The material described by Li3VMn(P2O7)2 crystallizes in the triclinic P1 space group. There are six inequivalent Li sites. In the first Li site, Li(1) is bonded in a see-saw-like geometry to one O(22), one O(3), one O(6), and one O(9) atom. In the second Li site, Li(2) is bonded in a see-saw-like geometry to one O(10), one O(21), one O(4), and one O(5) atom. In the third Li site, Li(3) is bonded to one O(18), one O(19), one O(2), and one O(26) atom to form distorted LiO4 tetrahedra that share  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra,  an edgeedge with one Mn(1)O6 octahedra, and  an edgeedge with one P(5)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 47-79°. In the fourth Li site, Li(4) is bonded to one O(1), one O(17), one O(20), and one O(25) atom to form distorted LiO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  an edgeedge with one Mn(2)O6 octahedra, and  an edgeedge with one P(6)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 47-79°. In the fifth Li site, Li(5) is bonded in a see-saw-like geometry to one O(19), one O(23), one O(25), and one O(8) atom. In the sixth Li site, Li(6) is bonded in a see-saw-like geometry to one O(20), one O(24), one O(26), and one O(7) atom. There are two inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(11), one O(24), one O(3), one O(7), and one O(9) atom to form VO6 octahedra that share  a cornercorner with one Li(4)O4 tetrahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra,  a cornercorner with one P(5)O4 tetrahedra,  a cornercorner with one P(6)O4 tetrahedra,  a cornercorner with one P(7)O4 tetrahedra, and  a cornercorner with one P(8)O4 tetrahedra. In the second V site, V(2) is bonded to one O(10), one O(12), one O(2), one O(23), one O(4), and one O(8) atom to form VO6 octahedra that share  a cornercorner with one Li(3)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(5)O4 tetrahedra,  a cornercorner with one P(6)O4 tetrahedra,  a cornercorner with one P(7)O4 tetrahedra, and  a cornercorner with one P(8)O4 tetrahedra. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(18), one O(19), one O(22), one O(25), one O(28), and one O(6) atom to form distorted MnO6 octahedra that share  a cornercorner with one Li(4)O4 tetrahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra,  a cornercorner with one P(6)O4 tetrahedra,  a cornercorner with one P(8)O4 tetrahedra, and  an edgeedge with one Li(3)O4 tetrahedra. In the second Mn site, Mn(2) is bonded to one O(17), one O(20), one O(21), one O(26), one O(27), and one O(5) atom to form distorted MnO6 octahedra that share  a cornercorner with one Li(3)O4 tetrahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra,  a cornercorner with one P(5)O4 tetrahedra,  a cornercorner with one P(7)O4 tetrahedra, and  an edgeedge with one Li(4)O4 tetrahedra. There are eight inequivalent P sites. In the first P site, P(1) is bonded to one O(13), one O(19), one O(5), and one O(7) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one Li(3)O4 tetrahedra, and  a cornercorner with one P(5)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 45-52°. In the second P site, P(2) is bonded to one O(14), one O(20), one O(6), and one O(8) atom to form PO4 tetrahedra that share  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one Li(4)O4 tetrahedra, and  a cornercorner with one P(6)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 45-52°. In the third P site, P(3) is bonded to one O(15), one O(17), one O(28), and one O(4) atom to form PO4 tetrahedra that share  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one Li(4)O4 tetrahedra, and  a cornercorner with one P(7)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 28-58°. In the fourth P site, P(4) is bonded to one O(16), one O(18), one O(27), and one O(3) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one Li(3)O4 tetrahedra, and  a cornercorner with one P(8)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 28-58°. In the fifth P site, P(5) is bonded to one O(11), one O(13), one O(2), and one O(26) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra, and  an edgeedge with one Li(3)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 