17876798 1.0 Ir Ir35 1 0.00000000 0.86115059 0.82116548 1.0