data_[Ac2Ti2Mo2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Ti  1.5400  1.4000  0.8517
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P4_2nm]
_cell_length_a [5.0122]
_cell_length_b [5.0122]
_cell_length_c [9.9238]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [AcTiMoO6]
_chemical_formula_sum '[Ac2 Ti2 Mo2 O12]'
_cell_volume [249.3048]
_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
[
  Ac  Ac0  2  0.0000  0.0000  0.9974  1
  Ti  Ti1  2  0.0000  0.0000  0.3418  1
  Mo  Mo2  2  0.0000  0.0000  0.6635  1
  O  O3  4  0.1666  0.8334  0.4983  1
  O  O4  4  0.2347  0.7653  0.8049  1
  O  O5  4  0.2363  0.7637  0.1955  1
]