33-47°. In the sixth P site, P(6) is bonded to one O(1), one O(12), one O(14), and one O(25) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra, and  an edgeedge with one Li(4)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 33-46°. In the seventh P site, P(7) is bonded to one O(15), one O(21), one O(23), and one O(9) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra, and  a cornercorner with one P(3)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 42-57°. In the eighth P site, P(8) is bonded to one O(10), one O(16), one O(22), and one O(24) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra, and  a cornercorner with one P(4)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 42-57°. There are twenty-eight inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Li(4), one V(1), and one P(6) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one Li(3), one V(2), and one P(5) atom. In the third O site, O(3) is bonded in a distorted T-shaped geometry to one Li(1), one V(1), and one P(4) atom. In the fourth O site, O(4) is bonded in a distorted T-shaped geometry to one Li(2), one V(2), and one P(3) atom. In the fifth O site, O(5) is bonded in a 3-coordinate geometry to one Li(2), one Mn(2), and one P(1) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Li(1), one Mn(1), and one P(2) atom. In the seventh O site, O(7) is bonded in a distorted trigonal planar geometry to one Li(6), one V(1), and one P(1) atom. In the eighth O site, O(8) is bonded in a distorted trigonal planar geometry to one Li(5), one V(2), and one P(2) atom. In the ninth O site, O(9) is bonded in a distorted T-shaped geometry to one Li(1), one V(1), and one P(7) atom. In the tenth O site, O(10) is bonded in a distorted T-shaped geometry to one Li(2), one V(2), and one P(8) atom. In the eleventh O site, O(11) is bonded in a distorted bent 120 degrees geometry to one V(1) and one P(5) atom. In the twelfth O site, O(12) is bonded in a distorted bent 120 degrees geometry to one V(2) and one P(6) atom. In the thirteenth O site, O(13) is bonded in a distorted bent 120 degrees geometry to one P(1) and one P(5) atom. In the fourteenth O site, O(14) is bonded in a distorted bent 120 degrees geometry to one P(2) and one P(6) atom. In the fifteenth O site, O(15) is bonded in a bent 120 degrees geometry to one P(3) and one P(7) atom. In the sixteenth O site, O(16) is bonded in a bent 120 degrees geometry to one P(4) and one P(8) atom. In the seventeenth O site, O(17) is bonded in a distorted trigonal planar geometry to one Li(4), one Mn(2), and one P(3) atom. In the eighteenth O site, O(18) is bonded in a distorted trigonal planar geometry to one Li(3), one Mn(1), and one P(4) atom. In the nineteenth O site, O(19) is bonded in a 4-coordinate geometry to one Li(3), one Li(5), one Mn(1), and one P(1) atom. In the twentieth O site, O(20) is bonded in a 4-coordinate geometry to one Li(4), one Li(6), one Mn(2), and one P(2) atom. In the twenty-first O site, O(21) is bonded in a distorted trigonal planar geometry to one Li(2), one Mn(2), and one P(7) atom. In the twenty-second O site, O(22) is bonded in a distorted trigonal planar geometry to one Li(1), one Mn(1), and one P(8) atom. In the twenty-third O site, O(23) is bonded in a distorted trigonal planar geometry to one Li(5), one V(2), and one P(7) atom. In the twenty-fourth O site, O(24) is bonded in a distorted trigonal planar geometry to one Li(6), one V(1), and one P(8) atom. In the twenty-fifth O site, O(25) is bonded in a 4-coordinate geometry to one Li(4), one Li(5), one Mn(1), and one P(6) atom. In the twenty-sixth O site, O(26) is bonded in a 4-coordinate geometry to one Li(3), one Li(6), one Mn(2), and one P(5) atom. In the twenty-seventh O site, O(27) is bonded in a distorted bent 150 degrees geometry to one Mn(2) and one P(4) atom. In the twenty-eighth O site, O(28) is bonded in a distorted bent 150 degrees geometry to one Mn(1) and one P(3) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li3MnV(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.046
_cell_length_b   7.094
_cell_length_c   8.380
_cell_angle_alpha   89.143
