data_[Sr8Li2Cu2C4O20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Li  0.9800  1.4500  0.9000
  Cu  1.9000  1.3500  0.8200
  C  2.5500  0.7000  0.3000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [I-42m]
_cell_length_a [5.5763]
_cell_length_b [5.5763]
_cell_length_c [14.8337]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [121]
_chemical_formula_structural [Sr4LiCu(CO5)2]
_chemical_formula_sum '[Sr8 Li2 Cu2 C4 O20]'
_cell_volume [461.2532]
_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
[
  Sr  Sr0  8  0.0000  0.5000  0.1130  1.0
  Li  Li1  2  0.0000  0.0000  0.0000  1.0
  Cu  Cu2  2  0.0000  0.0000  0.5000  1.0
  C  C3  4  0.0000  0.0000  0.2382  1.0
  O  O4  8  0.1437  0.1437  0.2809  1.0
  O  O5  8  0.2352  0.2352  0.5036  1.0
  O  O6  4  0.0000  0.0000  0.1500  1.0
]