The material described by TlPF6 is Halite, Rock Salt structured and crystallizes in the trigonal R-3m space group. The structure is zero-dimensional and consists of three 7440-28-0 atoms and three PF6 clusters. In each PF6 cluster, P(1) is bonded in an octahedral geometry to six equivalent F(1) atoms. F(1) is bonded in a single-bond geometry to one P(1) atom. is represented by the CIF file [CIF]
data_TlPF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.312
_cell_length_b   5.661
_cell_length_c   5.312
_cell_angle_alpha   62.019
_cell_angle_beta   60.000
_cell_angle_gamma   62.019
_symmetry_Int_Tables_number   1
_cell_volume   116.272
_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
  Tl  Tl0  1  0.500  0.500  0.500  1.0
  P  P1  1  0.000  0.000  0.000  1.0
  F  F2  1  0.078  0.196  0.078  1.0
  F  F3  1  0.078  0.196  0.647  1.0
  F  F4  1  0.647  0.196  0.078  1.0
  F  F5  1  0.353  0.804  0.922  1.0
  F  F6  1  0.922  0.804  0.353  1.0
  F  F7  1  0.922  0.804  0.922  1.0
[/CIF]
.
The material described by TlPF6 is Halite, Rock Salt structured and crystallizes in the trigonal R-3m space group. The structure is zero-dimensional and consists of three 7440-28-0 atoms and three PF6 clusters. In each PF6 cluster, P(1) is bonded in an octahedral geometry to six equivalent F(1) atoms. F(1) is bonded in a single-bond geometry to one P(1) atom. is represented by the CIF file [CIF]
data_TlPF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.312
_cell_length_b   5.661
_cell_length_c   5.312
_cell_angle_alpha   62.019
_cell_angle_beta   60.000
_cell_angle_gamma   62.019
_symmetry_Int_Tables_number   1
_cell_volume   116.272
_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
  Tl  Tl0  1  0.500  0.500  0.500  1.0
  P  P1  1  0.000  0.000  0.000  1.0
  F  F2  1  0.078  0.196  0.078  1.0
  F  F3  1  0.078  0.196  0.647  1.0
  F  F4  1  0.647  0.196  0.078  1.0
  F  F5  1  0.353  0.804  0.922  1.0
  F  F6  1  0.922  0.804  0.353  1.0
  F  F7  1  0.922  0.804  0.922  1.0
[/CIF]
.