# generated using pymatgen data_Ho5Sc(Si3Ru)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.03144770 _cell_length_b 10.03144783 _cell_length_c 8.07303170 _cell_angle_alpha 90.00472911 _cell_angle_beta 90.00473121 _cell_angle_gamma 132.58603736 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho5Sc(Si3Ru)8 _chemical_formula_sum 'Ho5 Sc1 Si24 Ru8' _cell_volume 598.13095119 _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 0.00000000 0.00000000 1.0 Ho Ho1 1 0.50309542 0.00301123 0.74977567 1.0 Ho Ho2 1 0.99698877 0.49690458 0.25022433 1.0 Ho Ho3 1 0.49690458 0.99698877 0.25022433 1.0 Ho Ho4 1 0.00301123 0.50309542 0.74977567 1.0 Sc Sc5 1 0.50000000 0.50000000 0.50000000 1.0 Si Si6 1 0.79428295 0.20571705 0.50000000 1.0 Si Si7 1 0.29479198 0.70520802 0.00000000 1.0 Si Si8 1 0.20571705 0.79428295 0.50000000 1.0 Si Si9 1 0.70520802 0.29479198 1.00000000 1.0 Si Si10 1 0.33426526 0.33426526 0.83217598 1.0 Si Si11 1 0.66573474 0.66573474 0.16782402 1.0 Si Si12 1 0.16830856 0.16830856 0.33490277 1.0 Si Si13 1 0.83169144 0.83169144 0.66509723 1.0 Si Si14 1 0.12108862 0.88641575 0.72690757 1.0 Si Si15 1 0.11358425 0.87891138 0.27309243 1.0 Si Si16 1 0.61176675 0.37901248 0.22882492 1.0 Si Si17 1 0.62098752 0.38823325 0.77117508 1.0 Si Si18 1 0.87891138 0.11358425 0.27309243 1.0 Si Si19 1 0.88641575 0.12108862 0.72690757 1.0 Si Si20 1 0.38823325 0.62098752 0.77117508 1.0 Si Si21 1 0.37901248 0.61176675 0.22882492 1.0 Si Si22 1 0.34497390 0.11204667 0.50497762 1.0 Si Si23 1 0.88795333 0.65502610 0.49502238 1.0 Si Si24 1 0.39007145 0.15572863 0.00523274 1.0 Si Si25 1 0.84427137 0.60992855 0.99476726 1.0 Si Si26 1 0.65502610 0.88795333 0.49502238 1.0 Si Si27 1 0.11204667 0.34497390 0.50497762 1.0 Si Si28 1 0.60992855 0.84427137 0.99476726 1.0 Si Si29 1 0.15572863 0.39007145 0.00523274 1.0 Ru Ru30 1 0.66786219 0.33213781 0.50000000 1.0 Ru Ru31 1 0.16904579 0.83095421 1.00000000 1.0 Ru Ru32 1 0.33213781 0.66786219 0.50000000 1.0 Ru Ru33 1 0.83095421 0.16904579 0.00000000 1.0 Ru Ru34 1 0.12747718 0.12747718 0.62717745 1.0 Ru Ru35 1 0.87252282 0.87252282 0.37282255 1.0 Ru Ru36 1 0.37310379 0.37310379 0.12820145 1.0 Ru Ru37 1 0.62689621 0.62689621 0.87179855 1.0