data_[La4Mn4Ge8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Mn  1.5500  1.4000  0.6483
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [7.5709]
_cell_length_b [4.1629]
_cell_length_c [10.5569]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [LaMnGe2]
_chemical_formula_sum '[La4 Mn4 Ge8]'
_cell_volume [332.7161]
_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  0.1391  0.7500  0.1299  1.0
  Mn  Mn1  4  0.0149  0.2500  0.3960  1.0
  Ge  Ge2  4  0.1609  0.7500  0.8086  1.0
  Ge  Ge3  4  0.2086  0.7500  0.4367  1.0
]