# generated using pymatgen data_Nd4GePd28Se _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.92664137 _cell_length_b 8.92664137 _cell_length_c 7.16232869 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd4GePd28Se _chemical_formula_sum 'Nd4 Ge1 Pd28 Se1' _cell_volume 570.72963262 _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 0.50000000 0.00000000 0.93300207 1.0 Nd Nd1 1 0.00000000 0.50000000 0.06434281 1.0 Nd Nd2 1 0.00000000 0.00000000 0.50050346 1.0 Nd Nd3 1 0.50000000 0.50000000 0.50050346 1.0 Ge Ge4 1 0.00000000 0.50000000 0.54972062 1.0 Pd Pd5 1 0.32734502 0.82734502 0.62407368 1.0 Pd Pd6 1 0.32734502 0.17265498 0.62407368 1.0 Pd Pd7 1 0.67265498 0.82734502 0.62407368 1.0 Pd Pd8 1 0.67265498 0.17265498 0.62407368 1.0 Pd Pd9 1 0.16874092 0.66874092 0.37760895 1.0 Pd Pd10 1 0.16874092 0.33125908 0.37760895 1.0 Pd Pd11 1 0.83125908 0.66874092 0.37760895 1.0 Pd Pd12 1 0.83125908 0.33125908 0.37760895 1.0 Pd Pd13 1 0.50000000 0.76536228 0.25201616 1.0 Pd Pd14 1 0.50000000 0.23463772 0.25201616 1.0 Pd Pd15 1 0.26536228 0.00000000 0.25201616 1.0 Pd Pd16 1 0.73463772 0.00000000 0.25201616 1.0 Pd Pd17 1 0.00000000 0.73318375 0.74449710 1.0 Pd Pd18 1 0.00000000 0.26681625 0.74449710 1.0 Pd Pd19 1 0.23318375 0.50000000 0.74449710 1.0 Pd Pd20 1 0.76681625 0.50000000 0.74449710 1.0 Pd Pd21 1 0.50000000 0.34760840 0.85882696 1.0 Pd Pd22 1 0.50000000 0.65239160 0.85882696 1.0 Pd Pd23 1 0.84760840 0.00000000 0.85882696 1.0 Pd Pd24 1 0.15239160 0.00000000 0.85882696 1.0 Pd Pd25 1 0.00000000 0.15101348 0.14248361 1.0 Pd Pd26 1 0.00000000 0.84898652 0.14248361 1.0 Pd Pd27 1 0.65101348 0.50000000 0.14248361 1.0 Pd Pd28 1 0.34898652 0.50000000 0.14248361 1.0 Pd Pd29 1 0.24782624 0.74782624 0.99999267 1.0 Pd Pd30 1 0.24782624 0.25217376 0.99999267 1.0 Pd Pd31 1 0.75217376 0.74782624 0.99999267 1.0 Pd Pd32 1 0.75217376 0.25217376 0.99999267 1.0 Se Se33 1 0.50000000 0.00000000 0.45393303 1.0