data_[Y4Ho4Br12N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  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 [C2/m]
_cell_length_a [18.6770]
_cell_length_b [3.8618]
_cell_length_c [11.7403]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.0244]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [YHoBr3N]
_chemical_formula_sum '[Y4 Ho4 Br12 N4]'
_cell_volume [684.8598]
_cell_formula_units_Z [4]
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  4  0.1356  0.0000  0.2848  1
  Ho  Ho1  4  0.0725  0.5000  0.9616  1
  Br  Br2  4  0.0354  0.0000  0.7510  1
  Br  Br3  4  0.1702  0.5000  0.5103  1
  Br  Br4  4  0.2118  0.0000  0.1185  1
  N  N5  4  0.0740  0.5000  0.1523  1
]