data_[Tb4Re4Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Re  1.9000  1.3500  0.7125
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.2254]
_cell_length_b [4.3253]
_cell_length_c [10.3077]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.0480]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TbReGe]
_chemical_formula_sum '[Tb4 Re4 Ge4]'
_cell_volume [270.3879]
_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
[
  Tb  Tb0  4  0.1516  0.0000  0.3546  1
  Re  Re1  4  0.1898  0.5000  0.9379  1
  Ge  Ge2  4  0.2092  0.5000  0.1878  1
]