data_[Cs3Pa12Ag3N24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Pa  1.5000  1.8000  1.0400
  Ag  1.9300  1.6000  1.0867
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [7.2448]
_cell_length_b [7.2448]
_cell_length_c [16.5891]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [CsPa4AgN8]
_chemical_formula_sum '[Cs3 Pa12 Ag3 N24]'
_cell_volume [754.0564]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.3821  1
  Pa  Pa1  9  0.1716  0.3432  0.8336  1
  Pa  Pa2  3  0.0000  0.0000  0.6180  1
  Ag  Ag3  3  0.0000  0.0000  0.0025  1
  N  N4  9  0.0018  0.5009  0.2370  1
  N  N5  9  0.0650  0.5325  0.7696  1
  N  N6  3  0.0000  0.0000  0.2244  1
  N  N7  3  0.0000  0.0000  0.7524  1
]