data_[Nd8Ho4Zn4S20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ho  1.2300  1.7500  1.0410
  Zn  1.6500  1.3500  0.8800
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.8754]
_cell_length_b [16.9763]
_cell_length_c [11.9864]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Nd2HoZnS5]
_chemical_formula_sum '[Nd8 Ho4 Zn4 S20]'
_cell_volume [788.5901]
_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
[
  Nd  Nd0  4  0.0000  0.1147  0.6840  1.0
  Nd  Nd1  4  0.0000  0.1319  0.3190  1.0
  Ho  Ho2  4  0.0000  0.1978  0.0160  1.0
  Zn  Zn3  4  0.0000  0.4541  0.4463  1.0
  S  S4  4  0.0000  0.0400  0.0518  1.0
  S  S5  4  0.0000  0.2907  0.6745  1.0
  S  S6  4  0.0000  0.3162  0.3560  1.0
  S  S7  4  0.0000  0.3559  0.0044  1.0
  S  S8  4  0.0000  0.4933  0.7719  1.0
]