data_[Cs4Be4Co4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Be  1.5700  1.0500  0.5900
  Co  1.8800  1.3500  0.7683
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.5541]
_cell_length_b [15.2430]
_cell_length_c [9.0950]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [CsBeCoS3]
_chemical_formula_sum '[Cs4 Be4 Co4 S12]'
_cell_volume [492.7216]
_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
[
  Cs  Cs0  4  0.0000  0.2533  0.2500  1
  Be  Be1  4  0.0000  0.4731  0.7500  1
  Co  Co2  4  0.0000  0.0000  0.0000  1
  S  S3  8  0.0000  0.4066  0.5513  1
  S  S4  4  0.0000  0.0511  0.7500  1
]