data_[Sr3Pr3Ho12S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Pr  1.1300  1.8500  1.0600
  Ho  1.2300  1.7500  1.0410
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.1451]
_cell_length_b [8.1451]
_cell_length_c [20.3222]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [SrPr(HoS2)4]
_chemical_formula_sum '[Sr3 Pr3 Ho12 S24]'
_cell_volume [1167.5954]
_cell_formula_units_Z [3]
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
[
  Sr  Sr0  3  0.0000  0.0000  0.6268  1
  Pr  Pr1  3  0.0000  0.0000  0.9984  1
  Ho  Ho2  9  0.0047  0.5024  0.5007  1
  Ho  Ho3  3  0.0000  0.0000  0.3746  1
  S  S4  9  0.0123  0.5061  0.7560  1
  S  S5  9  0.1822  0.3644  0.5744  1
  S  S6  3  0.0000  0.0000  0.2423  1
  S  S7  3  0.0000  0.0000  0.7649  1
]