data_[La2Dy2Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Dy  1.2200  1.7500  1.1310
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [4.0761]
_cell_length_b [5.9516]
_cell_length_c [8.2480]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [LaDyGe2]
_chemical_formula_sum '[La2 Dy2 Ge4]'
_cell_volume [200.0944]
_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
[
  La  La0  2  0.0000  0.1316  0.6812  1.0
  Dy  Dy1  2  0.5000  0.3701  0.3171  1.0
  Ge  Ge2  2  0.0000  0.3941  0.0397  1.0
  Ge  Ge3  2  0.5000  0.1191  0.9620  1.0
]