The material described by NaCSbO2F3 crystallizes in the monoclinic Cc space group. There are two inequivalent Na sites. In the first Na site, Na(1) is bonded to one O(4), one F(1), one F(2), one F(3), one F(4), and one F(5) atom to form a mixture of distorted corner and edge-sharing NaOF5 octahedra. The corner-sharing octahedral tilt angles range from 68-70°. In the second Na site, Na(2) is bonded to one O(2), one F(1), one F(3), one F(4), one F(5), and one F(6) atom to form a mixture of distorted corner and edge-sharing NaOF5 octahedra. The corner-sharing octahedral tilt angles range from 68-70°. There are two inequivalent C sites. In the first C site, C(1) is bonded in a distorted bent 120 degrees geometry to one O(1) and one O(4) atom. In the second C site, C(2) is bonded in a distorted bent 120 degrees geometry to one O(2) and one O(3) atom. There are two inequivalent Sb sites. In the first Sb site, Sb(1) is bonded in a 3-coordinate geometry to one O(4), one F(2), one F(3), and one F(5) atom. In the second Sb site, Sb(2) is bonded in a 5-coordinate geometry to one O(1), one O(2), one F(1), one F(4), and one F(6) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one C(1) and one Sb(2) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Na(2), one C(2), and one Sb(2) atom. In the third O site, O(3) is bonded in a single-bond geometry to one C(2) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one Na(1), one C(1), and one Sb(1) atom. There are six inequivalent F sites. In the first F site, F(1) is bonded in a trigonal planar geometry to one Na(1), one Na(2), and one Sb(2) atom. In the second F site, F(2) is bonded in a bent 150 degrees geometry to one Na(1) and one Sb(1) atom. In the third F site, F(3) is bonded in a trigonal planar geometry to one Na(1), one Na(2), and one Sb(1) atom. In the fourth F site, F(4) is bonded in a trigonal planar geometry to one Na(1), one Na(2), and one Sb(2) atom. In the fifth F site, F(5) is bonded in a trigonal planar geometry to one Na(1), one Na(2), and one Sb(1) atom. In the sixth F site, F(6) is bonded in a bent 150 degrees geometry to one Na(2) and one Sb(2) atom. is represented by the CIF card [CIF]
data_NaSbCO2F3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.336
_cell_length_b   9.336
_cell_length_c   8.522
_cell_angle_alpha   83.667
_cell_angle_beta   83.667
_cell_angle_gamma   40.279
_symmetry_Int_Tables_number   1
_cell_volume   476.902
_cell_formula_units_Z   4
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  0.721  0.491  0.569  1.0
  Na  Na1  1  0.067  0.303  0.218  1.0
  Na  Na2  1  0.491  0.721  0.069  1.0
  Na  Na3  1  0.303  0.067  0.718  1.0
  Sb  Sb4  1  0.125  0.878  0.496  1.0
  Sb  Sb5  1  0.661  0.918  0.290  1.0
  Sb  Sb6  1  0.918  0.661  0.790  1.0
  Sb  Sb7  1  0.878  0.125  0.996  1.0
  C  C8  1  0.498  0.355  0.424  1.0
  C  C9  1  0.437  0.288  0.870  1.0
  C  C10  1  0.355  0.498  0.924  1.0
  C  C11  1  0.288  0.437  0.370  1.0
  O  O12  1  0.158  0.684  0.896  1.0
  O  O13  1  0.321  0.302  0.297  1.0
  O  O14  1  0.302  0.321  0.797  1.0
  O  O15  1  0.684  0.158  0.396  1.0
  O  O16  1  0.632  0.101  0.901  1.0
  O  O17  1  0.101  0.632  0.401  1.0
  O  O18  1  0.465  0.493  0.494  1.0
  O  O19  1  0.493  0.465  0.994  1.0
  F  F20  1  0.973  0.431  0.695  1.0
  F  F21  1  0.222  0.834  0.271  1.0
  F  F22  1  0.355  0.825  0.584  1.0
  F  F23  1  0.620  0.782  0.844  1.0
  F  F24  1  0.431  0.973  0.195  1.0
  F  F25  1  0.825  0.355  0.084  1.0
  F  F26  1  0.998  0.176  0.436  1.0
  F  F27  1  0.563  0.956  0.515  1.0
  F  F28  1  0.782  0.620  0.344  1.0
  F  F29  1  0.956  0.563  0.015  1.0
  F  F30  1  0.176  0.998  0.936  1.0
  F  F31  1  0.834  0.222  0.771  1.0
[/CIF]
.
