data_[La4Ge1Sb1S2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ge  2.0100  1.2500  0.7700
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.4879]
_cell_length_b [4.3849]
_cell_length_c [7.6188]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6728]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [La4GeSbS2]
_chemical_formula_sum '[La4 Ge1 Sb1 S2]'
_cell_volume [235.5488]
_cell_formula_units_Z [1]
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  2  0.2544  0.5000  0.2431  1.0
  La  La1  2  0.2606  0.0000  0.7632  1.0
  Ge  Ge2  1  0.0000  0.0000  0.0000  1.0
  Sb  Sb3  1  0.0000  0.5000  0.5000  1.0
  S  S4  1  0.5000  0.0000  0.5000  1.0
  S  S5  1  0.5000  0.5000  0.0000  1.0
]