_cell_angle_beta   89.824
_cell_angle_gamma   70.905
_symmetry_Int_Tables_number   1
_cell_volume   283.487
_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  0.821  0.662  0.851  1.0
  Li  Li1  1  0.726  0.096  0.161  1.0
  Li  Li2  1  0.181  0.343  0.357  1.0
  Mn  Mn3  1  0.197  0.270  0.984  1.0
  O  O4  1  0.928  0.879  0.335  1.0
  O  O5  1  0.830  0.882  0.694  1.0
  O  O6  1  0.794  0.505  0.040  1.0
  O  O7  1  0.775  0.521  0.341  1.0
  O  O8  1  0.616  0.585  0.671  1.0
  O  O9  1  0.396  0.907  0.439  1.0
  O  O10  1  0.373  0.744  0.170  1.0
  O  O11  1  0.563  0.242  0.661  1.0
  O  O12  1  0.622  0.074  0.940  1.0
  O  O13  1  0.456  0.369  0.195  1.0
  O  O14  1  0.239  0.510  0.837  1.0
  O  O15  1  0.195  0.525  0.534  1.0
  O  O16  1  0.132  0.111  0.203  1.0
  O  O17  1  0.036  0.138  0.804  1.0
  P  P18  1  0.608  0.525  0.186  1.0
  P  P19  1  0.776  0.081  0.782  1.0
  P  P20  1  0.209  0.912  0.297  1.0
  P  P21  1  0.395  0.478  0.679  1.0
  V  V22  1  0.785  0.724  0.505  1.0
[/CIF]
.
The material described by Li3VMn(P2O7)2 crystallizes in the triclinic P1 space group. There are six inequivalent Li sites. In the first Li site, Li(1) is bonded in a see-saw-like geometry to one O(22), one O(3), one O(6), and one O(9) atom. In the second Li site, Li(2) is bonded in a see-saw-like geometry to one O(10), one O(21), one O(4), and one O(5) atom. In the third Li site, Li(3) is bonded to one O(18), one O(19), one O(2), and one O(26) atom to form distorted LiO4 tetrahedra that share  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra,  an edgeedge with one Mn(1)O6 octahedra, and  an edgeedge with one P(5)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 47-79°. In the fourth Li site, Li(4) is bonded to one O(1), one O(17), one O(20), and one O(25) atom to form distorted LiO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  an edgeedge with one Mn(2)O6 octahedra, and  an edgeedge with one P(6)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 47-79°. In the fifth Li site, Li(5) is bonded in a see-saw-like geometry to one O(19), one O(23), one O(25), and one O(8) atom. In the sixth Li site, Li(6) is bonded in a see-saw-like geometry to one O(20), one O(24), one O(26), and one O(7) atom. There are two inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(11), one O(24), one O(3), one O(7), and one O(9) atom to form VO6 octahedra that share  a cornercorner with one Li(4)O4 tetrahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra,  a cornercorner with one P(5)O4 tetrahedra,  a cornercorner with one P(6)O4 tetrahedra,  a cornercorner with one P(7)O4 tetrahedra, and  a cornercorner with one P(8)O4 tetrahedra. In the second V site, V(2) is bonded to one O(10), one O(12), one O(2), one O(23), one O(4), and one O(8) atom to form VO6 octahedra that share  a cornercorner with one Li(3)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(5)O4 tetrahedra,  a cornercorner with one P(6)O4 tetrahedra,  a cornercorner with one P(7)O4 tetrahedra, and  a cornercorner with one P(8)O4 tetrahedra. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(18), one O(19), one O(22), one O(25), one O(28), and one O(6) atom to form distorted MnO6 octahedra that share  a cornercorner with one Li(4)O4 tetrahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra,  a cornercorner with one P(6)O4 tetrahedra,  a cornercorner with one P(8)O4 tetrahedra, and  an edgeedge with one Li(3)O4 tetrahedra. In the second Mn site, Mn(2) is bonded to one O(17), one O(20), one O(21), one O(26), one O(27), and one O(5) atom to form distorted MnO6 octahedra that share  a cornercorner with one Li(3)O4 tetrahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra,  a cornercorner with one P(5)O4 tetrahedra,  a cornercorner with one P(7)O4 tetrahedra, and  an edgeedge with one Li(4)O4 tetrahedra. There are eight inequivalent P sites. In the first P site, P(1) is bonded to one O(13), one O(19), one O(5), and one O(7) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one Li(3)O4 tetrahedra, and  a cornercorner with one P(5)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 45-52°. In the second P site, P(2) is bonded