The compound described by Li2V(PO3)5 crystallizes in the monoclinic Pc space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a distorted T-shaped geometry to one O(15), one O(3), and one O(8) atom. In the second Li site, Li(2) is bonded in a distorted T-shaped geometry to one O(13), one O(15), and one O(8) atom. V(1) is bonded to one O(1), one O(14), one O(4), one O(6), one O(7), and one O(9) atom to form VO6 octahedra that share corners with two equivalent P(2)O4 tetrahedra, corners with two equivalent P(4)O4 tetrahedra, and corners with two equivalent P(5)O4 tetrahedra. There are five inequivalent P sites. In the first P site, P(1) is bonded to one O(10), one O(11), one O(15), and one O(3) atom to form corner-sharing PO4 tetrahedra. In the second P site, P(2) is bonded to one O(12), one O(14), one O(2), and one O(9) atom to form PO4 tetrahedra that share corners with two equivalent V(1)O6 octahedra,  a cornercorner with one P(3)O4 tetrahedra, and  a cornercorner with one P(5)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 36-41°. In the third P site, P(3) is bonded to one O(10), one O(13), one O(2), and one O(8) atom to form corner-sharing PO4 tetrahedra. In the fourth P site, P(4) is bonded to one O(11), one O(4), one O(5), and one O(7) atom to form PO4 tetrahedra that share corners with two equivalent V(1)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra, and  a cornercorner with one P(5)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 32-42°. In the fifth P site, P(5) is bonded to one O(1), one O(12), one O(5), and one O(6) atom to form PO4 tetrahedra that share corners with two equivalent V(1)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra, and  a cornercorner with one P(4)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 47-48°. There are fifteen inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one V(1) and one P(5) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one P(2) and one P(3) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one Li(1) and one P(1) atom. In the fourth O site, O(4) is bonded in a bent 150 degrees geometry to one V(1) and one P(4) atom. In the fifth O site, O(5) is bonded in a bent 120 degrees geometry to one P(4) and one P(5) atom. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one V(1) and one P(5) atom. In the seventh O site, O(7) is bonded in a bent 150 degrees geometry to one V(1) and one P(4) atom. In the eighth O site, O(8) is bonded in a distorted trigonal planar geometry to one Li(1), one Li(2), and one P(3) atom. In the ninth O site, O(9) is bonded in a bent 150 degrees geometry to one V(1) and one P(2) atom. In the tenth O site, O(10) is bonded in a bent 150 degrees geometry to one P(1) and one P(3) atom. In the eleventh O site, O(11) is bonded in a bent 150 degrees geometry to one P(1) and one P(4) atom. In the twelfth O site, O(12) is bonded in a bent 120 degrees geometry to one P(2) and one P(5) atom. In the thirteenth O site, O(13) is bonded in a bent 120 degrees geometry to one Li(2) and one P(3) atom. In the fourteenth O site, O(14) is bonded in a bent 150 degrees geometry to one V(1) and one P(2) atom. In the fifteenth O site, O(15) is bonded in a distorted trigonal planar geometry to one Li(1), one Li(2), and one P(1) atom. is represented by the CIF file [CIF]
data_Li2V(PO3)5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.634
_cell_length_b   5.308
_cell_length_c   13.319
_cell_angle_alpha   71.065
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   644.204
