data_[Sm2Lu2Sc4Sb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Lu  1.2700  1.7500  1.0010
  Sc  1.3600  1.6000  0.8850
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [4.3552]
_cell_length_b [4.3552]
_cell_length_c [16.2697]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [SmLu(ScSb)2]
_chemical_formula_sum '[Sm2 Lu2 Sc4 Sb4]'
_cell_volume [308.5955]
_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
[
  Sm  Sm0  2  0.0000  0.0000  0.3231  1
  Lu  Lu1  2  0.0000  0.0000  0.6748  1
  Sc  Sc2  4  0.0000  0.5000  0.0011  1
  Sb  Sb3  2  0.0000  0.0000  0.1307  1
  Sb  Sb4  2  0.0000  0.0000  0.8692  1
]