data_[Cs3Na1P2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Na  0.9300  1.8000  1.1600
  P  2.1900  1.0000  0.5500
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [6.3817]
_cell_length_b [6.5895]
_cell_length_c [6.7960]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.1510]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Cs3Na(PAu)2]
_chemical_formula_sum '[Cs3 Na1 P2 Au2]'
_cell_volume [274.5071]
_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
[
  Cs  Cs0  1  0.0135  0.5000  0.6796  1
  Cs  Cs1  1  0.3187  0.0000  0.9798  1
  Cs  Cs2  1  0.6822  0.5000  0.0431  1
  Na  Na3  1  0.0471  0.0000  0.4038  1
  P  P4  1  0.2422  0.5000  0.2679  1
  P  P5  1  0.7347  0.0000  0.6609  1
  Au  Au6  2  0.4808  0.2526  0.4824  1
]