data_[Y4Tm6Sc2Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Tm  1.2500  1.7500  1.0950
  Sc  1.3600  1.6000  0.8850
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.7673]
_cell_length_b [4.2845]
_cell_length_c [8.6396]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.2388]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Y2Tm3ScTe6]
_chemical_formula_sum '[Y4 Tm6 Sc2 Te12]'
_cell_volume [676.2414]
_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
[
  Y  Y0  4  0.1683  0.0000  0.3334  1
  Tm  Tm1  4  0.1730  0.0000  0.8366  1
  Tm  Tm2  2  0.0000  0.5000  0.5000  1
  Sc  Sc3  2  0.0000  0.5000  0.0000  1
  Te  Te4  4  0.0033  0.0000  0.7574  1
  Te  Te5  4  0.1611  0.5000  0.0761  1
  Te  Te6  4  0.1643  0.5000  0.5859  1
]