data_[Fe8Co4Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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/c]
_cell_length_a [11.8399]
_cell_length_b [10.6376]
_cell_length_c [6.2393]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.5412]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Fe2CoCl6]
_chemical_formula_sum '[Fe8 Co4 Cl24]'
_cell_volume [769.9362]
_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
[
  Fe  Fe0  8  0.1973  0.4091  0.3183  1.0
  Co  Co1  4  0.0000  0.0933  0.2500  1.0
  Cl  Cl2  8  0.1093  0.0709  0.6086  1.0
  Cl  Cl3  8  0.1195  0.2436  0.1469  1.0
  Cl  Cl4  8  0.1323  0.4262  0.6192  1.0
]