The material described by NaCSbO2F3 crystallizes in the monoclinic Cc space group. There are two inequivalent Na sites. In the first Na site, Na(1) is bonded to one O(4), one F(1), one F(2), one F(3), one F(4), and one F(5) atom to form a mixture of distorted corner and edge-sharing NaOF5 octahedra. The corner-sharing octahedral tilt angles range from 68-70°. In the second Na site, Na(2) is bonded to one O(2), one F(1), one F(3), one F(4), one F(5), and one F(6) atom to form a mixture of distorted corner and edge-sharing NaOF5 octahedra. The corner-sharing octahedral tilt angles range from 68-70°. There are two inequivalent C sites. In the first C site, C(1) is bonded in a distorted bent 120 degrees geometry to one O(1) and one O(4) atom. In the second C site, C(2) is bonded in a distorted bent 120 degrees geometry to one O(2) and one O(3) atom. There are two inequivalent Sb sites. In the first Sb site, Sb(1) is bonded in a 3-coordinate geometry to one O(4), one F(2), one F(3), and one F(5) atom. In the second Sb site, Sb(2) is bonded in a 5-coordinate geometry to one O(1), one O(2), one F(1), one F(4), and one F(6) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one C(1) and one Sb(2) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Na(2), one C(2), and one Sb(2) atom. In the third O site, O(3) is bonded in a single-bond geometry to one C(2) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one Na(1), one C(1), and one Sb(1) atom. There are six inequivalent F sites. In the first F site, F(1) is bonded in a trigonal planar geometry to one Na(1), one Na(2), and one Sb(2) atom. In the second F site, F(2) is bonded in a bent 150 degrees geometry to one Na(1) and one Sb(1) atom. In the third F site, F(3) is bonded in a trigonal planar geometry to one Na(1), one Na(2), and one Sb(1) atom. In the fourth F site, F(4) is bonded in a trigonal planar geometry to one Na(1), one Na(2), and one Sb(2) atom. In the fifth F site, F(5) is bonded in a trigonal planar geometry to one Na(1), one Na(2), and one Sb(1) atom. In the sixth F site, F(6) is bonded in a bent 150 degrees geometry to one Na(2) and one Sb(2) atom. is represented by the CIF card [CIF]
data_NaSbCO2F3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.336
_cell_length_b   9.336
_cell_length_c   8.522
_cell_angle_alpha   83.667
_cell_angle_beta   83.667
_cell_angle_gamma   40.279
_symmetry_Int_Tables_number   1
_cell_volume   476.902
_cell_formula_units_Z   4
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  0.721  0.491  0.569  1.0
  Na  Na1  1  0.067  0.303  0.218  1.0
  Na  Na2  1  0.491  0.721  0.069  1.0
  Na  Na3  1  0.303  0.067  0.718  1.0
  Sb  Sb4  1  0.125  0.878  0.496  1.0
  Sb  Sb5  1  0.661  0.918  0.290  1.0
  Sb  Sb6  1  0.918  0.661  0.790  1.0
  Sb  Sb7  1  0.878  0.125  0.996  1.0
  C  C8  1  0.498  0.355  0.424  1.0
  C  C9  1  0.437  0.288  0.870  1.0
  C  C10  1  0.355  0.498  0.924  1.0
  C  C11  1  0.288  0.437  0.370  1.0
  O  O12  1  0.158  0.684  0.896  1.0
  O  O13  1  0.321  0.302  0.297  1.0
  O  O14  1  0.302  0.321  0.797  1.0
  O  O15  1  0.684  0.158  0.396  1.0
  O  O16  1  0.632  0.101  0.901  1.0
  O  O17  1  0.101  0.632  0.401  1.0
  O  O18  1  0.465  0.493  0.494  1.0
  O  O19  1  0.493  0.465  0.994  1.0
  F  F20  1  0.973  0.431  0.695  1.0
  F  F21  1  0.222  0.834  0.271  1.0
  F  F22  1  0.355  0.825  0.584  1.0
  F  F23  1  0.620  0.782  0.844  1.0
  F  F24  1  0.431  0.973  0.195  1.0
  F  F25  1  0.825  0.355  0.084  1.0
  F  F26  1  0.998  0.176  0.436  1.0
  F  F27  1  0.563  0.956  0.515  1.0
  F  F28  1  0.782  0.620  0.344  1.0
  F  F29  1  0.956  0.563  0.015  1.0
  F  F30  1  0.176  0.998  0.936  1.0
  F  F31  1  0.834  0.222  0.771  1.0
[/CIF]
.