The material structure described by LiCo(CO3)2 crystallizes in the monoclinic Cc space group. Li(1) is bonded in a 5-coordinate geometry to one O(1), one O(2), one O(3), one O(4), and one O(6) atom. Co(1) is bonded in a distorted square co-planar geometry to one O(1), one O(2), one O(5), and one O(6) atom. There are two inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one O(1), one O(4), and one O(5) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one O(2), one O(3), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one Li(1), one Co(1), and one C(1) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one Li(1), one Co(1), and one C(2) atom. In the third O site, O(3) is bonded in a distorted water-like geometry to one Li(1) and one C(2) atom. In the fourth O site, O(4) is bonded in a distorted bent 120 degrees geometry to one Li(1) and one C(1) atom. In the fifth O site, O(5) is bonded in a water-like geometry to one Co(1) and one C(1) atom. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one Li(1), one Co(1), and one C(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiCo(CO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.118
_cell_length_b   6.118
_cell_length_c   8.345
_cell_angle_alpha   82.616
_cell_angle_beta   82.616
_cell_angle_gamma   126.809
_symmetry_Int_Tables_number   1
_cell_volume   239.517
_cell_formula_units_Z   2
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  0.567  0.680  0.643  1.0
  Li  Li1  1  0.680  0.567  0.143  1.0
  Co  Co2  1  0.987  0.256  0.001  1.0
  Co  Co3  1  0.256  0.987  0.501  1.0
  C  C4  1  0.941  0.599  0.782  1.0
  C  C5  1  0.991  0.125  0.715  1.0
  C  C6  1  0.599  0.941  0.282  1.0
  C  C7  1  0.125  0.991  0.215  1.0
  O  O8  1  0.872  0.468  0.943  1.0
  O  O9  1  0.170  0.341  0.770  1.0
  O  O10  1  0.745  0.925  0.804  1.0
  O  O11  1  0.773  0.508  0.692  1.0
  O  O12  1  0.200  0.839  0.727  1.0
  O  O13  1  0.079  0.137  0.558  1.0
  O  O14  1  0.468  0.872  0.443  1.0
  O  O15  1  0.925  0.745  0.304  1.0
  O  O16  1  0.341  0.170  0.270  1.0
  O  O17  1  0.508  0.773  0.192  1.0
  O  O18  1  0.839  0.200  0.227  1.0
  O  O19  1  0.137  0.079  0.058  1.0
[/CIF]
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The material structure described by LiCo(CO3)2 crystallizes in the monoclinic Cc space group. Li(1) is bonded in a 5-coordinate geometry to one O(1), one O(2), one O(3), one O(4), and one O(6) atom. Co(1) is bonded in a distorted square co-planar geometry to one O(1), one O(2), one O(5), and one O(6) atom. There are two inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one O(1), one O(4), and one O(5) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one O(2), one O(3), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one Li(1), one Co(1), and one C(1) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one Li(1), one Co(1), and one C(2) atom. In the third O site, O(3) is bonded in a distorted water-like geometry to one Li(1) and one C(2) atom. In the fourth O site, O(4) is bonded in a distorted bent 120 degrees geometry to one Li(1) and one C(1) atom. In the fifth O site, O(5) is bonded in a water-like geometry to one Co(1) and one C(1) atom. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one Li(1), one Co(1), and one C(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiCo(CO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.118
_cell_length_b   6.118
_cell_length_c   8.345
_cell_angle_alpha   82.616
_cell_angle_beta   82.616
_cell_angle_gamma   126.809
_symmetry_Int_Tables_number   1
_cell_volume   239.517
_cell_formula_units_Z   2
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  0.567  0.680  0.643  1.0
  Li  Li1  1  0.680  0.567  0.143  1.0
  Co  Co2  1  0.987  0.256  0.001  1.0
  Co  Co3  1  0.256  0.987  0.501  1.0
  C  C4  1  0.941  0.599  0.782  1.0
  C  C5  1  0.991  0.125  0.715  1.0
  C  C6  1  0.599  0.941  0.282  1.0
  C  C7  1  0.125  0.991  0.215  1.0
  O  O8  1  0.872  0.468  0.943  1.0
  O  O9  1  0.170  0.341  0.770  1.0
  O  O10  1  0.745  0.925  0.804  1.0
  O  O11  1  0.773  0.508  0.692  1.0
  O  O12  1  0.200  0.839  0.727  1.0
  O  O13  1  0.079  0.137  0.558  1.0
  O  O14  1  0.468  0.872  0.443  1.0
  O  O15  1  0.925  0.745  0.304  1.0
  O  O16  1  0.341  0.170  0.270  1.0
  O  O17  1  0.508  0.773  0.192  1.0
  O  O18  1  0.839  0.200  0.227  1.0
  O  O19  1  0.137  0.079  0.058  1.0
[/CIF]
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