data_[Sr12Ag12Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.6528]
_cell_length_b [11.1988]
_cell_length_c [16.3227]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Sr3Ag3Pd2]
_chemical_formula_sum '[Sr12 Ag12 Pd8]'
_cell_volume [850.5107]
_cell_formula_units_Z [4]
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  8  0.0000  0.0959  0.5992  1.0
  Sr  Sr1  4  0.0000  0.3718  0.7500  1.0
  Ag  Ag2  8  0.0000  0.3842  0.5392  1.0
  Ag  Ag3  4  0.0000  0.3374  0.2500  1.0
  Pd  Pd4  8  0.0000  0.2017  0.1082  1.0
]