data_[Y8Ho4Cu4S20]
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
  Cu  1.9000  1.3500  0.8200
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.8158]
_cell_length_b [16.6609]
_cell_length_c [11.3942]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Y2HoCuS5]
_chemical_formula_sum '[Y8 Ho4 Cu4 S20]'
_cell_volume [724.3829]
_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  0.0000  0.1063  0.6842  1.0
  Y  Y1  4  0.0000  0.1204  0.3073  1.0
  Ho  Ho2  4  0.0000  0.1948  0.0099  1.0
  Cu  Cu3  4  0.0000  0.4418  0.4561  1.0
  S  S4  4  0.0000  0.0424  0.0645  1.0
  S  S5  4  0.0000  0.2890  0.6774  1.0
  S  S6  4  0.0000  0.3174  0.3441  1.0
  S  S7  4  0.0000  0.3580  0.0013  1.0
  S  S8  4  0.0000  0.4975  0.7792  1.0
]