_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  0.602  0.936  0.937  1.0
  Li  Li1  1  0.398  0.936  0.437  1.0
  Li  Li2  1  0.597  0.056  0.571  1.0
  Li  Li3  1  0.403  0.056  0.071  1.0
  V  V4  1  0.005  0.009  0.495  1.0
  V  V5  1  0.995  0.009  0.995  1.0
  P  P6  1  0.476  0.516  0.862  1.0
  P  P7  1  0.524  0.516  0.362  1.0
  P  P8  1  0.816  0.415  0.085  1.0
  P  P9  1  0.520  0.473  0.144  1.0
  P  P10  1  0.480  0.473  0.644  1.0
  P  P11  1  0.824  0.601  0.408  1.0
  P  P12  1  0.014  0.015  0.745  1.0
  P  P13  1  0.176  0.601  0.908  1.0
  P  P14  1  0.184  0.415  0.585  1.0
  P  P15  1  0.986  0.015  0.245  1.0
  O  O16  1  0.065  0.050  0.337  1.0
  O  O17  1  0.343  0.347  0.606  1.0
  O  O18  1  0.410  0.714  0.349  1.0
  O  O19  1  0.861  0.311  0.435  1.0
  O  O20  1  0.879  0.766  0.291  1.0
  O  O21  1  0.060  0.975  0.152  1.0
  O  O22  1  0.131  0.737  0.987  1.0
  O  O23  1  0.590  0.714  0.849  1.0
  O  O24  1  0.502  0.751  0.069  1.0
  O  O25  1  0.142  0.276  0.506  1.0
  O  O26  1  0.858  0.276  0.006  1.0
  O  O27  1  0.657  0.347  0.106  1.0
  O  O28  1  0.420  0.494  0.752  1.0
  O  O29  1  0.935  0.050  0.837  1.0
  O  O30  1  0.663  0.645  0.397  1.0
  O  O31  1  0.116  0.272  0.700  1.0
  O  O32  1  0.593  0.275  0.659  1.0
  O  O33  1  0.884  0.272  0.200  1.0
  O  O34  1  0.940  0.975  0.652  1.0
  O  O35  1  0.580  0.494  0.252  1.0
  O  O36  1  0.157  0.711  0.551  1.0
  O  O37  1  0.498  0.751  0.569  1.0
  O  O38  1  0.507  0.239  0.437  1.0
  O  O39  1  0.869  0.737  0.487  1.0
  O  O40  1  0.139  0.311  0.935  1.0
  O  O41  1  0.337  0.645  0.897  1.0
  O  O42  1  0.407  0.275  0.159  1.0
  O  O43  1  0.121  0.766  0.791  1.0
  O  O44  1  0.843  0.711  0.051  1.0
  O  O45  1  0.493  0.239  0.937  1.0
[/CIF]
.
The compound described by Li2V(PO3)5 crystallizes in the monoclinic Pc space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a distorted T-shaped geometry to one O(15), one O(3), and one O(8) atom. In the second Li site, Li(2) is bonded in a distorted T-shaped geometry to one O(13), one O(15), and one O(8) atom. V(1) is bonded to one O(1), one O(14), one O(4), one O(6), one O(7), and one O(9) atom to form VO6 octahedra that share corners with two equivalent P(2)O4 tetrahedra, corners with two equivalent P(4)O4 tetrahedra, and corners with two equivalent P(5)O4 tetrahedra. There are five inequivalent P sites. In the first P site, P(1) is bonded to one O(10), one O(11), one O(15), and one O(3) atom to form corner-sharing PO4 tetrahedra. In the second P site, P(2) is bonded to one O(12), one O(14), one O(2), and one O(9) atom to form PO4 tetrahedra that share corners with two equivalent V(1)O6 octahedra,  a cornercorner with one P(3)O4 tetrahedra, and  a cornercorner with one P(5)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 36-41°. In the third P site, P(3) is bonded to one O(10), one O(13), one O(2), and one O(8) atom to form corner-sharing PO4 tetrahedra. In the fourth P site, P(4) is bonded to one O(11), one O(4), one O(5), and one O(7) atom to form PO4 tetrahedra that share corners with two equivalent V(1)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra, and  a cornercorner with one P(5)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 32-42°. In the fifth P site, P(5) is bonded to one O(1), one O(12), one O(5), and one O(6) atom to form PO4 tetrahedra that share corners with two equivalent V(1)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra, and  a cornercorner with one P(4)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 47-48°. There are fifteen inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one V(1) and one P(5) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one P(2) and one P(3) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one Li(1) and one P(1) atom. In the fourth O site, O(4) is bonded in a bent 150 degrees geometry to one V(1) and one P(4) atom. In the fifth O site, O(5) is bonded in a bent 120 degrees geometry to one P(4) and one P(5) atom. