data_[Ta3Te2F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Te  2.1000  1.4000  1.2933
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.2818]
_cell_length_b [5.8491]
_cell_length_c [20.1845]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Ta3Te2F2]
_chemical_formula_sum '[Ta3 Te2 F2]'
_cell_volume [387.4538]
_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
[
  Ta  Ta0  2  0.0000  0.2521  0.4741  1
  Ta  Ta1  1  0.5000  0.0000  0.5660  1
  Te  Te2  1  0.5000  0.5000  0.3801  1
  Te  Te3  1  0.5000  0.5000  0.5701  1
  F  F4  1  0.0000  0.0000  0.3987  1
  F  F5  1  0.0000  0.0000  0.6370  1
]