data_[Rb6Pa2Sn4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Pa  1.5000  1.8000  1.0400
  Sn  1.9600  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.3610]
_cell_length_b [12.7310]
_cell_length_c [7.9099]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.9888]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Rb3Pa(SnS3)2]
_chemical_formula_sum '[Rb6 Pa2 Sn4 S12]'
_cell_volume [705.0253]
_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  4  0.0000  0.1748  0.5000  1
  Rb  Rb1  2  0.0000  0.5000  0.5000  1
  Pa  Pa2  2  0.0000  0.0000  0.0000  1
  Sn  Sn3  4  0.0000  0.3345  0.0000  1
  S  S4  8  0.2173  0.1533  0.1924  1
  S  S5  4  0.2406  0.0000  0.8053  1
]