# generated using pymatgen data_Sc4AlGaTc6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.18962192 _cell_length_b 5.18962293 _cell_length_c 8.65247769 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000622 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4AlGaTc6 _chemical_formula_sum 'Sc4 Al1 Ga1 Tc6' _cell_volume 201.80996921 _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 Sc Sc0 1 0.33333300 0.66666700 0.43161411 1.0 Sc Sc1 1 0.66666700 0.33333300 0.56838589 1.0 Sc Sc2 1 0.66666700 0.33333300 0.93233395 1.0 Sc Sc3 1 0.33333300 0.66666700 0.06766605 1.0 Al Al4 1 0.00000000 0.00000000 0.50000000 1.0 Ga Ga5 1 0.00000000 0.00000000 0.00000000 1.0 Tc Tc6 1 0.82789722 0.17210278 0.24991848 1.0 Tc Tc7 1 0.82789722 0.65579543 0.24991848 1.0 Tc Tc8 1 0.34420457 0.17210278 0.24991848 1.0 Tc Tc9 1 0.17210278 0.82789722 0.75008152 1.0 Tc Tc10 1 0.17210278 0.34420457 0.75008152 1.0 Tc Tc11 1 0.65579543 0.82789722 0.75008152 1.0