# generated using pymatgen data_Sc2(Al3Co)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.22336458 _cell_length_b 7.22336458 _cell_length_c 9.00482414 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.35822869 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2(Al3Co)3 _chemical_formula_sum 'Sc4 Al18 Co6' _cell_volume 409.50321199 _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 0.99318208 0.67357123 0.25000000 1.0 Sc Sc1 1 0.00681792 0.32642877 0.75000000 1.0 Sc Sc2 1 0.67357123 0.99318208 0.25000000 1.0 Sc Sc3 1 0.32642877 0.00681792 0.75000000 1.0 Al Al4 1 0.99501472 0.33545973 0.07325060 1.0 Al Al5 1 0.00498528 0.66454027 0.92674940 1.0 Al Al6 1 0.00498528 0.66454027 0.57325060 1.0 Al Al7 1 0.33545973 0.99501472 0.42674940 1.0 Al Al8 1 0.99501472 0.33545973 0.42674940 1.0 Al Al9 1 0.66454027 0.00498528 0.57325060 1.0 Al Al10 1 0.66454027 0.00498528 0.92674940 1.0 Al Al11 1 0.33545973 0.99501472 0.07325060 1.0 Al Al12 1 0.34023811 0.56126471 0.25000000 1.0 Al Al13 1 0.65976189 0.43873529 0.75000000 1.0 Al Al14 1 0.56126471 0.34023811 0.25000000 1.0 Al Al15 1 0.43873529 0.65976189 0.75000000 1.0 Al Al16 1 0.32962079 0.32962079 0.54457573 1.0 Al Al17 1 0.67037921 0.67037921 0.45542427 1.0 Al Al18 1 0.67037921 0.67037921 0.04457573 1.0 Al Al19 1 0.32962079 0.32962079 0.95542427 1.0 Al Al20 1 0.11929478 0.11929478 0.25000000 1.0 Al Al21 1 0.88070522 0.88070522 0.75000000 1.0 Co Co22 1 0.67155957 0.32844043 0.00000000 1.0 Co Co23 1 0.32844043 0.67155957 0.00000000 1.0 Co Co24 1 0.32844043 0.67155957 0.50000000 1.0 Co Co25 1 0.67155957 0.32844043 0.50000000 1.0 Co Co26 1 0.00000000 -0.00000000 0.00000000 1.0 Co Co27 1 0.00000000 -0.00000000 0.50000000 1.0