data_[Ho8Sc4C8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Sc  1.3600  1.6000  0.8850
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.2670]
_cell_length_b [5.0498]
_cell_length_c [7.0608]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.1406]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho2ScC2]
_chemical_formula_sum '[Ho8 Sc4 C8]'
_cell_volume [372.1105]
_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  0.0123  0.0000  0.7388  1
  Ho  Ho1  4  0.1664  0.5000  0.5774  1
  Sc  Sc2  4  0.1480  0.5000  0.1015  1
  C  C3  4  0.0051  0.5000  0.7697  1
  C  C4  4  0.1736  0.0000  0.6002  1
]