data_[Ce4Tm2Sb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Tm  1.2500  1.7500  1.0950
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.3514]
_cell_length_b [4.3085]
_cell_length_c [11.5101]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.7032]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ce2TmSb]
_chemical_formula_sum '[Ce4 Tm2 Sb2]'
_cell_volume [212.0335]
_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
[
  Ce  Ce0  2  0.0091  0.2500  0.1225  1.0
  Ce  Ce1  2  0.4069  0.2500  0.8860  1.0
  Tm  Tm2  2  0.3042  0.7500  0.6107  1.0
  Sb  Sb3  2  0.1759  0.7500  0.3408  1.0
]