# generated using pymatgen data_Nd2Si(Pd6Au)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.99272841 _cell_length_b 8.99272841 _cell_length_c 7.10213284 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2Si(Pd6Au)2 _chemical_formula_sum 'Nd4 Si2 Pd24 Au4' _cell_volume 574.34354778 _cell_formula_units_Z 2 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 0.92557002 1.0 Nd Nd1 1 0.00000000 0.50000000 0.07442998 1.0 Nd Nd2 1 0.00000000 0.00000000 0.50000000 1.0 Nd Nd3 1 0.50000000 0.50000000 0.50000000 1.0 Si Si4 1 0.50000000 0.00000000 0.44144186 1.0 Si Si5 1 0.00000000 0.50000000 0.55855814 1.0 Pd Pd6 1 0.33631209 0.83631209 0.60971562 1.0 Pd Pd7 1 0.33631209 0.16368791 0.60971562 1.0 Pd Pd8 1 0.66368791 0.83631209 0.60971562 1.0 Pd Pd9 1 0.66368791 0.16368791 0.60971562 1.0 Pd Pd10 1 0.16368791 0.66368791 0.39028438 1.0 Pd Pd11 1 0.16368791 0.33631209 0.39028438 1.0 Pd Pd12 1 0.83631209 0.66368791 0.39028438 1.0 Pd Pd13 1 0.83631209 0.33631209 0.39028438 1.0 Pd Pd14 1 0.50000000 0.77111038 0.25545491 1.0 Pd Pd15 1 0.50000000 0.22888962 0.25545491 1.0 Pd Pd16 1 0.27111038 0.00000000 0.25545491 1.0 Pd Pd17 1 0.72888962 0.00000000 0.25545491 1.0 Pd Pd18 1 0.00000000 0.72888962 0.74454509 1.0 Pd Pd19 1 0.00000000 0.27111038 0.74454509 1.0 Pd Pd20 1 0.22888962 0.50000000 0.74454509 1.0 Pd Pd21 1 0.77111038 0.50000000 0.74454509 1.0 Pd Pd22 1 0.50000000 0.34845121 0.85208094 1.0 Pd Pd23 1 0.50000000 0.65154879 0.85208094 1.0 Pd Pd24 1 0.84845121 0.00000000 0.85208094 1.0 Pd Pd25 1 0.15154879 0.00000000 0.85208094 1.0 Pd Pd26 1 0.00000000 0.15154879 0.14791906 1.0 Pd Pd27 1 0.00000000 0.84845121 0.14791906 1.0 Pd Pd28 1 0.65154879 0.50000000 0.14791906 1.0 Pd Pd29 1 0.34845121 0.50000000 0.14791906 1.0 Au Au30 1 0.25000000 0.75000000 0.00000000 1.0 Au Au31 1 0.25000000 0.25000000 0.00000000 1.0 Au Au32 1 0.75000000 0.75000000 0.00000000 1.0 Au Au33 1 0.75000000 0.25000000 0.00000000 1.0