data_[Sr4Co4F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Co  1.8800  1.3500  0.7683
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.1472]
_cell_length_b [15.3635]
_cell_length_c [5.6700]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [SrCoF4]
_chemical_formula_sum '[Sr4 Co4 F16]'
_cell_volume [361.2648]
_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
[
  Sr  Sr0  4  0.0000  0.3272  0.2500  1.0
  Co  Co1  4  0.0000  0.0909  0.2500  1.0
  F  F2  8  0.0000  0.1882  0.5054  1.0
  F  F3  4  0.0000  0.0000  0.0000  1.0
  F  F4  4  0.0000  0.3909  0.7500  1.0
]