# generated using pymatgen data_Sc2AlTc3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.19394783 _cell_length_b 5.19394887 _cell_length_c 8.65927521 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00001220 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2AlTc3 _chemical_formula_sum 'Sc4 Al2 Tc6' _cell_volume 202.30535307 _cell_formula_units_Z 2 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 0.33333300 0.66666700 0.43222059 1.0 Sc Sc1 1 0.66666700 0.33333300 0.56777941 1.0 Sc Sc2 1 0.66666700 0.33333300 0.93222059 1.0 Sc Sc3 1 0.33333300 0.66666700 0.06777941 1.0 Al Al4 1 0.00000000 0.00000000 0.50000000 1.0 Al Al5 1 0.00000000 0.00000000 0.00000000 1.0 Tc Tc6 1 0.82874360 0.17125640 0.25000000 1.0 Tc Tc7 1 0.82874360 0.65748821 0.25000000 1.0 Tc Tc8 1 0.34251179 0.17125640 0.25000000 1.0 Tc Tc9 1 0.17125640 0.82874360 0.75000000 1.0 Tc Tc10 1 0.17125640 0.34251179 0.75000000 1.0 Tc Tc11 1 0.65748821 0.82874360 0.75000000 1.0