data_[Ce1Dy2Tm1Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Dy  1.2200  1.7500  1.1310
  Tm  1.2500  1.7500  1.0950
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [5.8947]
_cell_length_b [3.4001]
_cell_length_c [11.0939]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.3369]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [CeDy2TmSc4]
_chemical_formula_sum '[Ce1 Dy2 Tm1 Sc4]'
_cell_volume [218.7457]
_cell_formula_units_Z [1]
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
[
  Ce  Ce0  1  0.0000  0.0000  0.0000  1.0
  Dy  Dy1  1  0.5000  0.0000  0.5000  1.0
  Dy  Dy2  1  0.5000  0.5000  0.0000  1.0
  Tm  Tm3  1  0.0000  0.5000  0.5000  1.0
  Sc  Sc4  2  0.2436  0.5000  0.2477  1.0
  Sc  Sc5  2  0.2460  0.0000  0.7502  1.0
]