data_[Sr4Sn4Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Sn  1.9600  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.9577]
_cell_length_b [4.2774]
_cell_length_c [7.5323]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.3614]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr2Sn2Pd3]
_chemical_formula_sum '[Sr4 Sn4 Pd6]'
_cell_volume [350.9611]
_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
[
  Sr  Sr0  4  0.1259  0.0000  0.7503  1.0
  Sn  Sn1  4  0.1459  0.0000  0.2143  1.0
  Pd  Pd2  4  0.1501  0.5000  0.4290  1.0
  Pd  Pd3  2  0.0000  0.5000  0.0000  1.0
]