# generated using pymatgen data_Sc3Ga _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.22548225 _cell_length_b 6.22548367 _cell_length_c 5.04700554 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99960755 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc3Ga _chemical_formula_sum 'Sc6 Ga2' _cell_volume 169.39954061 _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 0.17183923 0.34368941 0.25000000 1.0 Sc Sc1 1 0.65630859 0.82816077 0.25000000 1.0 Sc Sc2 1 0.17185071 0.82815229 0.25000000 1.0 Sc Sc3 1 0.82814616 0.65630217 0.75000000 1.0 Sc Sc4 1 0.34369583 0.17185484 0.75000000 1.0 Sc Sc5 1 0.82815780 0.17184520 0.75000000 1.0 Ga Ga6 1 0.33333330 0.66666470 0.75000000 1.0 Ga Ga7 1 0.66666738 0.33333062 0.25000000 1.0