data_[Ho2Tm8Sc6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Tm  1.2500  1.7500  1.0950
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [10.8120]
_cell_length_b [6.9926]
_cell_length_c [6.0466]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [HoTm4Sc3]
_chemical_formula_sum '[Ho2 Tm8 Sc6]'
_cell_volume [457.1449]
_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
[
  Ho  Ho0  2  0.0000  0.3782  0.8503  1.0
  Tm  Tm1  4  0.2499  0.8741  0.5250  1.0
  Tm  Tm2  2  0.0000  0.1266  0.3600  1.0
  Tm  Tm3  2  0.0000  0.6231  0.3534  1.0
  Sc  Sc4  4  0.2469  0.6249  0.0204  1.0
  Sc  Sc5  2  0.0000  0.8728  0.8607  1.0
]