The crystal structure described by Li6Co2OF11 crystallizes in the triclinic P1 space group. There are six inequivalent Li sites. In the first Li site, Li(1) is bonded in a 1-coordinate geometry to one O(1), one F(11), one F(3), and one F(7) atom. In the second Li site, Li(2) is bonded in a distorted bent 150 degrees geometry to one F(10), one F(6), and one F(9) atom. In the third Li site, Li(3) is bonded in a 5-coordinate geometry to one O(1), one F(1), one F(10), one F(3), and one F(5) atom. In the fourth Li site, Li(4) is bonded in a 5-coordinate geometry to one F(11), one F(2), one F(4), one F(8), and one F(9) atom. In the fifth Li site, Li(5) is bonded in a 2-coordinate geometry to one Co(1), one F(3), and one F(4) atom. In the sixth Li site, Li(6) is bonded in a 5-coordinate geometry to one Co(2), one F(11), one F(7), one F(8), and one F(9) atom. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 5-coordinate geometry to one Li(5), one O(1), one F(10), one F(3), and one F(6) atom. In the second Co site, Co(2) is bonded in a 2-coordinate geometry to one Li(6), one F(5), and one F(8) atom. O(1) is bonded in a 4-coordinate geometry to one Li(1), one Li(3), one Co(1), and one F(1) atom. There are eleven inequivalent F sites. In the first F site, F(1) is bonded in a distorted bent 120 degrees geometry to one Li(3) and one O(1) atom. In the second F site, F(2) is bonded in a distorted single-bond geometry to one Li(4) atom. In the third F site, F(3) is bonded in a 4-coordinate geometry to one Li(1), one Li(3), one Li(5), and one Co(1) atom. In the fourth F site, F(4) is bonded in a 2-coordinate geometry to one Li(4) and one Li(5) atom. In the fifth F site, F(5) is bonded in an L-shaped geometry to one Li(3) and one Co(2) atom. In the sixth F site, F(6) is bonded in an L-shaped geometry to one Li(2) and one Co(1) atom. In the seventh F site, F(7) is bonded in a distorted L-shaped geometry to one Li(1) and one Li(6) atom. In the eighth F site, F(8) is bonded in a distorted single-bond geometry to one Li(4), one Li(6), and one Co(2) atom. In the ninth F site, F(9) is bonded in a 1-coordinate geometry to one Li(2), one Li(4), and one Li(6) atom. In the tenth F site, F(10) is bonded in a 3-coordinate geometry to one Li(2), one Li(3), and one Co(1) atom. In the eleventh F site, F(11) is bonded in a 3-coordinate geometry to one Li(1), one Li(4), and one Li(6) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li6Co2OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.127
_cell_length_b   5.452
_cell_length_c   8.696
_cell_angle_alpha   106.839
_cell_angle_beta   90.280
_cell_angle_gamma   117.976
_symmetry_Int_Tables_number   1
_cell_volume   202.599
_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  0.028  0.268  0.082  1.0
  Li  Li1  1  0.611  0.305  0.568  1.0
  Li  Li2  1  0.176  0.727  0.167  1.0
  Li  Li3  1  0.687  0.696  0.683  1.0
  Li  Li4  1  0.413  0.714  0.438  1.0
  Li  Li5  1  0.819  0.283  0.813  1.0
  Co  Co6  1  0.339  0.321  0.322  1.0
  Co  Co7  1  0.914  0.680  0.926  1.0
  O  O8  1  0.479  0.493  0.134  1.0
  F  F9  1  0.814  0.795  0.227  1.0
  F  F10  1  0.322  0.793  0.727  1.0
  F  F11  1  0.089  0.498  0.358  1.0
  F  F12  1  0.827  0.854  0.455  1.0
  F  F13  1  0.264  0.796  0.970  1.0
  F  F14  1  0.235  0.209  0.516  1.0
  F  F15  1  0.720  0.204  0.023  1.0
  F  F16  1  0.551  0.497  0.891  1.0
  F  F17  1  0.917  0.500  0.625  1.0
  F  F18  1  0.652  0.202  0.279  1.0
  F  F19  1  0.124  0.139  0.795  1.0
[/CIF]
