data_[Y12Ni2Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ni  1.9100  1.3500  0.7400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.5987]
_cell_length_b [7.2664]
_cell_length_c [11.9148]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.2405]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Y6NiPd2]
_chemical_formula_sum '[Y12 Ni2 Pd4]'
_cell_volume [477.8196]
_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
[
  Y  Y0  4  0.0968  0.1831  0.4350  1.0
  Y  Y1  4  0.2588  0.6770  0.4329  1.0
  Y  Y2  4  0.3971  0.0352  0.2475  1.0
  Ni  Ni3  2  0.5000  0.0000  0.5000  1.0
  Pd  Pd4  4  0.1853  0.1158  0.7444  1.0
]