data_[Be24Co16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Be  1.5700  1.0500  0.5900
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [Fdd2]
_cell_length_a [7.4461]
_cell_length_b [10.5935]
_cell_length_c [4.3722]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [43]
_chemical_formula_structural [Be3Co2]
_chemical_formula_sum '[Be24 Co16]'
_cell_volume [344.8786]
_cell_formula_units_Z [8]
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  16  0.0604  0.3881  0.1146  1.0
  Be  Be1  8  0.0000  0.0000  0.0169  1.0
  Co  Co2  16  0.0602  0.3042  0.6270  1.0
]