data_[Li6Ac4Ge2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ac  1.1000  1.9500  1.2600
  Ge  2.0100  1.2500  0.7700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.8613]
_cell_length_b [11.3477]
_cell_length_c [5.2417]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.2040]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li3Ac2GeO6]
_chemical_formula_sum '[Li6 Ac4 Ge2 O12]'
_cell_volume [331.1863]
_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
[
  Li  Li0  4  0.0000  0.1027  0.5000  1
  Li  Li1  2  0.0000  0.5000  0.5000  1
  Ac  Ac2  4  0.0000  0.3313  0.0000  1
  Ge  Ge3  2  0.0000  0.0000  0.0000  1
  O  O4  8  0.2016  0.1332  0.2417  1
  O  O5  4  0.2456  0.0000  0.7677  1
]