# generated using pymatgen data_Sc4Al4Tc3Mo _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.36827941 _cell_length_b 5.34670140 _cell_length_c 8.44986959 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.36394440 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4Al4Tc3Mo _chemical_formula_sum 'Sc4 Al4 Tc3 Mo1' _cell_volume 209.26532015 _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 0.33022046 0.66347498 0.44115964 1.0 Sc Sc1 1 0.66495129 0.33629744 0.56095650 1.0 Sc Sc2 1 0.66495129 0.33629744 0.93904350 1.0 Sc Sc3 1 0.33022046 0.66347498 0.05884036 1.0 Al Al4 1 0.84223128 0.64986914 0.25000000 1.0 Al Al5 1 0.33698635 0.15180795 0.25000000 1.0 Al Al6 1 0.18183735 0.84694109 0.75000000 1.0 Al Al7 1 0.19103398 0.35381984 0.75000000 1.0 Tc Tc8 1 0.97377781 0.99880711 0.50078185 1.0 Tc Tc9 1 0.97377781 0.99880711 0.99921815 1.0 Tc Tc10 1 0.67691391 0.85124613 0.75000000 1.0 Mo Mo11 1 0.83310000 0.14915479 0.25000000 1.0