data_[Ho2Ti2Cl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Ti  1.5400  1.4000  0.8517
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pmma]
_cell_length_a [15.1191]
_cell_length_b [3.7023]
_cell_length_c [19.0980]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [51]
_chemical_formula_structural [HoTiCl5]
_chemical_formula_sum '[Ho2 Ti2 Cl10]'
_cell_volume [1069.0271]
_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  2  0.2500  0.0000  0.5110  1
  Ti  Ti1  2  0.0000  0.5000  0.5000  1
  Cl  Cl2  4  0.0692  0.0000  0.5714  1
  Cl  Cl3  4  0.1479  0.5000  0.4366  1
  Cl  Cl4  2  0.2500  0.5000  0.6073  1
]