data_[Co32Sn8C128O128]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Sn  1.9600  1.4500  0.8300
  C  2.5500  0.7000  0.3000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [F-43c]
_cell_length_a [16.6138]
_cell_length_b [16.6138]
_cell_length_c [16.6138]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [219]
_chemical_formula_structural [Co4Sn(CO)16]
_chemical_formula_sum '[Co32 Sn8 C128 O128]'
_cell_volume [4585.7078]
_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
[
  Co  Co0  32  0.0909  0.0909  0.4091  1
  Sn  Sn1  8  0.0000  0.0000  0.0000  1
  C  C2  96  0.0058  0.1015  0.8468  1
  C  C3  32  0.1517  0.1517  0.3483  1
  O  O4  96  0.0460  0.1125  0.1987  1
  O  O5  32  0.1917  0.1917  0.8083  1
]