data_[Tb8Be2Cl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Be  1.5700  1.0500  0.5900
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.5959]
_cell_length_b [3.7984]
_cell_length_c [8.1991]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.1773]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb4BeCl5]
_chemical_formula_sum '[Tb8 Be2 Cl10]'
_cell_volume [533.5720]
_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
[
  Tb  Tb0  4  0.0008  0.0000  0.7689  1
  Tb  Tb1  4  0.1518  0.5000  0.0850  1
  Be  Be2  2  0.0000  0.5000  0.0000  1
  Cl  Cl3  4  0.1652  0.0000  0.3318  1
  Cl  Cl4  4  0.1738  0.0000  0.8466  1
  Cl  Cl5  2  0.0000  0.5000  0.5000  1
]