The compound described by LiV2(CO3)4 crystallizes in the monoclinic Pc space group. Li(1) is bonded in a 3-coordinate geometry to one O(1), one O(10), one O(12), and one O(2) atom. There are two inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(10), one O(11), one O(12), one O(5), one O(6), and one O(7) atom to form distorted edge-sharing VO7 pentagonal bipyramids. In the second V site, V(2) is bonded to one O(11), one O(3), one O(4), one O(6), one O(8), and one O(9) atom to form edge-sharing VO6 octahedra. There are four inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one O(1), one O(12), 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(4) atom. In the third C site, C(3) is bonded in a trigonal planar geometry to one O(11), one O(7), and one O(8) atom. In the fourth C site, C(4) is bonded in a trigonal planar geometry to one O(10), one O(6), and one O(9) atom. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Li(1), one V(1), and one C(1) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one Li(1) and one C(2) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one V(2) and one C(2) atom. In the fourth O site, O(4) is bonded in a linear geometry to one V(2) and one C(2) atom. In the fifth O site, O(5) is bonded in an L-shaped geometry to one V(1) and one C(1) atom. In the sixth O site, O(6) is bonded in a distorted trigonal planar geometry to one V(1), one V(2), and one C(4) atom. In the seventh O site, O(7) is bonded in a bent 150 degrees geometry to one V(1) and one C(3) atom. In the eighth O site, O(8) is bonded in a bent 150 degrees geometry to one V(2) and one C(3) atom. In the ninth O site, O(9) is bonded in a bent 150 degrees geometry to one V(2) and one C(4) atom. In the tenth O site, O(10) is bonded in a distorted trigonal planar geometry to one Li(1), one V(1), and one C(4) atom. In the eleventh O site, O(11) is bonded in a trigonal planar geometry to one V(1), one V(2), and one C(3) atom. In the twelfth O site, O(12) is bonded in a distorted T-shaped geometry to one Li(1), one V(1), and one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiV2(CO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.878
_cell_length_b   8.209
_cell_length_c   12.257
_cell_angle_alpha   48.399
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   442.229
_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  0.528  0.327  1.0
  Li  Li1  1  0.433  0.528  0.827  1.0
  V  V2  1  0.001  0.540  0.001  1.0
  V  V3  1  0.958  0.956  0.002  1.0
  V  V4  1  0.042  0.956  0.502  1.0
  V  V5  1  0.999  0.540  0.501  1.0
  C  C6  1  0.568  0.541  0.006  1.0
  C  C7  1  0.473  0.056  0.993  1.0
  C  C8  1  0.002  0.027  0.220  1.0
  C  C9  1  0.005  0.462  0.282  1.0
  C  C10  1  0.527  0.056  0.493  1.0
  C  C11  1  0.432  0.541  0.506  1.0
  C  C12  1  0.998  0.027  0.720  1.0
  C  C13  1  0.995  0.462  0.782  1.0
  O  O14  1  0.354  0.572  0.997  1.0
  O  O15  1  0.509  0.222  0.973  1.0
  O  O16  1  0.631  0.924  0.014  1.0
  O  O17  1  0.264  0.990  0.997  1.0
  O  O18  1  0.689  0.439  0.122  1.0
  O  O19  1  0.019  0.620  0.138  1.0
  O  O20  1  0.068  0.217  0.148  1.0
  O  O21  1  0.922  0.943  0.169  1.0
  O  O22  1  0.090  0.277  0.339  1.0
  O  O23  1  0.902  0.504  0.352  1.0
  O  O24  1  0.015  0.889  0.367  1.0
  O  O25  1  0.313  0.617  0.388  1.0
  O  O26  1  0.369  0.924  0.514  1.0
  O  O27  1  0.736  0.990  0.497  1.0
  O  O28  1  0.491  0.222  0.473  1.0
  O  O29  1  0.646  0.572  0.497  1.0
  O  O30  1  0.311  0.439  0.622  1.0
  O  O31  1  0.981  0.620  0.638  1.0
  O  O32  1  0.932  0.217  0.648  1.0
  O  O33  1  0.078  0.943  0.669  1.0
  O  O34  1  0.910  0.277  0.839  1.0
  O  O35  1  0.098  0.504  0.852  1.0
  O  O36  1  0.985  0.889  0.867  1.0
  O  O37  1  0.687  0.617  0.888  1.0
[/CIF]
.
