data_[Sr6Li2Ho4Se12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Li  0.9800  1.4500  0.9000
  Ho  1.2300  1.7500  1.0410
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.3208]
_cell_length_b [12.6755]
_cell_length_c [7.3791]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.2844]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr3Li(HoSe3)2]
_chemical_formula_sum '[Sr6 Li2 Ho4 Se12]'
_cell_volume [646.3245]
_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
[
  Sr  Sr0  4  0.0000  0.1650  0.5000  1.0
  Sr  Sr1  2  0.0000  0.5000  0.5000  1.0
  Li  Li2  2  0.0000  0.0000  0.0000  1.0
  Ho  Ho3  4  0.0000  0.3330  0.0000  1.0
  Se  Se4  8  0.2435  0.1679  0.2266  1.0
  Se  Se5  4  0.2396  0.5000  0.2249  1.0
]