data_[Cs1Co1Hg2F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Co  1.8800  1.3500  0.7683
  Hg  2.0000  1.5000  1.2450
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0818]
_cell_length_b [5.4438]
_cell_length_c [8.3868]
_cell_angle_alpha [100.5273]
_cell_angle_beta [93.6304]
_cell_angle_gamma [90.7699]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsCoHg2F8]
_chemical_formula_sum '[Cs1 Co1 Hg2 F8]'
_cell_volume [227.5756]
_cell_formula_units_Z [1]
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
[
  Cs  Cs0  1  0.0000  0.0000  0.5000  1.0
  Co  Co1  1  0.0000  0.0000  0.0000  1.0
  Hg  Hg2  2  0.4381  0.4682  0.2066  1.0
  F  F3  2  0.1138  0.7400  0.8215  1.0
  F  F4  2  0.1788  0.8573  0.1550  1.0
  F  F5  2  0.3168  0.2388  0.9866  1.0
  F  F6  2  0.4817  0.2953  0.5770  1.0
]