data_[Sr8Y4In4Te20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Y  1.2200  1.8000  1.0400
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.4767]
_cell_length_b [20.0640]
_cell_length_c [14.0127]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Sr2YInTe5]
_chemical_formula_sum '[Sr8 Y4 In4 Te20]'
_cell_volume [1258.6346]
_cell_formula_units_Z [4]
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  0.1184  0.6797  1.0
  Sr  Sr1  4  0.0000  0.1299  0.3188  1.0
  Y  Y2  4  0.0000  0.2093  0.0214  1.0
  In  In3  4  0.0000  0.4436  0.4402  1.0
  Te  Te4  4  0.0000  0.0496  0.0635  1.0
  Te  Te5  4  0.0000  0.2891  0.6713  1.0
  Te  Te6  4  0.0000  0.3092  0.3630  1.0
  Te  Te7  4  0.0000  0.3594  0.0023  1.0
  Te  Te8  4  0.0000  0.4956  0.7639  1.0
]