data_[Rb1Li2Pa2Se6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Li  0.9800  1.4500  0.9000
  Pa  1.5000  1.8000  1.0400
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P-31m]
_cell_length_a [7.4228]
_cell_length_b [7.4228]
_cell_length_c [6.9798]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [162]
_chemical_formula_structural [RbLi2(PaSe3)2]
_chemical_formula_sum '[Rb1 Li2 Pa2 Se6]'
_cell_volume [333.0484]
_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
[
  Rb  Rb0  1  0.0000  0.0000  0.5000  1
  Li  Li1  2  0.3333  0.6667  0.0000  1
  Pa  Pa2  2  0.3333  0.6667  0.5000  1
  Se  Se3  6  0.0000  0.4046  0.7446  1
]