# generated using pymatgen data_Sc2InGa2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.93205497 _cell_length_b 6.93205497 _cell_length_c 4.14023729 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2InGa2 _chemical_formula_sum 'Sc4 In2 Ga4' _cell_volume 198.95242131 _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 0.17103748 0.32896252 0.50000000 1.0 Sc Sc1 1 0.32896252 0.82896252 0.50000000 1.0 Sc Sc2 1 0.82896252 0.67103748 0.50000000 1.0 Sc Sc3 1 0.67103748 0.17103748 0.50000000 1.0 In In4 1 0.50000000 0.50000000 0.00000000 1.0 In In5 1 0.00000000 0.00000000 0.00000000 1.0 Ga Ga6 1 0.62570431 0.87429569 0.00000000 1.0 Ga Ga7 1 0.12570431 0.62570431 0.00000000 1.0 Ga Ga8 1 0.87429569 0.37429569 0.00000000 1.0 Ga Ga9 1 0.37429569 0.12570431 0.00000000 1.0