data_[Ce6Ho2Sc4As12]
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
  Sc  1.3600  1.6000  0.8850
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1082]
_cell_length_b [12.3096]
_cell_length_c [7.0557]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6771]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce3Ho(ScAs3)2]
_chemical_formula_sum '[Ce6 Ho2 Sc4 As12]'
_cell_volume [581.3156]
_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  4  0.0000  0.1648  0.5000  1.0
  Ce  Ce1  2  0.0000  0.5000  0.5000  1.0
  Ho  Ho2  2  0.0000  0.0000  0.0000  1.0
  Sc  Sc3  4  0.0000  0.3327  0.0000  1.0
  As  As4  8  0.2489  0.1702  0.2357  1.0
  As  As5  4  0.2369  0.5000  0.2333  1.0
]