# generated using pymatgen data_Sc12Si12Rh3Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.02473851 _cell_length_b 10.26081366 _cell_length_c 11.71340613 _cell_angle_alpha 90.03518869 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc12Si12Rh3Au _chemical_formula_sum 'Sc12 Si12 Rh3 Au1' _cell_volume 483.72951811 _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 0.25000000 0.87775085 0.02198262 1.0 Sc Sc1 1 0.25000000 0.62560764 0.51948840 1.0 Sc Sc2 1 0.75000000 0.12248694 0.98020303 1.0 Sc Sc3 1 0.75000000 0.37691652 0.47685641 1.0 Sc Sc4 1 0.25000000 0.92102719 0.59866407 1.0 Sc Sc5 1 0.25000000 0.57964783 0.10077988 1.0 Sc Sc6 1 0.75000000 0.07943113 0.39816099 1.0 Sc Sc7 1 0.75000000 0.42084342 0.90086108 1.0 Sc Sc8 1 0.25000000 0.66548848 0.80226531 1.0 Sc Sc9 1 0.25000000 0.84307529 0.30004816 1.0 Sc Sc10 1 0.75000000 0.34364319 0.20008455 1.0 Sc Sc11 1 0.75000000 0.15359770 0.69966536 1.0 Si Si12 1 0.25000000 0.01130767 0.82269573 1.0 Si Si13 1 0.25000000 0.48592994 0.32557160 1.0 Si Si14 1 0.75000000 0.98573199 0.17665142 1.0 Si Si15 1 0.75000000 0.52524089 0.67465080 1.0 Si Si16 1 0.25000000 0.24182479 0.84872997 1.0 Si Si17 1 0.25000000 0.25116757 0.34046375 1.0 Si Si18 1 0.75000000 0.75130317 0.15892750 1.0 Si Si19 1 0.75000000 0.75333569 0.65764593 1.0 Si Si20 1 0.25000000 0.18380180 0.53830159 1.0 Si Si21 1 0.25000000 0.30434846 0.04645906 1.0 Si Si22 1 0.75000000 0.80467032 0.45425801 1.0 Si Si23 1 0.75000000 0.69616962 0.95741611 1.0 Rh Rh24 1 0.25000000 0.11104459 0.17829830 1.0 Rh Rh25 1 0.75000000 0.61111381 0.31994780 1.0 Rh Rh26 1 0.75000000 0.88781845 0.82196533 1.0 Au Au27 1 0.25000000 0.38567508 0.67895823 1.0