data_[Cs4Np2Pa4Se12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Np  1.3600  1.7500  1.0000
  Pa  1.5000  1.8000  1.0400
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.2477]
_cell_length_b [12.5595]
_cell_length_c [8.9956]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.3467]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs2Np(PaSe3)2]
_chemical_formula_sum '[Cs4 Np2 Pa4 Se12]'
_cell_volume [789.6513]
_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
[
  Cs  Cs0  4  0.0000  0.1657  0.0000  1
  Np  Np1  2  0.0000  0.0000  0.5000  1
  Pa  Pa2  4  0.0000  0.3341  0.5000  1
  Se  Se3  8  0.2303  0.1695  0.6853  1
  Se  Se4  4  0.2224  0.5000  0.6866  1
]