data_[K1Tc1H2F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Tc  1.9000  1.3500  0.7417
  H  2.2000  0.2500  0.0000
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.9257]
_cell_length_b [4.9818]
_cell_length_c [7.7378]
_cell_angle_alpha [93.4479]
_cell_angle_beta [97.4645]
_cell_angle_gamma [109.6670]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KTcH2F8]
_chemical_formula_sum '[K1 Tc1 H2 F8]'
_cell_volume [176.1855]
_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
[
  K  K0  1  0.0000  0.0000  0.5000  1
  Tc  Tc1  1  0.0000  0.0000  0.0000  1
  H  H2  2  0.3144  0.5379  0.3130  1
  F  F3  2  0.2118  0.2237  0.8406  1
  F  F4  2  0.2360  0.7751  0.0038  1
  F  F5  2  0.2534  0.2491  0.2076  1
  F  F6  2  0.3429  0.6892  0.4069  1
]