The compound described by Cs2TaF6Cu crystallizes in the cubic Fm-3m space group. The structure consists of four 7440-50-8 atoms inside a Cs2TaF6 framework. In the Cs2TaF6 framework, Cs(1) is bonded in a 12-coordinate geometry to twelve equivalent F(1) atoms. Ta(1) is bonded in an octahedral geometry to six equivalent F(1) atoms. F(1) is bonded in a single-bond geometry to four equivalent Cs(1) and one Ta(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cs2TaCuF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.307
_cell_length_b   7.307
_cell_length_c   7.307
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   275.925
_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
  Cs  Cs0  1  0.250  0.250  0.250  1.0
  Cs  Cs1  1  0.750  0.750  0.750  1.0
  Ta  Ta2  1  0.500  0.500  0.500  1.0
  Cu  Cu3  1  0.000  0.000  0.000  1.0
  F  F4  1  0.313  0.687  0.313  1.0
  F  F5  1  0.687  0.687  0.313  1.0
  F  F6  1  0.687  0.313  0.687  1.0
  F  F7  1  0.687  0.313  0.313  1.0
  F  F8  1  0.313  0.687  0.687  1.0
  F  F9  1  0.313  0.313  0.687  1.0
[/CIF]
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The compound described by Cs2TaF6Cu crystallizes in the cubic Fm-3m space group. The structure consists of four 7440-50-8 atoms inside a Cs2TaF6 framework. In the Cs2TaF6 framework, Cs(1) is bonded in a 12-coordinate geometry to twelve equivalent F(1) atoms. Ta(1) is bonded in an octahedral geometry to six equivalent F(1) atoms. F(1) is bonded in a single-bond geometry to four equivalent Cs(1) and one Ta(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cs2TaCuF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.307
_cell_length_b   7.307
_cell_length_c   7.307
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   275.925
_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
  Cs  Cs0  1  0.250  0.250  0.250  1.0
  Cs  Cs1  1  0.750  0.750  0.750  1.0
  Ta  Ta2  1  0.500  0.500  0.500  1.0
  Cu  Cu3  1  0.000  0.000  0.000  1.0
  F  F4  1  0.313  0.687  0.313  1.0
  F  F5  1  0.687  0.687  0.313  1.0
  F  F6  1  0.687  0.313  0.687  1.0
  F  F7  1  0.687  0.313  0.313  1.0
  F  F8  1  0.313  0.687  0.687  1.0
  F  F9  1  0.313  0.313  0.687  1.0
[/CIF]
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