data_[Sr2Tl1In1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.4673]
_cell_length_b [9.0332]
_cell_length_c [6.6890]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.2610]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Sr2TlInCl8]
_chemical_formula_sum '[Sr2 Tl1 In1 Cl8]'
_cell_volume [390.7685]
_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  2  0.5000  0.2460  0.5000  1.0
  Tl  Tl1  1  0.0000  0.5000  0.0000  1.0
  In  In2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  4  0.2223  0.2013  0.1535  1.0
  Cl  Cl4  2  0.2486  0.0000  0.6831  1.0
  Cl  Cl5  2  0.2723  0.5000  0.6289  1.0
]