# generated using pymatgen data_Sc3Al3Ga2Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.63052276 _cell_length_b 6.63052365 _cell_length_c 4.16344070 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000046 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc3Al3Ga2Ru _chemical_formula_sum 'Sc3 Al3 Ga2 Ru1' _cell_volume 158.51801019 _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 0.41877252 1.00000000 0.00000000 1.0 Sc Sc1 1 0.00000000 0.41877252 0.00000000 1.0 Sc Sc2 1 0.58122848 0.58122748 0.00000000 1.0 Al Al3 1 0.76521744 0.00000000 0.50000000 1.0 Al Al4 1 0.23478356 0.23478356 0.50000000 1.0 Al Al5 1 1.00000000 0.76521644 0.50000000 1.0 Ga Ga6 1 0.66666800 0.33333400 0.50000000 1.0 Ga Ga7 1 0.33333300 0.66666600 0.50000000 1.0 Ru Ru8 1 0.00000000 0.00000000 0.00000000 1.0