The compound described by Li3Co2Cu3O10 crystallizes in the triclinic P-1 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one O(4), two equivalent O(3), and two equivalent O(5) atoms to form distorted LiO6 octahedra that share  a cornercorner with one Li(2)O6 octahedra, corners with two equivalent Co(1)O6 octahedra, corners with three equivalent Cu(2)O6 octahedra,  an edgeedge with one Cu(1)O6 octahedra,  an edgeedge with one Cu(2)O6 octahedra, edges with two equivalent Li(1)O6 octahedra, edges with two equivalent Li(2)O6 octahedra, and edges with three equivalent Co(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 11-17°. In the second Li site, Li(2) is bonded to two equivalent O(3), two equivalent O(4), and two equivalent O(5) atoms to form LiO6 octahedra that share corners with two equivalent Li(1)O6 octahedra, corners with two equivalent Cu(1)O6 octahedra, edges with two equivalent Cu(2)O6 octahedra, edges with four equivalent Li(1)O6 octahedra, and edges with four equivalent Co(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 9-16°. Co(1) is bonded to one O(1), one O(2), one O(4), one O(5), and two equivalent O(3) atoms to form CoO6 octahedra that share  a cornercorner with one Cu(1)O6 octahedra, corners with two equivalent Li(1)O6 octahedra,  an edgeedge with one Co(1)O6 octahedra,  an edgeedge with one Cu(1)O6 octahedra, edges with two equivalent Li(2)O6 octahedra, edges with three equivalent Li(1)O6 octahedra, and edges with three equivalent Cu(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 5-13°. There are two inequivalent Cu sites. In the first Cu site, Cu(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(4) atoms to form distorted CuO6 octahedra that share corners with two equivalent Li(2)O6 octahedra, corners with two equivalent Co(1)O6 octahedra, corners with two equivalent Cu(2)O6 octahedra, edges with two equivalent Li(1)O6 octahedra, edges with two equivalent Co(1)O6 octahedra, and edges with four equivalent Cu(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 5-17°. In the second Cu site, Cu(2) is bonded to one O(4), one O(5), two equivalent O(1), and two equivalent O(2) atoms to form CuO6 octahedra that share  a cornercorner with one Cu(1)O6 octahedra, corners with three equivalent Li(1)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra, edges with two equivalent Cu(1)O6 octahedra, edges with two equivalent Cu(2)O6 octahedra, and edges with three equivalent Co(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 11-17°. There are five inequivalent O sites. In the first O site, O(1) is bonded to one Li(1), one Co(1), one Cu(1), and two equivalent Cu(2) atoms to form distorted OLiCoCu3 square pyramids that share  a cornercorner with one O(1)LiCoCu3 square pyramid, corners with two equivalent O(3)Li3Co2 square pyramids, corners with three equivalent O(5)Li3CoCu square pyramids,  an edgeedge with one O(3)Li3Co2 square pyramid,  an edgeedge with one O(5)Li3CoCu square pyramid,  an edgeedge with one O(1)LiCoCu3 square pyramid, and edges with three equivalent O(4)Li2CoCu2 square pyramids. In the second O site, O(2) is bonded in a rectangular see-saw-like geometry to one Co(1), one Cu(1), and two equivalent Cu(2) atoms. In the third O site, O(3) is bonded to one Li(2), two equivalent Li(1), and two equivalent Co(1) atoms to form OLi3Co2 square pyramids that share  a cornercorner with one O(3)Li3Co2 square pyramid, corners with two equivalent O(4)Li2CoCu2 square pyramids, corners with two equivalent O(5)Li3CoCu square pyramids, corners with two equivalent O(1)LiCoCu3 square pyramids,  an edgeedge with one O(1)LiCoCu3 square pyramid, edges with two equivalent O(4)Li2CoCu2 square pyramids, edges with two equivalent O(3)Li3Co2 square pyramids, and edges with three equivalent O(5)Li3CoCu square pyramids. In the fourth O site, O(4) is bonded to one Li(1), one Li(2), one Co(1), one Cu(1), and one Cu(2) atom to form OLi2CoCu2 square pyramids that share corners with two equivalent