# generated using pymatgen data_Ho3Mg5(B6Ru)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.52110602 _cell_length_b 8.86289522 _cell_length_c 11.17597112 _cell_angle_alpha 89.91628655 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho3Mg5(B6Ru)4 _chemical_formula_sum 'Ho3 Mg5 B24 Ru4' _cell_volume 348.77032391 _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 Ho Ho0 1 0.00000000 0.32235982 0.41447204 1.0 Ho Ho1 1 0.00000000 0.67617968 0.58724528 1.0 Ho Ho2 1 0.00000000 0.82339436 0.08426848 1.0 Mg Mg3 1 0.00000000 0.16993710 0.91295720 1.0 Mg Mg4 1 0.00000000 0.94488856 0.36955864 1.0 Mg Mg5 1 0.00000000 0.05804460 0.63091232 1.0 Mg Mg6 1 0.00000000 0.44540797 0.12781935 1.0 Mg Mg7 1 0.00000000 0.55789615 0.87123813 1.0 B B8 1 0.50000000 0.55514133 0.43277995 1.0 B B9 1 0.50000000 0.44340323 0.56853656 1.0 B B10 1 0.50000000 0.05533825 0.06485749 1.0 B B11 1 0.50000000 0.94514216 0.93250339 1.0 B B12 1 0.50000000 0.75588711 0.41804213 1.0 B B13 1 0.50000000 0.24393272 0.58426099 1.0 B B14 1 0.50000000 0.25636323 0.07853444 1.0 B B15 1 0.50000000 0.74486125 0.91722548 1.0 B B16 1 0.50000000 0.79456729 0.26255577 1.0 B B17 1 0.50000000 0.20436773 0.73983819 1.0 B B18 1 0.50000000 0.29402621 0.23608774 1.0 B B19 1 0.50000000 0.70564127 0.76321992 1.0 B B20 1 0.50000000 0.62851542 0.18190227 1.0 B B21 1 0.50000000 0.36926960 0.82134515 1.0 B B22 1 0.50000000 0.12866023 0.31705870 1.0 B B23 1 0.50000000 0.87200918 0.68240288 1.0 B B24 1 0.50000000 0.98190215 0.21186424 1.0 B B25 1 0.50000000 0.02114692 0.78845791 1.0 B B26 1 0.50000000 0.48092170 0.28629928 1.0 B B27 1 0.50000000 0.51849741 0.71418110 1.0 B B28 1 0.50000000 0.59236413 0.02476210 1.0 B B29 1 0.50000000 0.40678254 0.97476314 1.0 B B30 1 0.50000000 0.09256344 0.47507634 1.0 B B31 1 0.50000000 0.90732776 0.52548420 1.0 Ru Ru32 1 0.00000000 0.64098749 0.31882992 1.0 Ru Ru33 1 0.00000000 0.35985046 0.68498310 1.0 Ru Ru34 1 0.00000000 0.14203786 0.17793785 1.0 Ru Ru35 1 0.00000000 0.86038271 0.81774032 1.0