data_[Co4Ag4F12]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.9287]
_cell_length_b [3.9422]
_cell_length_c [6.6432]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.6366]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CoAgF3]
_chemical_formula_sum '[Co4 Ag4 F12]'
_cell_volume [282.1713]
_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
[
  Co  Co0  4  0.1303  0.0000  0.9171  1
  Ag  Ag1  4  0.1139  0.5000  0.4149  1
  F  F2  4  0.0574  0.0000  0.1901  1
  F  F3  4  0.1650  0.0000  0.6307  1
  F  F4  4  0.1687  0.5000  0.9744  1
]