data_[Tb8Tm6Se16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Tm  1.2500  1.7500  1.0950
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.4397]
_cell_length_b [11.4455]
_cell_length_c [8.0890]
_cell_angle_alpha [90.0000]
_cell_angle_beta [134.9525]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb4Tm3Se8]
_chemical_formula_sum '[Tb8 Tm6 Se16]'
_cell_volume [749.5219]
_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  0.2500  0.2500  0.5000  1.0
  Tb  Tb1  2  0.0000  0.0000  0.0000  1.0
  Tb  Tb2  2  0.0000  0.5000  0.5000  1.0
  Tm  Tm3  4  0.2500  0.2500  0.0000  1.0
  Tm  Tm4  2  0.0000  0.0000  0.5000  1.0
  Se  Se5  4  0.0000  0.2477  0.5000  1.0
  Se  Se6  4  0.0000  0.2552  0.0000  1.0
  Se  Se7  4  0.2470  0.5000  0.0047  1.0
  Se  Se8  4  0.2473  0.5000  0.4899  1.0
]