data_[Rb2Li4Pa4S12]
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
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.2072]
_cell_length_b [12.5947]
_cell_length_c [6.8686]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.9650]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [RbLi2(PaS3)2]
_chemical_formula_sum '[Rb2 Li4 Pa4 S12]'
_cell_volume [607.5842]
_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
[
  Rb  Rb0  2  0.0000  0.5000  0.5000  1
  Li  Li1  4  0.0000  0.1218  0.0000  1
  Pa  Pa2  4  0.0000  0.1674  0.5000  1
  S  S3  8  0.2485  0.2039  0.2691  1
  S  S4  4  0.1181  0.0000  0.7500  1
]