data_[Li7Ag3Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.6104]
_cell_length_b [2.8667]
_cell_length_c [15.1258]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.5597]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Li7Ag3Pd2]
_chemical_formula_sum '[Li7 Ag3 Pd2]'
_cell_volume [198.1761]
_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  2  0.1053  0.5000  0.2155  1.0
  Li  Li1  2  0.2722  0.5000  0.5456  1.0
  Li  Li2  2  0.4252  0.0000  0.8498  1.0
  Li  Li3  1  0.0000  0.0000  0.0000  1.0
  Ag  Ag4  2  0.1865  0.0000  0.3754  1.0
  Ag  Ag5  1  0.5000  0.5000  0.0000  1.0
  Pd  Pd6  2  0.3573  0.5000  0.7082  1.0
]