data_[Ac4Pd4O11]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Pd  2.2000  1.4000  0.8462
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.7210]
_cell_length_b [5.8875]
_cell_length_c [8.0546]
_cell_angle_alpha [89.7823]
_cell_angle_beta [89.4643]
_cell_angle_gamma [89.8501]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Ac4Pd4O11]
_chemical_formula_sum '[Ac4 Pd4 O11]'
_cell_volume [271.2808]
_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
[
  Ac  Ac0  1  0.4972  0.5630  0.7563  1
  Ac  Ac1  1  0.5232  0.4527  0.2605  1
  Ac  Ac2  1  0.9828  0.9378  0.2412  1
  Ac  Ac3  1  0.9952  0.0402  0.7410  1
  Pd  Pd4  1  0.0076  0.4937  0.5005  1
  Pd  Pd5  1  0.0201  0.4836  0.9982  1
  Pd  Pd6  1  0.4828  0.0190  0.9971  1
  Pd  Pd7  1  0.4947  0.0040  0.4976  1
  O  O8  1  0.0974  0.5166  0.2475  1
  O  O9  1  0.2025  0.7940  0.9511  1
  O  O10  1  0.2072  0.7884  0.5419  1
  O  O11  1  0.2994  0.2948  0.5564  1
  O  O12  1  0.4016  0.0371  0.2467  1
  O  O13  1  0.5692  0.9868  0.7495  1
  O  O14  1  0.7000  0.7037  0.0388  1
  O  O15  1  0.7073  0.7073  0.4698  1
  O  O16  1  0.7924  0.2087  0.0411  1
  O  O17  1  0.8001  0.2025  0.4565  1
  O  O18  1  0.9232  0.4732  0.7519  1
]