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one V(1) and one P(5) atom. In the seventh O site, O(7) is bonded in a bent 150 degrees geometry to one V(1) and one P(4) atom. In the eighth O site, O(8) is bonded in a distorted trigonal planar geometry to one Li(1), one Li(2), and one P(3) atom. In the ninth O site, O(9) is bonded in a bent 150 degrees geometry to one V(1) and one P(2) atom. In the tenth O site, O(10) is bonded in a bent 150 degrees geometry to one P(1) and one P(3) atom. In the eleventh O site, O(11) is bonded in a bent 150 degrees geometry to one P(1) and one P(4) atom. In the twelfth O site, O(12) is bonded in a bent 120 degrees geometry to one P(2) and one P(5) atom. In the thirteenth O site, O(13) is bonded in a bent 120 degrees geometry to one Li(2) and one P(3) atom. In the fourteenth O site, O(14) is bonded in a bent 150 degrees geometry to one V(1) and one P(2) atom. In the fifteenth O site, O(15) is bonded in a distorted trigonal planar geometry to one Li(1), one Li(2), and one P(1) atom. is represented by the CIF file [CIF]
data_Li2V(PO3)5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.634
_cell_length_b   5.308
_cell_length_c   13.319
_cell_angle_alpha   71.065
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   644.204
_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  0.602  0.936  0.937  1.0
  Li  Li1  1  0.398  0.936  0.437  1.0
  Li  Li2  1  0.597  0.056  0.571  1.0
  Li  Li3  1  0.403  0.056  0.071  1.0
  V  V4  1  0.005  0.009  0.495  1.0
  V  V5  1  0.995  0.009  0.995  1.0
  P  P6  1  0.476  0.516  0.862  1.0
  P  P7  1  0.524  0.516  0.362  1.0
  P  P8  1  0.816  0.415  0.085  1.0
  P  P9  1  0.520  0.473  0.144  1.0
  P  P10  1  0.480  0.473  0.644  1.0
  P  P11  1  0.824  0.601  0.408  1.0
  P  P12  1  0.014  0.015  0.745  1.0
  P  P13  1  0.176  0.601  0.908  1.0
  P  P14  1  0.184  0.415  0.585  1.0
  P  P15  1  0.986  0.015  0.245  1.0
  O  O16  1  0.065  0.050  0.337  1.0
  O  O17  1  0.343  0.347  0.606  1.0
  O  O18  1  0.410  0.714  0.349  1.0
  O  O19  1  0.861  0.311  0.435  1.0
  O  O20  1  0.879  0.766  0.291  1.0
  O  O21  1  0.060  0.975  0.152  1.0
  O  O22  1  0.131  0.737  0.987  1.0
  O  O23  1  0.590  0.714  0.849  1.0
  O  O24  1  0.502  0.751  0.069  1.0
  O  O25  1  0.142  0.276  0.506  1.0
  O  O26  1  0.858  0.276  0.006  1.0
  O  O27  1  0.657  0.347  0.106  1.0
  O  O28  1  0.420  0.494  0.752  1.0
  O  O29  1  0.935  0.050  0.837  1.0
  O  O30  1  0.663  0.645  0.397  1.0
  O  O31  1  0.116  0.272  0.700  1.0
  O  O32  1  0.593  0.275  0.659  1.0
  O  O33  1  0.884  0.272  0.200  1.0
  O  O34  1  0.940  0.975  0.652  1.0
  O  O35  1  0.580  0.494  0.252  1.0
  O  O36  1  0.157  0.711  0.551  1.0
  O  O37  1  0.498  0.751  0.569  1.0
  O  O38  1  0.507  0.239  0.437  1.0
  O  O39  1  0.869  0.737  0.487  1.0
  O  O40  1  0.139  0.311  0.935  1.0
  O  O41  1  0.337  0.645  0.897  1.0
  O  O42  1  0.407  0.275  0.159  1.0
  O  O43  1  0.121  0.766  0.791  1.0
  O  O44  1  0.843  0.711  0.051  1.0
  O  O45  1  0.493  0.239  0.937  1.0
[/CIF]
.