data_[Ta2F10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.6238]
_cell_length_b [7.3666]
_cell_length_c [19.2657]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [97.9883]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [TaF5]
_chemical_formula_sum '[Ta2 F10]'
_cell_volume [790.3968]
_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
[
  Ta  Ta0  1  0.1781  0.8886  0.4714  1
  Ta  Ta1  1  0.7457  0.2778  0.5284  1
  F  F2  1  0.0065  0.1127  0.5025  1
  F  F3  1  0.1807  0.0076  0.3849  1
  F  F4  1  0.2096  0.8633  0.5679  1
  F  F5  1  0.3437  0.6995  0.4443  1
  F  F6  1  0.4869  0.4024  0.5466  1
  F  F7  1  0.4968  0.0678  0.4848  1
  F  F8  1  0.7122  0.1232  0.6063  1
  F  F9  1  0.7894  0.3450  0.4344  1
  F  F10  1  0.8718  0.7567  0.4638  1
  F  F11  1  0.9788  0.4555  0.5648  1
]