data_[Rb4Mn8S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Mn  1.5500  1.4000  0.6483
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [14.8477]
_cell_length_b [3.6306]
_cell_length_c [9.6267]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [RbMn2S3]
_chemical_formula_sum '[Rb4 Mn8 S12]'
_cell_volume [518.9395]
_cell_formula_units_Z [4]
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  0.2380  0.7500  0.0463  1
  Mn  Mn1  4  0.0137  0.7500  0.3541  1
  Mn  Mn2  4  0.0179  0.2500  0.1012  1
  S  S3  4  0.0759  0.2500  0.8699  1
  S  S4  4  0.0780  0.7500  0.5710  1
  S  S5  4  0.1136  0.2500  0.2824  1
]