data_[Cr4Ga2F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
  Ga  1.8100  1.3000  0.7600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.1098]
_cell_length_b [6.6816]
_cell_length_c [4.4118]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.2717]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cr2GaF8]
_chemical_formula_sum '[Cr4 Ga2 F16]'
_cell_volume [268.0982]
_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
[
  Cr  Cr0  4  0.1257  0.5000  0.2514  1.0
  Ga  Ga1  2  0.0000  0.0000  0.0000  1.0
  F  F2  8  0.1090  0.2053  0.2273  1.0
  F  F3  4  0.0946  0.5000  0.7493  1.0
  F  F4  4  0.1585  0.0000  0.7398  1.0
]