data_[Cs1Co1As1F6]
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
  As  2.1800  1.1500  0.6600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.4208]
_cell_length_b [5.5338]
_cell_length_c [6.4721]
_cell_angle_alpha [90.4190]
_cell_angle_beta [91.8491]
_cell_angle_gamma [114.2800]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [CsCoAsF6]
_chemical_formula_sum '[Cs1 Co1 As1 F6]'
_cell_volume [176.8359]
_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  0.0019  0.0019  0.9982  1.0
  Co  Co1  1  0.3264  0.6845  0.4972  1.0
  As  As2  1  0.6784  0.3271  0.5011  1.0
  F  F3  1  0.0541  0.4500  0.6975  1.0
  F  F4  1  0.3846  0.3652  0.3407  1.0
  F  F5  1  0.4055  0.0265  0.6796  1.0
  F  F6  1  0.5521  0.9428  0.2955  1.0
  F  F7  1  0.6345  0.5985  0.6641  1.0
  F  F8  1  0.9624  0.6033  0.3261  1.0
]