# generated using pymatgen data_Th8Si12Ni3Pd _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.05989890 _cell_length_b 8.05989801 _cell_length_c 8.59465425 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000771 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th8Si12Ni3Pd _chemical_formula_sum 'Th8 Si12 Ni3 Pd1' _cell_volume 483.52412622 _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 Th Th0 1 0.50159615 0.00319330 0.24738444 1.0 Th Th1 1 0.50145482 0.00290963 0.75261515 1.0 Th Th2 1 0.99680670 0.49840385 0.24738444 1.0 Th Th3 1 0.99709037 0.49854518 0.75261515 1.0 Th Th4 1 0.50159615 0.49840385 0.24738444 1.0 Th Th5 1 0.50145482 0.49854518 0.75261515 1.0 Th Th6 1 0.00000000 0.00000000 0.24882495 1.0 Th Th7 1 0.00000000 0.00000000 0.75119034 1.0 Si Si8 1 0.17171519 0.34343139 0.00014688 1.0 Si Si9 1 0.82869819 0.65739439 0.99987191 1.0 Si Si10 1 0.65656861 0.82828481 0.00014688 1.0 Si Si11 1 0.82751110 0.65502219 0.50012741 1.0 Si Si12 1 0.34260561 0.17130181 0.99987191 1.0 Si Si13 1 0.16469197 0.32938394 0.49992183 1.0 Si Si14 1 0.17171519 0.82828481 0.00014688 1.0 Si Si15 1 0.34497781 0.17248890 0.50012741 1.0 Si Si16 1 0.82869819 0.17130181 0.99987191 1.0 Si Si17 1 0.67061606 0.83530803 0.49992183 1.0 Si Si18 1 0.82751110 0.17248890 0.50012741 1.0 Si Si19 1 0.16469197 0.83530803 0.49992183 1.0 Ni Ni20 1 0.33333300 0.66666700 0.00019078 1.0 Ni Ni21 1 0.66666700 0.33333300 0.99946747 1.0 Ni Ni22 1 0.66666700 0.33333300 0.50051789 1.0 Pd Pd23 1 0.33333300 0.66666700 0.49960273 1.0