data_[Cs1Co1Te1F6]
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
  Te  2.1000  1.4000  1.2933
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.6708]
_cell_length_b [5.8339]
_cell_length_c [6.0674]
_cell_angle_alpha [88.0703]
_cell_angle_beta [89.0492]
_cell_angle_gamma [63.7966]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [CsCoTeF6]
_chemical_formula_sum '[Cs1 Co1 Te1 F6]'
_cell_volume [179.9971]
_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  0.9654  0.9733  0.9444  1
  Co  Co1  1  0.6714  0.6632  0.5130  1
  Te  Te2  1  0.3247  0.2479  0.4559  1
  F  F3  1  0.0245  0.5078  0.6827  1
  F  F4  1  0.3406  0.8954  0.3200  1
  F  F5  1  0.4935  0.9017  0.7548  1
  F  F6  1  0.5323  0.4069  0.6353  1
  F  F7  1  0.7257  0.9871  0.4022  1
  F  F8  1  0.9218  0.4169  0.2918  1
]