data_[Li10Ca2Ag14]
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
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [5.3008]
_cell_length_b [9.5425]
_cell_length_c [9.3046]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [Li5CaAg7]
_chemical_formula_sum '[Li10 Ca2 Ag14]'
_cell_volume [470.6566]
_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  8  0.2476  0.2540  0.2511  1.0
  Li  Li1  2  0.0000  0.5000  0.7241  1.0
  Ca  Ca2  2  0.0000  0.0000  0.9936  1.0
  Ag  Ag3  4  0.0000  0.2810  0.5024  1.0
  Ag  Ag4  4  0.0000  0.3508  0.9986  1.0
  Ag  Ag5  2  0.0000  0.0000  0.3442  1.0
  Ag  Ag6  2  0.0000  0.0000  0.6462  1.0
  Ag  Ag7  2  0.0000  0.5000  0.2854  1.0
]