data_[Co3Ag6Sn9S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Ag  1.9300  1.6000  1.0867
  Sn  1.9600  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.5907]
_cell_length_b [7.5907]
_cell_length_c [18.0855]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [CoAg2Sn3S8]
_chemical_formula_sum '[Co3 Ag6 Sn9 S24]'
_cell_volume [902.4553]
_cell_formula_units_Z [3]
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
[
  Co  Co0  3  0.0000  0.0000  0.0000  1.0
  Ag  Ag1  6  0.0000  0.0000  0.3902  1.0
  Sn  Sn2  9  0.0000  0.5000  0.5000  1.0
  S  S3  18  0.0445  0.5223  0.7454  1.0
  S  S4  6  0.0000  0.0000  0.2470  1.0
]