data_[Sr2Y2Tl2]
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
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [5.8026]
_cell_length_b [3.8794]
_cell_length_c [9.1605]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.3139]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [SrYTl]
_chemical_formula_sum '[Sr2 Y2 Tl2]'
_cell_volume [201.4664]
_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  2  0.2069  0.5000  0.8645  1.0
  Y  Y1  1  0.0000  0.0000  0.5000  1.0
  Y  Y2  1  0.5000  0.5000  0.5000  1.0
  Tl  Tl3  2  0.3178  0.0000  0.2184  1.0
]