data_[Li4Sn14Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sn  1.9600  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.9940]
_cell_length_b [12.6329]
_cell_length_c [5.4041]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.1995]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2Sn7Pd2]
_chemical_formula_sum '[Li4 Sn14 Pd4]'
_cell_volume [540.1674]
_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  0.3401  0.5000  1
  Sn  Sn1  8  0.1732  0.2072  0.2131  1
  Sn  Sn2  4  0.1537  0.5000  0.2203  1
  Sn  Sn3  2  0.0000  0.0000  0.0000  1
  Pd  Pd4  4  0.1905  0.5000  0.7245  1
]