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The crystal structure described by Li6Co2OF11 crystallizes in the triclinic P1 space group. There are six inequivalent Li sites. In the first Li site, Li(1) is bonded in a 1-coordinate geometry to one O(1), one F(11), one F(3), and one F(7) atom. In the second Li site, Li(2) is bonded in a distorted bent 150 degrees geometry to one F(10), one F(6), and one F(9) atom. In the third Li site, Li(3) is bonded in a 5-coordinate geometry to one O(1), one F(1), one F(10), one F(3), and one F(5) atom. In the fourth Li site, Li(4) is bonded in a 5-coordinate geometry to one F(11), one F(2), one F(4), one F(8), and one F(9) atom. In the fifth Li site, Li(5) is bonded in a 2-coordinate geometry to one Co(1), one F(3), and one F(4) atom. In the sixth Li site, Li(6) is bonded in a 5-coordinate geometry to one Co(2), one F(11), one F(7), one F(8), and one F(9) atom. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 5-coordinate geometry to one Li(5), one O(1), one F(10), one F(3), and one F(6) atom. In the second Co site, Co(2) is bonded in a 2-coordinate geometry to one Li(6), one F(5), and one F(8) atom. O(1) is bonded in a 4-coordinate geometry to one Li(1), one Li(3), one Co(1), and one F(1) atom. There are eleven inequivalent F sites. In the first F site, F(1) is bonded in a distorted bent 120 degrees geometry to one Li(3) and one O(1) atom. In the second F site, F(2) is bonded in a distorted single-bond geometry to one Li(4) atom. In the third F site, F(3) is bonded in a 4-coordinate geometry to one Li(1), one Li(3), one Li(5), and one Co(1) atom. In the fourth F site, F(4) is bonded in a 2-coordinate geometry to one Li(4) and one Li(5) atom. In the fifth F site, F(5) is bonded in an L-shaped geometry to one Li(3) and one Co(2) atom. In the sixth F site, F(6) is bonded in an L-shaped geometry to one Li(2) and one Co(1) atom. In the seventh F site, F(7) is bonded in a distorted L-shaped geometry to one Li(1) and one Li(6) atom. In the eighth F site, F(8) is bonded in a distorted single-bond geometry to one Li(4), one Li(6), and one Co(2) atom. In the ninth F site, F(9) is bonded in a 1-coordinate geometry to one Li(2), one Li(4), and one Li(6) atom. In the tenth F site, F(10) is bonded in a 3-coordinate geometry to one Li(2), one Li(3), and one Co(1) atom. In the eleventh F site, F(11) is bonded in a 3-coordinate geometry to one Li(1), one Li(4), and one Li(6) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li6Co2OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.127
_cell_length_b   5.452
_cell_length_c   8.696
_cell_angle_alpha   106.839
_cell_angle_beta   90.280
_cell_angle_gamma   117.976
_symmetry_Int_Tables_number   1
_cell_volume   202.599
_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  0.028  0.268  0.082  1.0
  Li  Li1  1  0.611  0.305  0.568  1.0
  Li  Li2  1  0.176  0.727  0.167  1.0
  Li  Li3  1  0.687  0.696  0.683  1.0
  Li  Li4  1  0.413  0.714  0.438  1.0
  Li  Li5  1  0.819  0.283  0.813  1.0
  Co  Co6  1  0.339  0.321  0.322  1.0
  Co  Co7  1  0.914  0.680  0.926  1.0
  O  O8  1  0.479  0.493  0.134  1.0
  F  F9  1  0.814  0.795  0.227  1.0
  F  F10  1  0.322  0.793  0.727  1.0
  F  F11  1  0.089  0.498  0.358  1.0
  F  F12  1  0.827  0.854  0.455  1.0
  F  F13  1  0.264  0.796  0.970  1.0
  F  F14  1  0.235  0.209  0.516  1.0
  F  F15  1  0.720  0.204  0.023  1.0
  F  F16  1  0.551  0.497  0.891  1.0
  F  F17  1  0.917  0.500  0.625  1.0
  F  F18  1  0.652  0.202  0.279  1.0
  F  F19  1  0.124  0.139  0.795  1.0
[/CIF]
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