# generated using pymatgen data_Th3Si2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.15641370 _cell_length_b 7.86669428 _cell_length_c 7.86669428 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th3Si2 _chemical_formula_sum 'Th6 Si4' _cell_volume 257.21915846 _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 Th Th0 1 0.00000000 0.50000000 0.50000000 1.0 Th Th1 1 -0.00000000 -0.00000000 -0.00000000 1.0 Th Th2 1 0.50000000 0.18107323 0.68107323 1.0 Th Th3 1 0.50000000 0.81892677 0.31892677 1.0 Th Th4 1 0.50000000 0.31892677 0.18107323 1.0 Th Th5 1 0.50000000 0.68107323 0.81892677 1.0 Si Si6 1 0.00000000 0.61248089 0.11248089 1.0 Si Si7 1 -0.00000000 0.38751911 0.88751911 1.0 Si Si8 1 -0.00000000 0.88751911 0.61248089 1.0 Si Si9 1 0.00000000 0.11248089 0.38751911 1.0