data_[La8Tm4Cu4Te20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tm  1.2500  1.7500  1.0950
  Cu  1.9000  1.3500  0.8200
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.3646]
_cell_length_b [19.1139]
_cell_length_c [13.0546]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [La2TmCuTe5]
_chemical_formula_sum '[La8 Tm4 Cu4 Te20]'
_cell_volume [1089.0759]
_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
[
  La  La0  4  0.0000  0.1103  0.6874  1.0
  La  La1  4  0.0000  0.1234  0.3089  1.0
  Tm  Tm2  4  0.0000  0.1908  0.0105  1.0
  Cu  Cu3  4  0.0000  0.4280  0.4559  1.0
  Te  Te4  4  0.0000  0.0418  0.0594  1.0
  Te  Te5  4  0.0000  0.2878  0.6700  1.0
  Te  Te6  4  0.0000  0.3091  0.3472  1.0
  Te  Te7  4  0.0000  0.3531  0.0009  1.0
  Te  Te8  4  0.0000  0.4995  0.2837  1.0
]