data_[Y2Er6Tm12Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Er  1.2400  1.7500  1.0300
  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 [6.0020]
_cell_length_b [10.3843]
_cell_length_c [11.4760]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0233]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [YEr3(Tm3Sc)2]
_chemical_formula_sum '[Y2 Er6 Tm12 Sc4]'
_cell_volume [704.3455]
_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  2  0.0000  0.0000  0.0000  1.0
  Er  Er1  4  0.0000  0.1669  0.5000  1.0
  Er  Er2  2  0.0000  0.5000  0.5000  1.0
  Tm  Tm3  8  0.2497  0.3320  0.7540  1.0
  Tm  Tm4  4  0.2460  0.5000  0.2459  1.0
  Sc  Sc5  4  0.0000  0.3332  0.0000  1.0
]