# generated using pymatgen data_NdTh3(ZnGe)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.20161987 _cell_length_b 4.20162105 _cell_length_c 17.00792380 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00001368 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdTh3(ZnGe)4 _chemical_formula_sum 'Nd1 Th3 Zn4 Ge4' _cell_volume 260.02524307 _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 Nd Nd0 1 0.00000000 0.00000000 0.75000000 1.0 Th Th1 1 0.00000000 0.00000000 0.25000000 1.0 Th Th2 1 0.00000000 0.00000000 0.99961399 1.0 Th Th3 1 0.00000000 0.00000000 0.50038601 1.0 Zn Zn4 1 0.33333300 0.66666700 0.12721902 1.0 Zn Zn5 1 0.66666700 0.33333300 0.86685268 1.0 Zn Zn6 1 0.66666700 0.33333300 0.63314732 1.0 Zn Zn7 1 0.33333300 0.66666700 0.37278098 1.0 Ge Ge8 1 0.33333300 0.66666700 0.62097177 1.0 Ge Ge9 1 0.66666700 0.33333300 0.37826183 1.0 Ge Ge10 1 0.66666700 0.33333300 0.12173817 1.0 Ge Ge11 1 0.33333300 0.66666700 0.87902823 1.0