The crystal structure described by Co4OF11 crystallizes in the triclinic P1 space group. There are four inequivalent Co sites. In the first Co site, Co(1) is bonded to one O(1), one F(10), one F(2), one F(3), one F(4), and one F(9) atom to form CoOF5 octahedra that share corners with two equivalent Co(3)OF5 octahedra and corners with four equivalent Co(2)F6 octahedra. The corner-sharing octahedral tilt angles range from 28-36°. In the second Co site, Co(2) is bonded to one F(1), one F(10), one F(11), one F(2), one F(4), and one F(9) atom to form CoF6 octahedra that share corners with two equivalent Co(4)F6 octahedra and corners with four equivalent Co(1)OF5 octahedra. The corner-sharing octahedral tilt angles range from 35-38°. In the third Co site, Co(3) is bonded to one O(1), one F(3), one F(5), one F(6), one F(7), and one F(8) atom to form CoOF5 octahedra that share corners with two equivalent Co(1)OF5 octahedra and corners with four equivalent Co(4)F6 octahedra. The corner-sharing octahedral tilt angles range from 28-39°. In the fourth Co site, Co(4) is bonded to one F(1), one F(11), one F(5), one F(6), one F(7), and one F(8) atom to form CoF6 octahedra that share corners with two equivalent Co(2)F6 octahedra and corners with four equivalent Co(3)OF5 octahedra. The corner-sharing octahedral tilt angles range from 35-39°. O(1) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(3) atom. There are eleven inequivalent F sites. In the first F site, F(1) is bonded in a bent 150 degrees geometry to one Co(2) and one Co(4) atom. In the second F site, F(2) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(2) atom. In the third F site, F(3) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(3) atom. In the fourth F site, F(4) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(2) atom. In the fifth F site, F(5) is bonded in a bent 150 degrees geometry to one Co(3) and one Co(4) atom. In the sixth F site, F(6) is bonded in a bent 150 degrees geometry to one Co(3) and one Co(4) atom. In the seventh F site, F(7) is bonded in a bent 150 degrees geometry to one Co(3) and one Co(4) atom. In the eighth F site, F(8) is bonded in a bent 150 degrees geometry to one Co(3) and one Co(4) atom. In the ninth F site, F(9) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(2) atom. In the tenth F site, F(10) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(2) atom. In the eleventh F site, F(11) is bonded in a bent 150 degrees geometry to one Co(2) and one Co(4) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Co4OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.067
_cell_length_b   5.350
_cell_length_c   7.264
_cell_angle_alpha   93.761
_cell_angle_beta   90.882
_cell_angle_gamma   90.067
_symmetry_Int_Tables_number   1
_cell_volume   196.487
_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
  Co  Co0  1  0.496  0.500  0.994  1.0
  Co  Co1  1  0.999  1.000  1.000  1.0
  Co  Co2  1  0.491  0.499  0.513  1.0
  Co  Co3  1  0.997  0.999  0.500  1.0
  O  O4  1  0.407  0.503  0.759  1.0
  F  F5  1  0.882  0.001  0.253  1.0
  F  F6  1  0.197  0.312  0.057  1.0
  F  F7  1  0.606  0.500  0.241  1.0
  F  F8  1  0.299  0.816  0.058  1.0
  F  F9  1  0.809  0.316  0.556  1.0
  F  F10  1  0.309  0.188  0.441  1.0
  F  F11  1  0.690  0.812  0.562  1.0
  F  F12  1  0.193  0.684  0.440  1.0
  F  F13  1  0.701  0.183  0.938  1.0
  F  F14  1  0.803  0.689  0.942  1.0
  F  F15  1  0.122  0.999  0.746  1.0
[/CIF]
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The crystal structure described by Co4OF11 crystallizes in the triclinic P1 space group. There are four inequivalent Co sites. In the first Co site, Co(1) is bonded to one O(1), one F(10), one F(2), one F(3), one F(4), and one F(9) atom to form CoOF5 octahedra that share corners with two equivalent Co(3)OF5 octahedra and corners with four equivalent Co(2)F6 octahedra. The corner-sharing octahedral tilt angles range from 28-36°. In the second Co site, Co(2) is bonded to one F(1), one F(10), one F(11), one F(2), one F(4), and one F(9) atom to form CoF6 octahedra that share corners with two equivalent Co(4)F6 octahedra and corners with four equivalent Co(1)OF5 octahedra. The corner-sharing octahedral tilt angles range from 35-38°. In the third Co site, Co(3) is bonded to one O(1), one F(3), one F(5), one F(6), one F(7), and one F(8) atom to form CoOF5 octahedra that share corners with two equivalent Co(1)OF5 octahedra and corners with four equivalent Co(4)F6 octahedra. The corner-sharing octahedral tilt angles range from 28-39°. In the fourth Co site, Co(4) is bonded to one F(1), one F(11), one F(5), one F(6), one F(7), and one F(8) atom to form CoF6 octahedra that share corners with two equivalent Co(2)F6 octahedra and corners with four equivalent Co(3)OF5 octahedra. The corner-sharing octahedral tilt angles range from 35-39°. O(1) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(3) atom. There are eleven inequivalent F sites. In the first F site, F(1) is bonded in a bent 150 degrees geometry to one Co(2) and one Co(4) atom. In the second F site, F(2) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(2) atom. In the third F site, F(3) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(3) atom. In the fourth F site, F(4) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(2) atom. In the fifth F site, F(5) is bonded in a bent 150 degrees geometry to one Co(3) and one Co(4) atom. In the sixth F site, F(6) is bonded in a bent 150 degrees geometry to one Co(3) and one Co(4) atom. In the seventh F site, F(7) is bonded in a bent 150 degrees geometry to one Co(3) and one Co(4) atom. In the eighth F site, F(8) is bonded in a bent 150 degrees geometry to one Co(3) and one Co(4) atom. In the ninth F site, F(9) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(2) atom. In the tenth F site, F(10) is bonded in a bent 150 degrees geometry to one Co(1) and one Co(2) atom. In the eleventh F site, F(11) is bonded in a bent 150 degrees geometry to one Co(2) and one Co(4) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Co4OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.067
_cell_length_b   5.350
_cell_length_c   7.264
_cell_angle_alpha   93.761
_cell_angle_beta   90.882
_cell_angle_gamma   90.067
_symmetry_Int_Tables_number   1
_cell_volume   196.487
_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
  Co  Co0  1  0.496  0.500  0.994  1.0
  Co  Co1  1  0.999  1.000  1.000  1.0
  Co  Co2  1  0.491  0.499  0.513  1.0
  Co  Co3  1  0.997  0.999  0.500  1.0
  O  O4  1  0.407  0.503  0.759  1.0
  F  F5  1  0.882  0.001  0.253  1.0
  F  F6  1  0.197  0.312  0.057  1.0
  F  F7  1  0.606  0.500  0.241  1.0
  F  F8  1  0.299  0.816  0.058  1.0
  F  F9  1  0.809  0.316  0.556  1.0
  F  F10  1  0.309  0.188  0.441  1.0
  F  F11  1  0.690  0.812  0.562  1.0
  F  F12  1  0.193  0.684  0.440  1.0
  F  F13  1  0.701  0.183  0.938  1.0
  F  F14  1  0.803  0.689  0.942  1.0
  F  F15  1  0.122  0.999  0.746  1.0
[/CIF]
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