# generated using pymatgen data_Th6Mg23 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.09600124 _cell_length_b 10.09600131 _cell_length_c 10.09600138 _cell_angle_alpha 59.99982276 _cell_angle_beta 59.99982465 _cell_angle_gamma 59.99981903 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th6Mg23 _chemical_formula_sum 'Th6 Mg23' _cell_volume 727.66493224 _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 0.81456430 0.18543570 0.81456430 1.0 Th Th1 1 0.81456430 0.81456430 0.18543570 1.0 Th Th2 1 0.81456430 0.18543570 0.18543570 1.0 Th Th3 1 0.18543570 0.18543570 0.81456430 1.0 Th Th4 1 0.18543570 0.81456430 0.81456430 1.0 Th Th5 1 0.18543570 0.81456430 0.18543570 1.0 Mg Mg6 1 0.38016899 0.85949304 0.38016899 1.0 Mg Mg7 1 0.82956198 0.82956198 0.82956198 1.0 Mg Mg8 1 0.00000000 0.00000000 0.50000000 1.0 Mg Mg9 1 0.50000000 0.50000000 0.50000000 1.0 Mg Mg10 1 0.17043802 0.48868595 0.17043802 1.0 Mg Mg11 1 0.17043802 0.17043802 0.48868595 1.0 Mg Mg12 1 0.82956198 0.82956198 0.51131405 1.0 Mg Mg13 1 0.38016899 0.38016899 0.85949304 1.0 Mg Mg14 1 0.61983101 0.61983101 0.61983101 1.0 Mg Mg15 1 0.50000000 0.00000000 -0.00000000 1.0 Mg Mg16 1 0.85949304 0.38016899 0.38016899 1.0 Mg Mg17 1 0.14050696 0.61983101 0.61983101 1.0 Mg Mg18 1 0.17043802 0.17043802 0.17043802 1.0 Mg Mg19 1 0.82956198 0.51131405 0.82956198 1.0 Mg Mg20 1 0.51131405 0.82956198 0.82956198 1.0 Mg Mg21 1 0.50000000 0.00000000 0.50000000 1.0 Mg Mg22 1 0.38016899 0.38016899 0.38016899 1.0 Mg Mg23 1 0.61983101 0.14050696 0.61983101 1.0 Mg Mg24 1 0.61983101 0.61983101 0.14050696 1.0 Mg Mg25 1 0.50000000 0.50000000 -0.00000000 1.0 Mg Mg26 1 0.48868595 0.17043802 0.17043802 1.0 Mg Mg27 1 0.00000000 0.50000000 -0.00000000 1.0 Mg Mg28 1 0.00000000 0.50000000 0.50000000 1.0