The compound described by NaH6TeO6F crystallizes in the trigonal R3 space group. Na(1) is bonded in a 7-coordinate geometry to three equivalent O(1), three equivalent O(2), and one F(1) atom. There are two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one O(1) atom. In the second H site, H(2) is bonded in a linear geometry to one O(2) and one F(1) atom. Te(1) is bonded in an octahedral geometry to three equivalent O(1) and three equivalent O(2) atoms. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Na(1), one H(1), and one Te(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Na(1), one H(2), and one Te(1) atom. F(1) is bonded in a distorted tetrahedral geometry to one Na(1) and three equivalent H(2) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaTeH6O6F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.709
_cell_length_b   5.709
_cell_length_c   5.709
_cell_angle_alpha   64.624
_cell_angle_beta   64.624
_cell_angle_gamma   64.624
_symmetry_Int_Tables_number   1
_cell_volume   144.912
_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
  Na  Na0  1  0.624  0.624  0.624  1.0
  Te  Te1  1  0.997  0.997  0.997  1.0
  H  H2  1  0.045  0.984  0.545  1.0
  H  H3  1  0.984  0.545  0.045  1.0
  H  H4  1  0.545  0.045  0.984  1.0
  H  H5  1  0.679  0.201  0.382  1.0
  H  H6  1  0.201  0.382  0.679  1.0
  H  H7  1  0.382  0.679  0.201  1.0
  O  O8  1  0.176  0.935  0.643  1.0
  O  O9  1  0.935  0.643  0.176  1.0
  O  O10  1  0.643  0.176  0.935  1.0
  O  O11  1  0.842  0.029  0.366  1.0
  O  O12  1  0.029  0.366  0.842  1.0
  O  O13  1  0.366  0.842  0.029  1.0
  F  F14  1  0.444  0.444  0.444  1.0
[/CIF]
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The compound described by NaH6TeO6F crystallizes in the trigonal R3 space group. Na(1) is bonded in a 7-coordinate geometry to three equivalent O(1), three equivalent O(2), and one F(1) atom. There are two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one O(1) atom. In the second H site, H(2) is bonded in a linear geometry to one O(2) and one F(1) atom. Te(1) is bonded in an octahedral geometry to three equivalent O(1) and three equivalent O(2) atoms. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Na(1), one H(1), and one Te(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Na(1), one H(2), and one Te(1) atom. F(1) is bonded in a distorted tetrahedral geometry to one Na(1) and three equivalent H(2) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaTeH6O6F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.709
_cell_length_b   5.709
_cell_length_c   5.709
_cell_angle_alpha   64.624
_cell_angle_beta   64.624
_cell_angle_gamma   64.624
_symmetry_Int_Tables_number   1
_cell_volume   144.912
_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
  Na  Na0  1  0.624  0.624  0.624  1.0
  Te  Te1  1  0.997  0.997  0.997  1.0
  H  H2  1  0.045  0.984  0.545  1.0
  H  H3  1  0.984  0.545  0.045  1.0
  H  H4  1  0.545  0.045  0.984  1.0
  H  H5  1  0.679  0.201  0.382  1.0
  H  H6  1  0.201  0.382  0.679  1.0
  H  H7  1  0.382  0.679  0.201  1.0
  O  O8  1  0.176  0.935  0.643  1.0
  O  O9  1  0.935  0.643  0.176  1.0
  O  O10  1  0.643  0.176  0.935  1.0
  O  O11  1  0.842  0.029  0.366  1.0
  O  O12  1  0.029  0.366  0.842  1.0
  O  O13  1  0.366  0.842  0.029  1.0
  F  F14  1  0.444  0.444  0.444  1.0
[/CIF]
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