data_[Be8In4F24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Be  1.5700  1.0500  0.5900
  In  1.7800  1.5500  0.9400
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.5297]
_cell_length_b [9.1960]
_cell_length_c [4.9385]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.7133]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Be2InF6]
_chemical_formula_sum '[Be8 In4 F24]'
_cell_volume [475.6526]
_cell_formula_units_Z [4]
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
[
  Be  Be0  8  0.1718  0.4101  0.7217  1.0
  In  In1  4  0.0000  0.1120  0.7500  1.0
  F  F2  8  0.0901  0.2700  0.5903  1.0
  F  F3  8  0.1388  0.4698  0.9774  1.0
  F  F4  8  0.1820  0.1238  0.1572  1.0
]