data_[Tm8In4Te20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [6.1214]
_cell_length_b [14.7843]
_cell_length_c [13.5000]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Tm2InTe5]
_chemical_formula_sum '[Tm8 In4 Te20]'
_cell_volume [1221.7489]
_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
[
  Tm  Tm0  8  0.0000  0.1673  0.5645  1
  In  In1  4  0.0000  0.1981  0.2500  1
  Te  Te2  8  0.0000  0.0339  0.1067  1
  Te  Te3  8  0.0000  0.3245  0.0788  1
  Te  Te4  4  0.0000  0.2809  0.7500  1
]