data_[Cs8Mo2F14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Mo  2.1600  1.4500  0.7750
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.2857]
_cell_length_b [4.3139]
_cell_length_c [10.7787]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.4079]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs4MoF7]
_chemical_formula_sum '[Cs8 Mo2 F14]'
_cell_volume [646.3064]
_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
[
  Cs  Cs0  4  0.0344  0.5000  0.3350  1
  Cs  Cs1  4  0.2497  0.5000  0.1888  1
  Mo  Mo2  2  0.0000  0.0000  0.0000  1
  F  F3  4  0.1000  0.0000  0.9328  1
  F  F4  4  0.1116  0.0000  0.2180  1
  F  F5  4  0.1297  0.5000  0.6416  1
  F  F6  2  0.0000  0.5000  0.0000  1
]