The compound described by Li3Co5OF11 crystallizes in the triclinic P1 space group. There are three inequivalent Li sites. In the first Li site, Li(1) is bonded in a 2-coordinate geometry to one F(10), one F(4), one F(6), and one F(8) atom. In the second Li site, Li(2) is bonded in a 2-coordinate geometry to one F(11), one F(2), one F(3), one F(7), and one F(9) atom. In the third Li site, Li(3) is bonded in a 5-coordinate geometry to one F(11), one F(2), one F(4), one F(5), and one F(8) atom. There are five inequivalent Co sites. In the first Co site, Co(1) is bonded in a distorted rectangular see-saw-like geometry to one F(1), one F(3), one F(4), and one F(5) atom. In the second Co site, Co(2) is bonded in a 4-coordinate geometry to one O(1), one F(2), one F(8), and one F(9) atom. In the third Co site, Co(3) is bonded in a 4-coordinate geometry to one F(10), one F(3), one F(4), and one F(7) atom. In the fourth Co site, Co(4) is bonded in a distorted rectangular see-saw-like geometry to one F(11), one F(6), one F(8), and one F(9) atom. In the fifth Co site, Co(5) is bonded in a 6-coordinate geometry to one O(1), one F(1), one F(10), one F(3), one F(7), and one F(9) atom. O(1) is bonded in a distorted water-like geometry to one Co(2) and one Co(5) atom. There are eleven inequivalent F sites. In the first F site, F(1) is bonded in a 2-coordinate geometry to one Co(1) and one Co(5) atom. In the second F site, F(2) is bonded in a 3-coordinate geometry to one Li(2), one Li(3), and one Co(2) atom. In the third F site, F(3) is bonded in a 4-coordinate geometry to one Li(2), one Co(1), one Co(3), and one Co(5) atom. In the fourth F site, F(4) is bonded in a 4-coordinate geometry to one Li(1), one Li(3), one Co(1), and one Co(3) atom. In the fifth F site, F(5) is bonded in a water-like geometry to one Li(3) and one Co(1) atom. In the sixth F site, F(6) is bonded in a water-like geometry to one Li(1) and one Co(4) atom. In the seventh F site, F(7) is bonded in a bent 120 degrees geometry to one Li(2), one Co(3), and one Co(5) atom. In the eighth F site, F(8) is bonded in a 4-coordinate geometry to one Li(1), one Li(3), one Co(2), and one Co(4) atom. In the ninth F site, F(9) is bonded in a 4-coordinate geometry to one Li(2), one Co(2), one Co(4), and one Co(5) atom. In the tenth F site, F(10) is bonded in a 3-coordinate geometry to one Li(1), one Co(3), and one Co(5) atom. In the eleventh F site, F(11) is bonded in a 3-coordinate geometry to one Li(2), one Li(3), and one Co(4) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li3Co5OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.234
_cell_length_b   5.578
_cell_length_c   9.072
_cell_angle_alpha   105.966
_cell_angle_beta   89.963
_cell_angle_gamma   117.426
_symmetry_Int_Tables_number   1
_cell_volume   223.558
_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
  Li  Li0  1  0.790  0.636  0.942  1.0
  Li  Li1  1  0.278  0.133  0.423  1.0
  Li  Li2  1  0.212  0.350  0.073  1.0
  Co  Co3  1  0.479  0.126  0.826  1.0
  Co  Co4  1  0.969  0.634  0.335  1.0
  Co  Co5  1  0.023  0.400  0.669  1.0
  Co  Co6  1  0.518  0.865  0.172  1.0
  Co  Co7  1  0.744  0.861  0.573  1.0
  O  O8  1  0.972  0.719  0.524  1.0
  F  F9  1  0.028  0.982  0.779  1.0
  F  F10  1  0.520  0.470  0.271  1.0
  F  F11  1  0.571  0.111  0.629  1.0
  F  F12  1  0.925  0.373  0.877  1.0
  F  F13  1  0.465  0.212  0.027  1.0
  F  F14  1  0.523  0.779  0.967  1.0
  F  F15  1  0.042  0.281  0.471  1.0
  F  F16  1  0.069  0.638  0.134  1.0
  F  F17  1  0.446  0.882  0.375  1.0
  F  F18  1  0.469  0.519  0.722  1.0
  F  F19  1  0.958  0.029  0.212  1.0
[/CIF]
