# generated using pymatgen data_Ho19Mg(Ir3Ru)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.67388810 _cell_length_b 10.67187615 _cell_length_c 6.34363502 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00840705 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho19Mg(Ir3Ru)3 _chemical_formula_sum 'Ho19 Mg1 Ir9 Ru3' _cell_volume 722.60606959 _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 0.28570400 0.08422088 0.38361775 1.0 Ho Ho1 1 0.29377679 0.91286820 0.88396190 1.0 Ho Ho2 1 0.70622321 0.08713180 0.88396190 1.0 Ho Ho3 1 0.71429600 0.91577912 0.38361775 1.0 Ho Ho4 1 0.58799344 0.79415174 0.88248032 1.0 Ho Ho5 1 0.58561322 0.20461176 0.38176109 1.0 Ho Ho6 1 0.41438678 0.79538824 0.38176109 1.0 Ho Ho7 1 0.41200656 0.20584826 0.88248032 1.0 Ho Ho8 1 0.20653244 0.41380727 0.62074889 1.0 Ho Ho9 1 0.20695481 0.58973064 0.11669884 1.0 Ho Ho10 1 0.79304519 0.41026936 0.11669884 1.0 Ho Ho11 1 0.79346756 0.58619273 0.62074889 1.0 Ho Ho12 1 0.91133521 0.70744795 0.11546813 1.0 Ho Ho13 1 0.91556005 0.28366556 0.61820523 1.0 Ho Ho14 1 0.08443995 0.71633444 0.61820523 1.0 Ho Ho15 1 0.08866479 0.29255205 0.11546813 1.0 Ho Ho16 1 0.00000000 0.00000000 0.99804932 1.0 Ho Ho17 1 0.50000000 0.50000000 0.99840796 1.0 Ho Ho18 1 0.50000000 0.50000000 0.49829701 1.0 Mg Mg19 1 0.00000000 0.00000000 0.49715581 1.0 Ir Ir20 1 0.84746722 0.15369622 0.24690805 1.0 Ir Ir21 1 0.84651831 0.84690105 0.75154674 1.0 Ir Ir22 1 0.15348169 0.15309895 0.75154674 1.0 Ir Ir23 1 0.15253278 0.84630378 0.24690805 1.0 Ir Ir24 1 0.65416823 0.34731452 0.74674449 1.0 Ir Ir25 1 0.65271345 0.65386769 0.25206265 1.0 Ir Ir26 1 0.34728655 0.34613231 0.25206265 1.0 Ir Ir27 1 0.34583177 0.65268548 0.74674449 1.0 Ir Ir28 1 0.00000000 0.50000000 0.37389694 1.0 Ru Ru29 1 0.50000000 0.00000000 0.13364572 1.0 Ru Ru30 1 0.50000000 0.00000000 0.63118810 1.0 Ru Ru31 1 0.00000000 0.50000000 0.86894795 1.0