data_[Ho16Bi4C4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Bi  2.0200  1.6000  1.0350
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.9114]
_cell_length_b [18.7081]
_cell_length_c [6.7389]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ho4BiC]
_chemical_formula_sum '[Ho16 Bi4 C4]'
_cell_volume [619.1869]
_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
[
  Ho  Ho0  4  0.0000  0.0988  0.2207  1
  Ho  Ho1  4  0.0000  0.3130  0.9651  1
  Ho  Ho2  4  0.0000  0.3174  0.4625  1
  Ho  Ho3  4  0.0000  0.4978  0.9765  1
  Bi  Bi4  4  0.0000  0.0889  0.7221  1
  C  C5  4  0.0000  0.4036  0.7197  1
]