# generated using pymatgen data_Ho3Er(B6Ir)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.62031371 _cell_length_b 9.15382430 _cell_length_c 11.47942894 _cell_angle_alpha 90.03430553 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho3Er(B6Ir)2 _chemical_formula_sum 'Ho6 Er2 B24 Ir4' _cell_volume 380.42494260 _cell_formula_units_Z 2 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 Ho Ho0 1 0.00000000 0.32215114 0.41288940 1.0 Ho Ho1 1 0.00000000 0.67784886 0.58711060 1.0 Ho Ho2 1 0.00000000 0.82151037 0.08692248 1.0 Ho Ho3 1 0.00000000 0.17848963 0.91307752 1.0 Ho Ho4 1 0.00000000 0.94445191 0.37535711 1.0 Ho Ho5 1 0.00000000 0.05554809 0.62464289 1.0 Er Er6 1 0.00000000 0.44439998 0.12455792 1.0 Er Er7 1 0.00000000 0.55560002 0.87544208 1.0 B B8 1 0.50000000 0.55276183 0.43376802 1.0 B B9 1 0.50000000 0.44723817 0.56623198 1.0 B B10 1 0.50000000 0.05317688 0.06599100 1.0 B B11 1 0.50000000 0.94682312 0.93400900 1.0 B B12 1 0.50000000 0.74858578 0.42072280 1.0 B B13 1 0.50000000 0.25141422 0.57927720 1.0 B B14 1 0.50000000 0.24951252 0.07905785 1.0 B B15 1 0.50000000 0.75048748 0.92094215 1.0 B B16 1 0.50000000 0.79325811 0.26558636 1.0 B B17 1 0.50000000 0.20674189 0.73441364 1.0 B B18 1 0.50000000 0.29384791 0.23379817 1.0 B B19 1 0.50000000 0.70615209 0.76620183 1.0 B B20 1 0.50000000 0.63260552 0.18420412 1.0 B B21 1 0.50000000 0.36739448 0.81579588 1.0 B B22 1 0.50000000 0.13331859 0.31528812 1.0 B B23 1 0.50000000 0.86668141 0.68471188 1.0 B B24 1 0.50000000 0.98247284 0.21313268 1.0 B B25 1 0.50000000 0.01752716 0.78686732 1.0 B B26 1 0.50000000 0.48208626 0.28639261 1.0 B B27 1 0.50000000 0.51791374 0.71360739 1.0 B B28 1 0.50000000 0.61206809 0.03085474 1.0 B B29 1 0.50000000 0.38793191 0.96914526 1.0 B B30 1 0.50000000 0.11446989 0.46857724 1.0 B B31 1 0.50000000 0.88553011 0.53142276 1.0 Ir Ir32 1 0.00000000 0.63823368 0.32098789 1.0 Ir Ir33 1 0.00000000 0.36176632 0.67901211 1.0 Ir Ir34 1 0.00000000 0.13912853 0.17854024 1.0 Ir Ir35 1 0.00000000 0.86087147 0.82145976 1.0