data_[As4Pd16Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  As  2.1800  1.1500  0.6600
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.2377]
_cell_length_b [11.0829]
_cell_length_c [5.0234]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.6144]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [AsPd4Pt]
_chemical_formula_sum '[As4 Pd16 Pt4]'
_cell_volume [377.4402]
_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
[
  As  As0  4  0.0000  0.1532  0.7500  1.0
  Pd  Pd1  8  0.1640  0.4388  0.7357  1.0
  Pd  Pd2  8  0.1649  0.3018  0.2006  1.0
  Pt  Pt3  4  0.0000  0.0734  0.2500  1.0
]