O(4)Li2CoCu2 square pyramids, corners with two equivalent O(3)Li3Co2 square pyramids, corners with two equivalent O(5)Li3CoCu square pyramids, edges with two equivalent O(3)Li3Co2 square pyramids, edges with two equivalent O(5)Li3CoCu square pyramids, and edges with three equivalent O(1)LiCoCu3 square pyramids. In the fifth O site, O(5) is bonded to one Li(2), two equivalent Li(1), one Co(1), and one Cu(2) atom to form OLi3CoCu square pyramids that share  a cornercorner with one O(5)Li3CoCu square pyramid, corners with two equivalent O(4)Li2CoCu2 square pyramids, corners with two equivalent O(3)Li3Co2 square pyramids, corners with three equivalent O(1)LiCoCu3 square pyramids,  an edgeedge with one O(5)Li3CoCu square pyramid,  an edgeedge with one O(1)LiCoCu3 square pyramid, edges with two equivalent O(4)Li2CoCu2 square pyramids, and edges with three equivalent O(3)Li3Co2 square pyramids. is represented by the CIF card [CIF]
data_Li3Co2Cu3O10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.029
_cell_length_b   5.265
_cell_length_c   7.445
_cell_angle_alpha   108.861
_cell_angle_beta   99.675
_cell_angle_gamma   102.509
_symmetry_Int_Tables_number   1
_cell_volume   175.956
_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  0.215  0.912  0.405  1.0
  Li  Li1  1  0.500  0.500  0.500  1.0
  Li  Li2  1  0.785  0.088  0.595  1.0
  Co  Co3  1  0.112  0.693  0.694  1.0
  Co  Co4  1  0.888  0.307  0.306  1.0
  Cu  Cu5  1  0.000  0.500  0.000  1.0
  Cu  Cu6  1  0.697  0.882  0.903  1.0
  Cu  Cu7  1  0.303  0.118  0.097  1.0
  O  O8  1  0.052  0.041  0.835  1.0
  O  O9  1  0.318  0.734  0.953  1.0
  O  O10  1  0.109  0.331  0.545  1.0
  O  O11  1  0.211  0.469  0.227  1.0
  O  O12  1  0.445  0.857  0.658  1.0
  O  O13  1  0.555  0.143  0.342  1.0
  O  O14  1  0.789  0.531  0.773  1.0
  O  O15  1  0.891  0.669  0.455  1.0
  O  O16  1  0.682  0.266  0.047  1.0
  O  O17  1  0.948  0.959  0.165  1.0
[/CIF]
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The compound described by Li3Co2Cu3O10 crystallizes in the triclinic P-1 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one O(4), two equivalent O(3), and two equivalent O(5) atoms to form distorted LiO6 octahedra that share  a cornercorner with one Li(2)O6 octahedra, corners with two equivalent Co(1)O6 octahedra, corners with three equivalent Cu(2)O6 octahedra,  an edgeedge with one Cu(1)O6 octahedra,  an edgeedge with one Cu(2)O6 octahedra, edges with two equivalent Li(1)O6 octahedra, edges with two equivalent Li(2)O6 octahedra, and edges with three equivalent Co(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 11-17°. In the second Li site, Li(2) is bonded to two equivalent O(3), two equivalent O(4), and two equivalent O(5) atoms to form LiO6 octahedra that share corners with two equivalent Li(1)O6 octahedra, corners with two equivalent Cu(1)O6 octahedra, edges with two equivalent Cu(2)O6 octahedra, edges with four equivalent Li(1)O6 octahedra, and edges with four equivalent Co(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 9-16°. Co(1) is bonded to one O(1), one O(2), one O(4), one O(5), and two equivalent O(3) atoms to form CoO6 octahedra that share  a cornercorner with one Cu(1)O6 octahedra, corners with two equivalent Li(1)O6 octahedra,  an edgeedge with one Co(1)O6 octahedra,  an edgeedge with one Cu(1)O6 octahedra, edges with two equivalent Li(2)O6 octahedra, edges with three equivalent Li(1)O6 octahedra, and edges with three equivalent Cu(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 5-13°. There are two inequivalent Cu sites. In the first Cu site, Cu(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(4) atoms to form distorted CuO6 octahedra that share corners with two equivalent Li(2)O6 octahedra, corners with two equivalent Co(1)O6 octahedra, corners with two equivalent Cu(2)O6 octahedra, edges with two equivalent Li(1)O6 octahedra, edges with two equivalent Co(1)O6 octahedra, and edges with four equivalent