data_[Li4Ca14Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ca  1.0000  1.8000  1.1400
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [7.8749]
_cell_length_b [12.0048]
_cell_length_c [8.3220]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Li2Ca7Cd2]
_chemical_formula_sum '[Li4 Ca14 Cd4]'
_cell_volume [786.7375]
_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
[
  Li  Li0  4  0.0000  0.2971  0.0000  1
  Ca  Ca1  8  0.2500  0.2500  0.2928  1
  Ca  Ca2  4  0.0000  0.5000  0.2630  1
  Ca  Ca3  2  0.0000  0.0000  0.0000  1
  Cd  Cd4  4  0.1785  0.0000  0.5000  1
]