# generated using pymatgen data_Sc5Sb3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.61616863 _cell_length_b 8.76414466 _cell_length_c 11.17943473 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00107002 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc5Sb3 _chemical_formula_sum 'Sc20 Sb12' _cell_volume 746.21836518 _cell_formula_units_Z 4 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 Sc Sc0 1 0.02731474 0.25000000 0.51044292 1.0 Sc Sc1 1 0.97268500 0.75000000 0.48954660 1.0 Sc Sc2 1 0.47268917 0.75000000 0.01045062 1.0 Sc Sc3 1 0.52730549 0.25000000 0.98955751 1.0 Sc Sc4 1 0.35322506 0.25000000 0.28378104 1.0 Sc Sc5 1 0.64677670 0.75000000 0.71621334 1.0 Sc Sc6 1 0.14676483 0.75000000 0.78382049 1.0 Sc Sc7 1 0.85323232 0.25000000 0.21617875 1.0 Sc Sc8 1 0.18613788 0.25000000 0.77863348 1.0 Sc Sc9 1 0.81385808 0.75000000 0.22136817 1.0 Sc Sc10 1 0.31385688 0.75000000 0.27860120 1.0 Sc Sc11 1 0.68613976 0.25000000 0.72139420 1.0 Sc Sc12 1 0.19777406 0.06177638 0.06136051 1.0 Sc Sc13 1 0.80222337 0.93822448 0.93865316 1.0 Sc Sc14 1 0.30222983 0.93822673 0.56135857 1.0 Sc Sc15 1 0.80222337 0.56177552 0.93865316 1.0 Sc Sc16 1 0.69776795 0.06177176 0.43862590 1.0 Sc Sc17 1 0.19777406 0.43822362 0.06136051 1.0 Sc Sc18 1 0.69776795 0.43822824 0.43862590 1.0 Sc Sc19 1 0.30222983 0.56177327 0.56135857 1.0 Sb Sb20 1 0.41465257 0.25000000 0.53803526 1.0 Sb Sb21 1 0.58536087 0.75000000 0.46197768 1.0 Sb Sb22 1 0.08536002 0.75000000 0.03803056 1.0 Sb Sb23 1 0.91464882 0.25000000 0.96197951 1.0 Sb Sb24 1 0.06637566 0.00380059 0.32685971 1.0 Sb Sb25 1 0.93362170 0.99620264 0.67313568 1.0 Sb Sb26 1 0.43362608 0.99620862 0.82688201 1.0 Sb Sb27 1 0.93362170 0.50379736 0.67313568 1.0 Sb Sb28 1 0.56637528 0.00379077 0.17311531 1.0 Sb Sb29 1 0.06637566 0.49619941 0.32685971 1.0 Sb Sb30 1 0.56637528 0.49620923 0.17311531 1.0 Sb Sb31 1 0.43362608 0.50379138 0.82688201 1.0