The compound described by LiV2(CO3)4 crystallizes in the monoclinic Pc space group. Li(1) is bonded in a 3-coordinate geometry to one O(1), one O(10), one O(12), and one O(2) atom. There are two inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(10), one O(11), one O(12), one O(5), one O(6), and one O(7) atom to form distorted edge-sharing VO7 pentagonal bipyramids. In the second V site, V(2) is bonded to one O(11), one O(3), one O(4), one O(6), one O(8), and one O(9) atom to form edge-sharing VO6 octahedra. There are four inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one O(1), one O(12), 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(4) atom. In the third C site, C(3) is bonded in a trigonal planar geometry to one O(11), one O(7), and one O(8) atom. In the fourth C site, C(4) is bonded in a trigonal planar geometry to one O(10), one O(6), and one O(9) atom. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Li(1), one V(1), and one C(1) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one Li(1) and one C(2) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one V(2) and one C(2) atom. In the fourth O site, O(4) is bonded in a linear geometry to one V(2) and one C(2) atom. In the fifth O site, O(5) is bonded in an L-shaped geometry to one V(1) and one C(1) atom. In the sixth O site, O(6) is bonded in a distorted trigonal planar geometry to one V(1), one V(2), and one C(4) atom. In the seventh O site, O(7) is bonded in a bent 150 degrees geometry to one V(1) and one C(3) atom. In the eighth O site, O(8) is bonded in a bent 150 degrees geometry to one V(2) and one C(3) atom. In the ninth O site, O(9) is bonded in a bent 150 degrees geometry to one V(2) and one C(4) atom. In the tenth O site, O(10) is bonded in a distorted trigonal planar geometry to one Li(1), one V(1), and one C(4) atom. In the eleventh O site, O(11) is bonded in a trigonal planar geometry to one V(1), one V(2), and one C(3) atom. In the twelfth O site, O(12) is bonded in a distorted T-shaped geometry to one Li(1), one V(1), and one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiV2(CO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.878
_cell_length_b   8.209
_cell_length_c   12.257
_cell_angle_alpha   48.399
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   442.229
_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  0.528  0.327  1.0
  Li  Li1  1  0.433  0.528  0.827  1.0
  V  V2  1  0.001  0.540  0.001  1.0
  V  V3  1  0.958  0.956  0.002  1.0
  V  V4  1  0.042  0.956  0.502  1.0
  V  V5  1  0.999  0.540  0.501  1.0
  C  C6  1  0.568  0.541  0.006  1.0
  C  C7  1  0.473  0.056  0.993  1.0
  C  C8  1  0.002  0.027  0.220  1.0
  C  C9  1  0.005  0.462  0.282  1.0
  C  C10  1  0.527  0.056  0.493  1.0
  C  C11  1  0.432  0.541  0.506  1.0
  C  C12  1  0.998  0.027  0.720  1.0
  C  C13  1  0.995  0.462  0.782  1.0
  O  O14  1  0.354  0.572  0.997  1.0
  O  O15  1  0.509  0.222  0.973  1.0
  O  O16  1  0.631  0.924  0.014  1.0
  O  O17  1  0.264  0.990  0.997  1.0
  O  O18  1  0.689  0.439  0.122  1.0
  O  O19  1  0.019  0.620  0.138  1.0
  O  O20  1  0.068  0.217  0.148  1.0
  O  O21  1  0.922  0.943  0.169  1.0
  O  O22  1  0.090  0.277  0.339  1.0
  O  O23  1  0.902  0.504  0.352  1.0
  O  O24  1  0.015  0.889  0.367  1.0
  O  O25  1  0.313  0.617  0.388  1.0
  O  O26  1  0.369  0.924  0.514  1.0
  O  O27  1  0.736  0.990  0.497  1.0
  O  O28  1  0.491  0.222  0.473  1.0
  O  O29  1  0.646  0.572  0.497  1.0
  O  O30  1  0.311  0.439  0.622  1.0
  O  O31  1  0.981  0.620  0.638  1.0
  O  O32  1  0.932  0.217  0.648  1.0
  O  O33  1  0.078  0.943  0.669  1.0
  O  O34  1  0.910  0.277  0.839  1.0
  O  O35  1  0.098  0.504  0.852  1.0
  O  O36  1  0.985  0.889  0.867  1.0
  O  O37  1  0.687  0.617  0.888  1.0
[/CIF]
.