data_[La4Tm4Cu4Te12]
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 [Cmcm]
_cell_length_a [4.2453]
_cell_length_b [14.3156]
_cell_length_c [11.1081]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [LaTmCuTe3]
_chemical_formula_sum '[La4 Tm4 Cu4 Te12]'
_cell_volume [675.0803]
_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  0.2348  0.2500  1
  Tm  Tm1  4  0.0000  0.0000  0.0000  1
  Cu  Cu2  4  0.0000  0.4700  0.7500  1
  Te  Te3  8  0.0000  0.3553  0.5627  1
  Te  Te4  4  0.0000  0.0851  0.7500  1
]