# generated using pymatgen data_Ba3Na(Si2Au5)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.90188531 _cell_length_b 9.06206576 _cell_length_c 10.61730898 _cell_angle_alpha 88.56708678 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3Na(Si2Au5)4 _chemical_formula_sum 'Ba3 Na1 Si8 Au20' _cell_volume 663.85552564 _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 Ba Ba0 1 0.25000000 0.74044227 0.38331734 1.0 Ba Ba1 1 0.75000000 0.75208656 0.88686985 1.0 Ba Ba2 1 0.75000000 0.26098205 0.61601927 1.0 Na Na3 1 0.25000000 0.24174747 0.12261308 1.0 Si Si4 1 0.25000000 0.05096011 0.66734250 1.0 Si Si5 1 0.25000000 0.53880716 0.84364067 1.0 Si Si6 1 0.75000000 0.94883608 0.32995796 1.0 Si Si7 1 0.75000000 0.46225160 0.15329039 1.0 Si Si8 1 0.25000000 0.30133508 0.44515398 1.0 Si Si9 1 0.25000000 0.81662432 0.05166091 1.0 Si Si10 1 0.75000000 0.69920519 0.55070166 1.0 Si Si11 1 0.75000000 0.18025220 0.95052680 1.0 Au Au12 1 0.04312419 0.08393070 0.38212974 1.0 Au Au13 1 0.44927949 0.58667313 0.11127069 1.0 Au Au14 1 0.54295202 0.91786084 0.61474369 1.0 Au Au15 1 0.95823377 0.40315222 0.89535680 1.0 Au Au16 1 0.95704798 0.91786084 0.61474369 1.0 Au Au17 1 0.54176623 0.40315222 0.89535680 1.0 Au Au18 1 0.45687581 0.08393070 0.38212974 1.0 Au Au19 1 0.05072051 0.58667313 0.11127069 1.0 Au Au20 1 0.04055086 0.07493985 0.87045413 1.0 Au Au21 1 0.46702901 0.58690700 0.64583681 1.0 Au Au22 1 0.53072535 0.93738588 0.13045593 1.0 Au Au23 1 0.96742058 0.41059988 0.35032337 1.0 Au Au24 1 0.96927465 0.93738588 0.13045593 1.0 Au Au25 1 0.53257942 0.41059988 0.35032337 1.0 Au Au26 1 0.45944914 0.07493985 0.87045413 1.0 Au Au27 1 0.03297099 0.58690700 0.64583681 1.0 Au Au28 1 0.25000000 0.31872653 0.67381004 1.0 Au Au29 1 0.25000000 0.80810314 0.82393595 1.0 Au Au30 1 0.75000000 0.68080177 0.32362716 1.0 Au Au31 1 0.75000000 0.19593750 0.17639010 1.0