data_[Sr2Tl1V1F8]
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
  V  1.6300  1.3500  0.7775
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.8655]
_cell_length_b [5.4357]
_cell_length_c [7.9397]
_cell_angle_alpha [93.3160]
_cell_angle_beta [92.3027]
_cell_angle_gamma [92.7782]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Sr2TlVF8]
_chemical_formula_sum '[Sr2 Tl1 V1 F8]'
_cell_volume [209.1933]
_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  0.4671  0.4772  0.2433  1.0
  Tl  Tl1  1  0.0000  0.0000  0.5000  1.0
  V  V2  1  0.0000  0.0000  0.0000  1.0
  F  F3  2  0.0916  0.7382  0.8143  1.0
  F  F4  2  0.1772  0.8256  0.1788  1.0
  F  F5  2  0.3231  0.2300  0.9740  1.0
  F  F6  2  0.4709  0.2611  0.4984  1.0
]