data_[K2Fe2Co4Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Fe  1.8300  1.4000  0.8525
  Co  1.8800  1.3500  0.7683
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.3049]
_cell_length_b [7.0553]
_cell_length_c [9.2191]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.8354]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [KFe(CoCl4)2]
_chemical_formula_sum '[K2 Fe2 Co4 Cl16]'
_cell_volume [667.8841]
_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
[
  K  K0  2  0.0000  0.0000  0.5000  1.0
  Fe  Fe1  2  0.0000  0.0000  0.0000  1.0
  Co  Co2  4  0.1231  0.5000  0.7939  1.0
  Cl  Cl3  8  0.0102  0.2428  0.1944  1.0
  Cl  Cl4  4  0.1961  0.5000  0.5794  1.0
  Cl  Cl5  4  0.2330  0.0000  0.0072  1.0
]