# generated using pymatgen data_Nd4BeSiPd28 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.89064596 _cell_length_b 8.89064596 _cell_length_c 7.05181317 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd4BeSiPd28 _chemical_formula_sum 'Nd4 Be1 Si1 Pd28' _cell_volume 557.40059828 _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 0.93618735 1.0 Nd Nd1 1 0.00000000 0.50000000 0.06600233 1.0 Nd Nd2 1 0.00000000 0.00000000 0.49798415 1.0 Nd Nd3 1 0.50000000 0.50000000 0.49798415 1.0 Be Be4 1 0.50000000 0.00000000 0.45011279 1.0 Si Si5 1 0.00000000 0.50000000 0.54923338 1.0 Pd Pd6 1 0.33705031 0.83705031 0.61259591 1.0 Pd Pd7 1 0.33705031 0.16294969 0.61259591 1.0 Pd Pd8 1 0.66294969 0.83705031 0.61259591 1.0 Pd Pd9 1 0.66294969 0.16294969 0.61259591 1.0 Pd Pd10 1 0.16734932 0.66734932 0.38580349 1.0 Pd Pd11 1 0.16734932 0.33265068 0.38580349 1.0 Pd Pd12 1 0.83265068 0.66734932 0.38580349 1.0 Pd Pd13 1 0.83265068 0.33265068 0.38580349 1.0 Pd Pd14 1 0.50000000 0.77271187 0.26287602 1.0 Pd Pd15 1 0.50000000 0.22728813 0.26287602 1.0 Pd Pd16 1 0.27271187 0.00000000 0.26287602 1.0 Pd Pd17 1 0.72728813 0.00000000 0.26287602 1.0 Pd Pd18 1 0.00000000 0.72881216 0.74232778 1.0 Pd Pd19 1 0.00000000 0.27118784 0.74232778 1.0 Pd Pd20 1 0.22881216 0.50000000 0.74232778 1.0 Pd Pd21 1 0.77118784 0.50000000 0.74232778 1.0 Pd Pd22 1 0.50000000 0.34778417 0.85445581 1.0 Pd Pd23 1 0.50000000 0.65221583 0.85445581 1.0 Pd Pd24 1 0.84778417 0.00000000 0.85445581 1.0 Pd Pd25 1 0.15221583 0.00000000 0.85445581 1.0 Pd Pd26 1 0.00000000 0.15175682 0.14202079 1.0 Pd Pd27 1 0.00000000 0.84824318 0.14202079 1.0 Pd Pd28 1 0.65175682 0.50000000 0.14202079 1.0 Pd Pd29 1 0.34824318 0.50000000 0.14202079 1.0 Pd Pd30 1 0.25099523 0.75099523 0.00054543 1.0 Pd Pd31 1 0.25099523 0.24900477 0.00054543 1.0 Pd Pd32 1 0.74900477 0.75099523 0.00054543 1.0 Pd Pd33 1 0.74900477 0.24900477 0.00054543 1.0