Cu(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 5-17°. In the second Cu site, Cu(2) is bonded to one O(4), one O(5), two equivalent O(1), and two equivalent O(2) atoms to form CuO6 octahedra that share  a cornercorner with one Cu(1)O6 octahedra, corners with three equivalent Li(1)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra, edges with two equivalent Cu(1)O6 octahedra, edges with two equivalent Cu(2)O6 octahedra, and edges with three equivalent Co(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 11-17°. There are five inequivalent O sites. In the first O site, O(1) is bonded to one Li(1), one Co(1), one Cu(1), and two equivalent Cu(2) atoms to form distorted OLiCoCu3 square pyramids that share  a cornercorner with one O(1)LiCoCu3 square pyramid, corners with two equivalent O(3)Li3Co2 square pyramids, corners with three equivalent O(5)Li3CoCu square pyramids,  an edgeedge with one O(3)Li3Co2 square pyramid,  an edgeedge with one O(5)Li3CoCu square pyramid,  an edgeedge with one O(1)LiCoCu3 square pyramid, and edges with three equivalent O(4)Li2CoCu2 square pyramids. In the second O site, O(2) is bonded in a rectangular see-saw-like geometry to one Co(1), one Cu(1), and two equivalent Cu(2) atoms. In the third O site, O(3) is bonded to one Li(2), two equivalent Li(1), and two equivalent Co(1) atoms to form OLi3Co2 square pyramids that share  a cornercorner with one O(3)Li3Co2 square pyramid, corners with two equivalent O(4)Li2CoCu2 square pyramids, corners with two equivalent O(5)Li3CoCu square pyramids, corners with two equivalent O(1)LiCoCu3 square pyramids,  an edgeedge with one O(1)LiCoCu3 square pyramid, edges with two equivalent O(4)Li2CoCu2 square pyramids, edges with two equivalent O(3)Li3Co2 square pyramids, and edges with three equivalent O(5)Li3CoCu square pyramids. In the fourth O site, O(4) is bonded to one Li(1), one Li(2), one Co(1), one Cu(1), and one Cu(2) atom to form OLi2CoCu2 square pyramids that share corners with two equivalent O(4)Li2CoCu2 square pyramids, corners with two equivalent O(3)Li3Co2 square pyramids, corners with two equivalent O(5)Li3CoCu square pyramids, edges with two equivalent O(3)Li3Co2 square pyramids, edges with two equivalent O(5)Li3CoCu square pyramids, and edges with three equivalent O(1)LiCoCu3 square pyramids. In the fifth O site, O(5) is bonded to one Li(2), two equivalent Li(1), one Co(1), and one Cu(2) atom to form OLi3CoCu square pyramids that share  a cornercorner with one O(5)Li3CoCu square pyramid, corners with two equivalent O(4)Li2CoCu2 square pyramids, corners with two equivalent O(3)Li3Co2 square pyramids, corners with three equivalent O(1)LiCoCu3 square pyramids,  an edgeedge with one O(5)Li3CoCu square pyramid,  an edgeedge with one O(1)LiCoCu3 square pyramid, edges with two equivalent O(4)Li2CoCu2 square pyramids, and edges with three equivalent O(3)Li3Co2 square pyramids. is represented by the CIF card [CIF]
data_Li3Co2Cu3O10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.029
_cell_length_b   5.265
_cell_length_c   7.445
_cell_angle_alpha   108.861
_cell_angle_beta   99.675
_cell_angle_gamma   102.509
_symmetry_Int_Tables_number   1
_cell_volume   175.956
_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  0.215  0.912  0.405  1.0
  Li  Li1  1  0.500  0.500  0.500  1.0
  Li  Li2  1  0.785  0.088  0.595  1.0
  Co  Co3  1  0.112  0.693  0.694  1.0
  Co  Co4  1  0.888  0.307  0.306  1.0
  Cu  Cu5  1  0.000  0.500  0.000  1.0
  Cu  Cu6  1  0.697  0.882  0.903  1.0
  Cu  Cu7  1  0.303  0.118  0.097  1.0
  O  O8  1  0.052  0.041  0.835  1.0
  O  O9  1  0.318  0.734  0.953  1.0
  O  O10  1  0.109  0.331  0.545  1.0
  O  O11  1  0.211  0.469  0.227  1.0
  O  O12  1  0.445  0.857  0.658  1.0
  O  O13  1  0.555  0.143  0.342  1.0
  O  O14  1  0.789  0.531  0.773  1.0
  O  O15  1  0.891  0.669  0.455  1.0
  O  O16  1  0.682  0.266  0.047  1.0
  O  O17  1  0.948  0.959  0.165  1.0
[/CIF]
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