data_[Ti20Ge8O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Ge  2.0100  1.2500  0.7700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.0236]
_cell_length_b [13.6813]
_cell_length_c [10.3023]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Ti5Ge2O]
_chemical_formula_sum '[Ti20 Ge8 O4]'
_cell_volume [567.1255]
_cell_formula_units_Z [4]
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
[
  Ti  Ti0  8  0.0000  0.1021  0.1113  1
  Ti  Ti1  8  0.0000  0.3009  0.0656  1
  Ti  Ti2  4  0.0000  0.2721  0.7500  1
  Ge  Ge3  8  0.0000  0.0882  0.6337  1
  O  O4  4  0.0000  0.2152  0.2500  1
]