The structure described by LiCuCO3 crystallizes in the monoclinic Pc space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a 6-coordinate geometry to one O(2), one O(6), two equivalent O(1), and two equivalent O(3) atoms. In the second Li site, Li(2) is bonded in a distorted trigonal planar geometry to one O(1), one O(4), and one O(6) atom. There are two inequivalent Cu sites. In the first Cu site, Cu(1) is bonded in a distorted T-shaped geometry to one O(2), one O(4), and one O(5) atom. In the second Cu site, Cu(2) is bonded in a distorted linear geometry to one O(3) and one O(5) 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(2), and one O(3) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Li(2), two equivalent Li(1), and one C(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Li(1), one Cu(1), and one C(1) atom. In the third O site, O(3) is bonded to two equivalent Li(1), one Cu(2), and one C(1) atom to form distorted corner-sharing OLi2CuC tetrahedra. In the fourth O site, O(4) is bonded in a trigonal planar geometry to one Li(2), one Cu(1), and one C(2) atom. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to one Cu(1), one Cu(2), and one C(2) atom. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one Li(1), one Li(2), and one C(2) atom. is represented by the CIF card [CIF]
data_LiCuCO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.215
_cell_length_b   4.809
_cell_length_c   17.136
_cell_angle_alpha   86.783
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   264.493
_cell_formula_units_Z   4
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  0.202  0.846  0.083  1.0
  Li  Li1  1  0.247  0.191  0.457  1.0
  Li  Li2  1  0.798  0.846  0.583  1.0
  Li  Li3  1  0.753  0.191  0.957  1.0
  Cu  Cu4  1  0.060  0.287  0.277  1.0
  Cu  Cu5  1  0.559  0.690  0.235  1.0
  Cu  Cu6  1  0.940  0.287  0.777  1.0
  Cu  Cu7  1  0.441  0.690  0.735  1.0
  C  C8  1  0.717  0.307  0.123  1.0
  C  C9  1  0.187  0.712  0.383  1.0
  C  C10  1  0.283  0.307  0.623  1.0
  C  C11  1  0.813  0.712  0.883  1.0
  O  O12  1  0.596  0.185  0.062  1.0
  O  O13  1  0.911  0.158  0.178  1.0
  O  O14  1  0.651  0.576  0.129  1.0
  O  O15  1  0.122  0.445  0.376  1.0
  O  O16  1  0.344  0.863  0.324  1.0
  O  O17  1  0.100  0.820  0.447  1.0
  O  O18  1  0.404  0.185  0.562  1.0
  O  O19  1  0.089  0.158  0.678  1.0
  O  O20  1  0.349  0.576  0.629  1.0
  O  O21  1  0.878  0.445  0.876  1.0
  O  O22  1  0.656  0.863  0.824  1.0
  O  O23  1  0.900  0.820  0.947  1.0
[/CIF]
.
The structure described by LiCuCO3 crystallizes in the monoclinic Pc space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a 6-coordinate geometry to one O(2), one O(6), two equivalent O(1), and two equivalent O(3) atoms. In the second Li site, Li(2) is bonded in a distorted trigonal planar geometry to one O(1), one O(4), and one O(6) atom. There are two inequivalent Cu sites. In the first Cu site, Cu(1) is bonded in a distorted T-shaped geometry to one O(2), one O(4), and one O(5) atom. In the second Cu site, Cu(2) is bonded in a distorted linear geometry to one O(3) and one O(5) 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(2), and one O(3) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Li(2), two equivalent Li(1), and one C(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Li(1), one Cu(1), and one C(1) atom. In the third O site, O(3) is bonded to two equivalent Li(1), one Cu(2), and one C(1) atom to form distorted corner-sharing OLi2CuC tetrahedra. In the fourth O site, O(4) is bonded in a trigonal planar geometry to one Li(2), one Cu(1), and one C(2) atom. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to one Cu(1), one Cu(2), and one C(2) atom. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one Li(1), one Li(2), and one C(2) atom. is represented by the CIF card [CIF]
data_LiCuCO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.215
_cell_length_b   4.809
_cell_length_c   17.136
_cell_angle_alpha   86.783
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   264.493
_cell_formula_units_Z   4
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  0.202  0.846  0.083  1.0
  Li  Li1  1  0.247  0.191  0.457  1.0
  Li  Li2  1  0.798  0.846  0.583  1.0
  Li  Li3  1  0.753  0.191  0.957  1.0
  Cu  Cu4  1  0.060  0.287  0.277  1.0
  Cu  Cu5  1  0.559  0.690  0.235  1.0
  Cu  Cu6  1  0.940  0.287  0.777  1.0
  Cu  Cu7  1  0.441  0.690  0.735  1.0
  C  C8  1  0.717  0.307  0.123  1.0
  C  C9  1  0.187  0.712  0.383  1.0
  C  C10  1  0.283  0.307  0.623  1.0
  C  C11  1  0.813  0.712  0.883  1.0
  O  O12  1  0.596  0.185  0.062  1.0
  O  O13  1  0.911  0.158  0.178  1.0
  O  O14  1  0.651  0.576  0.129  1.0
  O  O15  1  0.122  0.445  0.376  1.0
  O  O16  1  0.344  0.863  0.324  1.0
  O  O17  1  0.100  0.820  0.447  1.0
  O  O18  1  0.404  0.185  0.562  1.0
  O  O19  1  0.089  0.158  0.678  1.0
  O  O20  1  0.349  0.576  0.629  1.0
  O  O21  1  0.878  0.445  0.876  1.0
  O  O22  1  0.656  0.863  0.824  1.0
  O  O23  1  0.900  0.820  0.947  1.0
[/CIF]
.