# generated using pymatgen data_Nd3SnGeIr2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.76487455 _cell_length_b 8.24640813 _cell_length_c 13.80106039 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3SnGeIr2 _chemical_formula_sum 'Nd12 Sn4 Ge4 Ir8' _cell_volume 656.09562652 _cell_formula_units_Z 4 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 0.63467946 0.25459058 0.25000000 1.0 Nd Nd1 1 0.36532054 0.74540942 0.75000000 1.0 Nd Nd2 1 0.36532054 0.75459058 0.25000000 1.0 Nd Nd3 1 0.63467946 0.24540942 0.75000000 1.0 Nd Nd4 1 0.15473721 0.39400279 0.09997907 1.0 Nd Nd5 1 0.84526279 0.60599721 0.90002093 1.0 Nd Nd6 1 0.84526279 0.60599721 0.59997907 1.0 Nd Nd7 1 0.84526279 0.89400279 0.40002093 1.0 Nd Nd8 1 0.15473721 0.39400279 0.40002093 1.0 Nd Nd9 1 0.15473721 0.10599721 0.59997907 1.0 Nd Nd10 1 0.15473721 0.10599721 0.90002093 1.0 Nd Nd11 1 0.84526279 0.89400279 0.09997907 1.0 Sn Sn12 1 0.65869705 0.25000000 0.00000000 1.0 Sn Sn13 1 0.34130295 0.75000000 0.00000000 1.0 Sn Sn14 1 0.34130295 0.75000000 0.50000000 1.0 Sn Sn15 1 0.65869705 0.25000000 0.50000000 1.0 Ge Ge16 1 0.13827049 0.10240652 0.25000000 1.0 Ge Ge17 1 0.86172951 0.89759348 0.75000000 1.0 Ge Ge18 1 0.86172951 0.60240652 0.25000000 1.0 Ge Ge19 1 0.13827049 0.39759348 0.75000000 1.0 Ir Ir20 1 0.36754580 0.04460032 0.09763890 1.0 Ir Ir21 1 0.63245420 0.95539968 0.90236110 1.0 Ir Ir22 1 0.63245420 0.95539968 0.59763890 1.0 Ir Ir23 1 0.63245420 0.54460032 0.40236110 1.0 Ir Ir24 1 0.36754580 0.04460032 0.40236110 1.0 Ir Ir25 1 0.36754580 0.45539968 0.59763890 1.0 Ir Ir26 1 0.36754580 0.45539968 0.90236110 1.0 Ir Ir27 1 0.63245420 0.54460032 0.09763890 1.0