data_[Tl4Co4S4O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Co  1.8800  1.3500  0.7683
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.1239]
_cell_length_b [5.9792]
_cell_length_c [7.0532]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.7879]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [TlCoSO]
_chemical_formula_sum '[Tl4 Co4 S4 O4]'
_cell_volume [295.1206]
_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
[
  Tl  Tl0  4  0.1148  0.2260  0.9840  1
  Co  Co1  4  0.4723  0.6266  0.2077  1
  S  S2  4  0.3041  0.6304  0.8691  1
  O  O3  4  0.3596  0.1327  0.7828  1
]