data_[Sr2Li1Th1Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Li  0.9800  1.4500  0.9000
  Th  1.3000  1.8000  1.0800
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.7431]
_cell_length_b [6.5413]
_cell_length_c [6.8037]
_cell_angle_alpha [109.4857]
_cell_angle_beta [100.6887]
_cell_angle_gamma [106.1120]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Sr2LiThPd6]
_chemical_formula_sum '[Sr2 Li1 Th1 Pd6]'
_cell_volume [220.3126]
_cell_formula_units_Z [1]
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
[
  Sr  Sr0  2  0.4779  0.8398  0.1933  1
  Li  Li1  1  0.0000  0.0000  0.0000  1
  Th  Th2  1  0.0000  0.5000  0.5000  1
  Pd  Pd3  2  0.0907  0.3579  0.8532  1
  Pd  Pd4  2  0.1435  0.1247  0.4142  1
  Pd  Pd5  2  0.4745  0.3863  0.2732  1
]