data_[Ac2Tm4F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Tm  1.2500  1.7500  1.0950
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.9400]
_cell_length_b [10.4616]
_cell_length_c [4.2642]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.3367]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [AcTm2F8]
_chemical_formula_sum '[Ac2 Tm4 F16]'
_cell_volume [298.5715]
_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  0.5000  1
  Tm  Tm1  4  0.0000  0.3208  0.0000  1
  F  F2  8  0.1869  0.1326  0.0612  1
  F  F3  4  0.0000  0.2522  0.5000  1
  F  F4  4  0.1094  0.5000  0.2853  1
]