data_[Li1Sm1Tm2Te4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sm  1.1700  1.8500  1.2290
  Tm  1.2500  1.7500  1.0950
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.5079]
_cell_length_b [4.3140]
_cell_length_c [7.5420]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0572]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [LiSm(TmTe2)2]
_chemical_formula_sum '[Li1 Sm1 Tm2 Te4]'
_cell_volume [230.8945]
_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
[
  Li  Li0  1  0.0000  0.5000  0.5000  1.0
  Sm  Sm1  1  0.0000  0.0000  0.0000  1.0
  Tm  Tm2  1  0.5000  0.0000  0.5000  1.0
  Tm  Tm3  1  0.5000  0.5000  0.0000  1.0
  Te  Te4  2  0.2503  0.0000  0.7428  1.0
  Te  Te5  2  0.2538  0.5000  0.2609  1.0
]