data_[Sr6Al4Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Al  1.6100  1.2500  0.6750
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.3732]
_cell_length_b [4.2881]
_cell_length_c [8.9978]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.7845]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr3(AlPd2)2]
_chemical_formula_sum '[Sr6 Al4 Pd8]'
_cell_volume [431.0662]
_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
[
  Sr  Sr0  4  0.1207  0.5000  0.3840  1
  Sr  Sr1  2  0.0000  0.0000  0.0000  1
  Al  Al2  4  0.1786  0.5000  0.7908  1
  Pd  Pd3  4  0.0943  0.0000  0.6450  1
  Pd  Pd4  4  0.2277  0.5000  0.0883  1
]