data_[Ce2Ho2Br2N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ho  1.2300  1.7500  1.0410
  Br  2.9600  1.1500  0.8825
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.1315]
_cell_length_b [4.1759]
_cell_length_c [7.9271]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.4832]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CeHoBrN2]
_chemical_formula_sum '[Ce2 Ho2 Br2 N4]'
_cell_volume [221.1444]
_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  0.3522  0.7500  0.0836  1.0
  Ho  Ho1  2  0.3567  0.7500  0.5754  1.0
  Br  Br2  2  0.0211  0.2500  0.7478  1.0
  N  N3  2  0.4826  0.2500  0.1145  1.0
  N  N4  2  0.4908  0.2500  0.6278  1.0
]