data_[Ho6S2O2F10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [9.3611]
_cell_length_b [3.6586]
_cell_length_c [9.4205]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.4837]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Ho3SOF5]
_chemical_formula_sum '[Ho6 S2 O2 F10]'
_cell_volume [280.8554]
_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
[
  Ho  Ho0  1  0.1227  0.5000  0.7145  1.0
  Ho  Ho1  1  0.2967  0.5000  0.4032  1.0
  Ho  Ho2  1  0.4176  0.0000  0.1341  1.0
  Ho  Ho3  1  0.5955  0.5000  0.8973  1.0
  Ho  Ho4  1  0.7003  0.0000  0.5846  1.0
  Ho  Ho5  1  0.8678  0.0000  0.2710  1.0
  S  S6  1  0.3290  0.0000  0.6675  1.0
  S  S7  1  0.6730  0.5000  0.3380  1.0
  O  O8  1  0.4364  0.0000  0.3872  1.0
  O  O9  1  0.6169  0.0000  0.0524  1.0
  F  F10  1  0.0440  0.5000  0.4323  1.0
  F  F11  1  0.1125  0.0000  0.2740  1.0
  F  F12  1  0.1576  0.0000  0.8800  1.0
  F  F13  1  0.2719  0.5000  0.1499  1.0
  F  F14  1  0.3775  0.5000  0.9526  1.0
  F  F15  1  0.5689  0.5000  0.6252  1.0
  F  F16  1  0.7251  0.0000  0.8372  1.0
  F  F17  1  0.8550  0.5000  0.1176  1.0
  F  F18  1  0.8788  0.5000  0.7152  1.0
  F  F19  1  0.9528  0.0000  0.5663  1.0
]