# generated using pymatgen data_Sm2Sc3Sn3Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.59949691 _cell_length_b 8.07518809 _cell_length_c 14.71554814 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm2Sc3Sn3Au _chemical_formula_sum 'Sm8 Sc12 Sn12 Au4' _cell_volume 903.05444179 _cell_formula_units_Z 4 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 Sm Sm0 1 0.50413622 0.32091730 0.90601466 1.0 Sm Sm1 1 0.00413622 0.17908270 0.59398534 1.0 Sm Sm2 1 0.49586378 0.67908270 0.40601466 1.0 Sm Sm3 1 0.99586378 0.82091730 0.09398534 1.0 Sm Sm4 1 0.49586378 0.67908270 0.09398534 1.0 Sm Sm5 1 0.99586378 0.82091730 0.40601466 1.0 Sm Sm6 1 0.50413622 0.32091730 0.59398534 1.0 Sm Sm7 1 0.00413622 0.17908270 0.90601466 1.0 Sc Sc8 1 0.33767930 0.82844537 0.86637554 1.0 Sc Sc9 1 0.83767930 0.67155463 0.63362446 1.0 Sc Sc10 1 0.66232070 0.17155463 0.36637554 1.0 Sc Sc11 1 0.16232070 0.32844537 0.13362446 1.0 Sc Sc12 1 0.66232070 0.17155463 0.13362446 1.0 Sc Sc13 1 0.16232070 0.32844537 0.36637554 1.0 Sc Sc14 1 0.33767930 0.82844537 0.63362446 1.0 Sc Sc15 1 0.83767930 0.67155463 0.86637554 1.0 Sc Sc16 1 0.18411769 0.50485480 0.75000000 1.0 Sc Sc17 1 0.68411769 0.99514520 0.75000000 1.0 Sc Sc18 1 0.81588231 0.49514520 0.25000000 1.0 Sc Sc19 1 0.31588231 0.00485480 0.25000000 1.0 Sn Sn20 1 0.32132194 0.03889311 0.04146074 1.0 Sn Sn21 1 0.82132194 0.46110689 0.45853926 1.0 Sn Sn22 1 0.67867806 0.96110689 0.54146074 1.0 Sn Sn23 1 0.17867806 0.53889311 0.95853926 1.0 Sn Sn24 1 0.67867806 0.96110689 0.95853926 1.0 Sn Sn25 1 0.17867806 0.53889311 0.54146074 1.0 Sn Sn26 1 0.32132194 0.03889311 0.45853926 1.0 Sn Sn27 1 0.82132194 0.46110689 0.04146074 1.0 Sn Sn28 1 0.30066961 0.13294357 0.75000000 1.0 Sn Sn29 1 0.80066961 0.36705643 0.75000000 1.0 Sn Sn30 1 0.69933039 0.86705643 0.25000000 1.0 Sn Sn31 1 0.19933039 0.63294357 0.25000000 1.0 Au Au32 1 0.53472396 0.62319504 0.75000000 1.0 Au Au33 1 0.03472396 0.87680496 0.75000000 1.0 Au Au34 1 0.46527604 0.37680496 0.25000000 1.0 Au Au35 1 0.96527604 0.12319504 0.25000000 1.0