data_[La4Ag3Pd1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [4.0021]
_cell_length_b [4.9215]
_cell_length_c [11.4382]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [La4Ag3Pd]
_chemical_formula_sum '[La4 Ag3 Pd1]'
_cell_volume [225.2912]
_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
[
  La  La0  1  0.0000  0.0000  0.1373  1
  La  La1  1  0.0000  0.5000  0.8719  1
  La  La2  1  0.5000  0.0000  0.6414  1
  La  La3  1  0.5000  0.5000  0.3488  1
  Ag  Ag4  1  0.0000  0.0000  0.4207  1
  Ag  Ag5  1  0.0000  0.5000  0.5754  1
  Ag  Ag6  1  0.5000  0.0000  0.9226  1
  Pd  Pd7  1  0.5000  0.5000  0.0819  1
]