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The compound described by Li3Co5OF11 crystallizes in the triclinic P1 space group. There are three inequivalent Li sites. In the first Li site, Li(1) is bonded in a 2-coordinate geometry to one F(10), one F(4), one F(6), and one F(8) atom. In the second Li site, Li(2) is bonded in a 2-coordinate geometry to one F(11), one F(2), one F(3), one F(7), and one F(9) atom. In the third Li site, Li(3) is bonded in a 5-coordinate geometry to one F(11), one F(2), one F(4), one F(5), and one F(8) atom. There are five inequivalent Co sites. In the first Co site, Co(1) is bonded in a distorted rectangular see-saw-like geometry to one F(1), one F(3), one F(4), and one F(5) atom. In the second Co site, Co(2) is bonded in a 4-coordinate geometry to one O(1), one F(2), one F(8), and one F(9) atom. In the third Co site, Co(3) is bonded in a 4-coordinate geometry to one F(10), one F(3), one F(4), and one F(7) atom. In the fourth Co site, Co(4) is bonded in a distorted rectangular see-saw-like geometry to one F(11), one F(6), one F(8), and one F(9) atom. In the fifth Co site, Co(5) is bonded in a 6-coordinate geometry to one O(1), one F(1), one F(10), one F(3), one F(7), and one F(9) atom. O(1) is bonded in a distorted water-like geometry to one Co(2) and one Co(5) atom. There are eleven inequivalent F sites. In the first F site, F(1) is bonded in a 2-coordinate geometry to one Co(1) and one Co(5) atom. In the second F site, F(2) is bonded in a 3-coordinate geometry to one Li(2), one Li(3), and one Co(2) atom. In the third F site, F(3) is bonded in a 4-coordinate geometry to one Li(2), one Co(1), one Co(3), and one Co(5) atom. In the fourth F site, F(4) is bonded in a 4-coordinate geometry to one Li(1), one Li(3), one Co(1), and one Co(3) atom. In the fifth F site, F(5) is bonded in a water-like geometry to one Li(3) and one Co(1) atom. In the sixth F site, F(6) is bonded in a water-like geometry to one Li(1) and one Co(4) atom. In the seventh F site, F(7) is bonded in a bent 120 degrees geometry to one Li(2), one Co(3), and one Co(5) atom. In the eighth F site, F(8) is bonded in a 4-coordinate geometry to one Li(1), one Li(3), one Co(2), and one Co(4) atom. In the ninth F site, F(9) is bonded in a 4-coordinate geometry to one Li(2), one Co(2), one Co(4), and one Co(5) atom. In the tenth F site, F(10) is bonded in a 3-coordinate geometry to one Li(1), one Co(3), and one Co(5) atom. In the eleventh F site, F(11) is bonded in a 3-coordinate geometry to one Li(2), one Li(3), and one Co(4) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li3Co5OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.234
_cell_length_b   5.578
_cell_length_c   9.072
_cell_angle_alpha   105.966
_cell_angle_beta   89.963
_cell_angle_gamma   117.426
_symmetry_Int_Tables_number   1
_cell_volume   223.558
_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
  Li  Li0  1  0.790  0.636  0.942  1.0
  Li  Li1  1  0.278  0.133  0.423  1.0
  Li  Li2  1  0.212  0.350  0.073  1.0
  Co  Co3  1  0.479  0.126  0.826  1.0
  Co  Co4  1  0.969  0.634  0.335  1.0
  Co  Co5  1  0.023  0.400  0.669  1.0
  Co  Co6  1  0.518  0.865  0.172  1.0
  Co  Co7  1  0.744  0.861  0.573  1.0
  O  O8  1  0.972  0.719  0.524  1.0
  F  F9  1  0.028  0.982  0.779  1.0
  F  F10  1  0.520  0.470  0.271  1.0
  F  F11  1  0.571  0.111  0.629  1.0
  F  F12  1  0.925  0.373  0.877  1.0
  F  F13  1  0.465  0.212  0.027  1.0
  F  F14  1  0.523  0.779  0.967  1.0
  F  F15  1  0.042  0.281  0.471  1.0
  F  F16  1  0.069  0.638  0.134  1.0
  F  F17  1  0.446  0.882  0.375  1.0
  F  F18  1  0.469  0.519  0.722  1.0
  F  F19  1  0.958  0.029  0.212  1.0
[/CIF]
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