# generated using pymatgen data_LuSc3In2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.07460405 _cell_length_b 5.07460453 _cell_length_c 6.41596922 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000328 _symmetry_Int_Tables_number 1 _chemical_formula_structural LuSc3In2 _chemical_formula_sum 'Lu1 Sc3 In2' _cell_volume 143.08603650 _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 Lu Lu0 1 0.00000000 0.00000000 0.00000000 1.0 Sc Sc1 1 0.00000000 0.00000000 0.50000000 1.0 Sc Sc2 1 0.33333300 0.66666700 0.73584614 1.0 Sc Sc3 1 0.66666700 0.33333300 0.26415386 1.0 In In4 1 0.33333300 0.66666700 0.24507087 1.0 In In5 1 0.66666700 0.33333300 0.75492913 1.0