data_[Zn6Ni2Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Ni  1.9100  1.3500  0.7400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.4304]
_cell_length_b [4.3881]
_cell_length_c [9.3726]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.9406]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Zn3NiPd6]
_chemical_formula_sum '[Zn6 Ni2 Pd12]'
_cell_volume [290.7376]
_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
[
  Zn  Zn0  2  0.2275  0.2500  0.0160  1
  Zn  Zn1  2  0.3596  0.7500  0.7858  1
  Zn  Zn2  2  0.4519  0.2500  0.6100  1
  Ni  Ni3  2  0.0443  0.2500  0.4118  1
  Pd  Pd4  2  0.0728  0.7500  0.8777  1
  Pd  Pd5  2  0.1495  0.7500  0.1840  1
  Pd  Pd6  2  0.1518  0.2500  0.7008  1
  Pd  Pd7  2  0.2492  0.7500  0.4941  1
  Pd  Pd8  2  0.3487  0.2500  0.3162  1
  Pd  Pd9  2  0.4640  0.7500  0.0872  1
]