data_[Sr1Li2Tm1F8]
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
  Tm  1.2500  1.7500  1.0950
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.8421]
_cell_length_b [5.8421]
_cell_length_c [6.9045]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [SrLi2TmF8]
_chemical_formula_sum '[Sr1 Li2 Tm1 F8]'
_cell_volume [204.0790]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.5000  1
  Li  Li1  2  0.3333  0.6667  0.7266  1
  Tm  Tm2  1  0.0000  0.0000  0.0000  1
  F  F3  6  0.1558  0.3116  0.7888  1
  F  F4  2  0.3333  0.6667  0.4521  1
]