# generated using pymatgen data_Sc3Al3Cu2Si _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.58104739 _cell_length_b 6.58104773 _cell_length_c 3.99614236 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000326 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc3Al3Cu2Si _chemical_formula_sum 'Sc3 Al3 Cu2 Si1' _cell_volume 149.88619236 _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 0.99660574 0.41875964 0.50000000 1.0 Sc Sc1 1 0.58124036 0.57784610 0.50000000 1.0 Sc Sc2 1 0.42215390 0.00339426 0.50000000 1.0 Al Al3 1 0.98829791 0.75139793 0.00000000 1.0 Al Al4 1 0.24860207 0.23690098 0.00000000 1.0 Al Al5 1 0.76309902 0.01170209 0.00000000 1.0 Cu Cu6 1 0.66666700 0.33333300 0.00000000 1.0 Cu Cu7 1 0.00000000 0.00000000 0.50000000 1.0 Si Si8 1 0.33333300 0.66666700 0.00000000 1.0