data_[Y2Tm4Sc10]
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 [Cm]
_cell_length_a [10.6290]
_cell_length_b [6.8390]
_cell_length_c [7.9548]
_cell_angle_alpha [90.0000]
_cell_angle_beta [131.8883]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [YTm2Sc5]
_chemical_formula_sum '[Y2 Tm4 Sc10]'
_cell_volume [430.4707]
_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  0.4639  0.5000  0.1409  1
  Tm  Tm1  2  0.0379  0.5000  0.8015  1
  Tm  Tm2  2  0.4560  0.0000  0.1428  1
  Sc  Sc3  4  0.2067  0.7495  0.6359  1
  Sc  Sc4  4  0.2943  0.2521  0.3105  1
  Sc  Sc5  2  0.0402  0.0000  0.7990  1
]