data_[Rb2Sr1Pa1S4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Sr  0.9500  2.0000  1.3200
  Pa  1.5000  1.8000  1.0400
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.4299]
_cell_length_b [4.2433]
_cell_length_c [8.0618]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.6473]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Rb2SrPaS4]
_chemical_formula_sum '[Rb2 Sr1 Pa1 S4]'
_cell_volume [242.2091]
_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  0.5000  0.5000  1
  Rb  Rb1  1  0.5000  0.0000  0.5000  1
  Sr  Sr2  1  0.5000  0.5000  0.0000  1
  Pa  Pa3  1  0.0000  0.0000  0.0000  1
  S  S4  2  0.2112  0.5000  0.1937  1
  S  S5  2  0.2390  0.0000  0.8032  1
]