data_[Zr8Ga4Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Ga  1.8100  1.3000  0.7600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.3424]
_cell_length_b [5.8225]
_cell_length_c [7.0973]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.9876]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Zr2GaPd2]
_chemical_formula_sum '[Zr8 Ga4 Pd8]'
_cell_volume [365.0661]
_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
[
  Zr  Zr0  8  0.1669  0.3880  0.1510  1.0
  Ga  Ga1  4  0.0000  0.2391  0.7500  1.0
  Pd  Pd2  8  0.1146  0.1290  0.4663  1.0
]