data_[Na4As8Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  As  2.1800  1.1500  0.6600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.8389]
_cell_length_b [4.1253]
_cell_length_c [7.6946]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.5161]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NaAs2Pd3]
_chemical_formula_sum '[Na4 As8 Pd12]'
_cell_volume [453.7327]
_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
[
  Na  Na0  4  0.1562  0.0000  0.0664  1.0
  As  As1  4  0.0146  0.5000  0.1722  1.0
  As  As2  4  0.1886  0.0000  0.6777  1.0
  Pd  Pd3  4  0.0449  0.0000  0.3654  1.0
  Pd  Pd4  4  0.0961  0.5000  0.6785  1.0
  Pd  Pd5  4  0.1823  0.5000  0.4225  1.0
]