data_[La4Sc4Ge4O20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sc  1.3600  1.6000  0.8850
  Ge  2.0100  1.2500  0.7700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [6.9491]
_cell_length_b [9.3464]
_cell_length_c [7.3610]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.0814]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LaScGeO5]
_chemical_formula_sum '[La4 Sc4 Ge4 O20]'
_cell_volume [443.0193]
_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
[
  La  La0  4  0.0000  0.3260  0.2500  1.0
  Sc  Sc1  4  0.0000  0.0000  0.0000  1.0
  Ge  Ge2  4  0.0000  0.3230  0.7500  1.0
  O  O3  8  0.1101  0.2136  0.6157  1.0
  O  O4  8  0.1766  0.4406  0.9231  1.0
  O  O5  4  0.0000  0.0869  0.2500  1.0
]