data_[Ni2Sn2Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Sn  1.9600  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [3.9776]
_cell_length_b [3.8062]
_cell_length_c [6.4707]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.9864]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [NiSnPd]
_chemical_formula_sum '[Ni2 Sn2 Pd2]'
_cell_volume [96.7607]
_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
[
  Ni  Ni0  2  0.2488  0.7500  0.4947  1.0
  Sn  Sn1  2  0.3210  0.2500  0.7688  1.0
  Pd  Pd2  2  0.1624  0.2500  0.1650  1.0
]