data_[Li2Ca1Cd10]
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 [P-1]
_cell_length_a [5.7152]
_cell_length_b [7.6191]
_cell_length_c [7.6466]
_cell_angle_alpha [83.4176]
_cell_angle_beta [69.6480]
_cell_angle_gamma [69.2711]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li2CaCd10]
_chemical_formula_sum '[Li2 Ca1 Cd10]'
_cell_volume [291.9617]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.5000  1.0
  Li  Li1  1  0.5000  0.0000  0.5000  1.0
  Ca  Ca2  1  0.0000  0.0000  0.0000  1.0
  Cd  Cd3  2  0.0128  0.3345  0.6423  1.0
  Cd  Cd4  2  0.2833  0.2072  0.2270  1.0
  Cd  Cd5  2  0.3400  0.6655  0.6421  1.0
  Cd  Cd6  2  0.4904  0.7939  0.2271  1.0
  Cd  Cd7  1  0.0000  0.5000  0.0000  1.0
  Cd  Cd8  1  0.5000  0.5000  0.0000  1.0
]