data_[Y8Tm12Sc4]
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
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [17.0435]
_cell_length_b [6.3705]
_cell_length_c [6.7314]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.4778]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Y2Tm3Sc]
_chemical_formula_sum '[Y8 Tm12 Sc4]'
_cell_volume [729.5085]
_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
[
  Y  Y0  8  0.1837  0.4393  0.6921  1
  Tm  Tm1  8  0.1422  0.0350  0.0163  1
  Tm  Tm2  4  0.0000  0.3160  0.2500  1
  Sc  Sc3  4  0.0000  0.1892  0.7500  1
]