data_[Li1Nd2As4Pd3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Nd  1.1400  1.8500  1.2765
  As  2.1800  1.1500  0.6600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.2015]
_cell_length_b [4.2015]
_cell_length_c [11.0341]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [LiNd2As4Pd3]
_chemical_formula_sum '[Li1 Nd2 As4 Pd3]'
_cell_volume [194.7765]
_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  0.5000  0.5000  0.5000  1
  Nd  Nd1  2  0.0000  0.5000  0.7400  1
  As  As2  2  0.0000  0.5000  0.3642  1
  As  As3  1  0.0000  0.0000  0.0000  1
  As  As4  1  0.5000  0.5000  0.0000  1
  Pd  Pd5  2  0.0000  0.5000  0.1383  1
  Pd  Pd6  1  0.0000  0.0000  0.5000  1
]