data_[Y10Tm10Sc4]
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/m]
_cell_length_a [16.7797]
_cell_length_b [5.5062]
_cell_length_c [9.4825]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.4012]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Y5Tm5Sc2]
_chemical_formula_sum '[Y10 Tm10 Sc4]'
_cell_volume [722.8777]
_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  0.1213  0.0000  0.7792  1.0
  Y  Y1  4  0.2498  0.0000  0.2511  1.0
  Y  Y2  2  0.0000  0.0000  0.0000  1.0
  Tm  Tm3  4  0.1234  0.5000  0.9607  1.0
  Tm  Tm4  4  0.1274  0.5000  0.3024  1.0
  Tm  Tm5  2  0.0000  0.5000  0.5000  1.0
  Sc  Sc6  4  0.1260  0.0000  0.4558  1.0
]