data_[Ba4Sr4Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sr  0.9500  2.0000  1.3200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.7941]
_cell_length_b [4.6690]
_cell_length_c [6.5881]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.7319]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2Sr2Pd3]
_chemical_formula_sum '[Ba4 Sr4 Pd6]'
_cell_volume [485.2669]
_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
[
  Ba  Ba0  4  0.1412  0.5000  0.1254  1
  Sr  Sr1  4  0.1107  0.0000  0.6276  1
  Pd  Pd2  4  0.2345  0.5000  0.6361  1
  Pd  Pd3  2  0.0000  0.0000  0.0000  1
]