data_[Ca2Co2Ag4F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  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 [P2_1/c]
_cell_length_a [5.8050]
_cell_length_b [5.9251]
_cell_length_c [10.1360]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.9058]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [CaCoAg2F6]
_chemical_formula_sum '[Ca2 Co2 Ag4 F12]'
_cell_volume [289.3434]
_cell_formula_units_Z [2]
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
[
  Ca  Ca0  2  0.5000  0.0000  0.0000  1.0
  Co  Co1  2  0.0000  0.0000  0.5000  1.0
  Ag  Ag2  4  0.2355  0.0462  0.2493  1.0
  F  F3  4  0.1323  0.2209  0.9421  1.0
  F  F4  4  0.2237  0.6947  0.9447  1.0
  F  F5  4  0.3483  0.0404  0.7404  1.0
]