to one O(14), one O(20), one O(6), and one O(8) atom to form PO4 tetrahedra that share  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one Li(4)O4 tetrahedra, and  a cornercorner with one P(6)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 45-52°. In the third P site, P(3) is bonded to one O(15), one O(17), one O(28), and one O(4) atom to form PO4 tetrahedra that share  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one Li(4)O4 tetrahedra, and  a cornercorner with one P(7)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 28-58°. In the fourth P site, P(4) is bonded to one O(16), one O(18), one O(27), and one O(3) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one Li(3)O4 tetrahedra, and  a cornercorner with one P(8)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 28-58°. In the fifth P site, P(5) is bonded to one O(11), one O(13), one O(2), and one O(26) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra, and  an edgeedge with one Li(3)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 33-47°. In the sixth P site, P(6) is bonded to one O(1), one O(12), one O(14), and one O(25) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra, and  an edgeedge with one Li(4)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 33-46°. In the seventh P site, P(7) is bonded to one O(15), one O(21), one O(23), and one O(9) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra, and  a cornercorner with one P(3)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 42-57°. In the eighth P site, P(8) is bonded to one O(10), one O(16), one O(22), and one O(24) atom to form PO4 tetrahedra that share  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra, and  a cornercorner with one P(4)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 42-57°. There are twenty-eight inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Li(4), one V(1), and one P(6) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one Li(3), one V(2), and one P(5) atom. In the third O site, O(3) is bonded in a distorted T-shaped geometry to one Li(1), one V(1), and one P(4) atom. In the fourth O site, O(4) is bonded in a distorted T-shaped geometry to one Li(2), one V(2), and one P(3) atom. In the fifth O site, O(5) is bonded in a 3-coordinate geometry to one Li(2), one Mn(2), and one P(1) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Li(1), one Mn(1), and one P(2) atom. In the seventh O site, O(7) is bonded in a distorted trigonal planar geometry to one Li(6), one V(1), and one P(1) atom. In the eighth O site, O(8) is bonded in a distorted trigonal planar geometry to one Li(5), one V(2), and one P(2) atom. In the ninth O site, O(9) is bonded in a distorted T-shaped geometry to one Li(1), one V(1), and one P(7) atom. In the tenth O site, O(10) is bonded in a distorted T-shaped geometry to one Li(2), one V(2), and one P(8) atom. In the eleventh O site, O(11) is bonded in a distorted bent 120 degrees geometry to one V(1) and one P(5) atom. In the twelfth O site, O(12) is bonded in a distorted bent 120 degrees geometry to one V(2) and one P(6) atom. In the thirteenth O site, O(13) is bonded in a distorted bent 120 degrees geometry to one P(1) and one P(5) atom. In the fourteenth O site, O(14) is bonded in a distorted bent 120 degrees geometry to one P(2) and one P(6) atom. In the fifteenth O site, O(15) is bonded in a bent 120 degrees geometry to one P(3) and one P(7) atom. In the sixteenth O site, O(16) is bonded in a bent 120 degrees geometry to one P(4) and one P(8) atom. In the seventeenth O site, O(17) is bonded in a distorted trigonal planar geometry to one Li(4), one Mn(2), and one P(3) atom. In the eighteenth O site, O(18) is bonded in a distorted trigonal planar geometry to one Li(3), one Mn(1), and one P(4) atom. In the nineteenth O site, O(19) is bonded in a 4-coordinate geometry to one Li(3), one Li(5), one Mn(1), and one P(1) atom. In the twentieth O site, O(20) is bonded in a 4-coordinate geometry to one Li(4), one Li(6), one Mn(2), and one P(2) atom. In the twenty-first O site, O(21) is bonded in a distorted trigonal planar geometry to one Li(2), one Mn(2), and one P(7) atom. In the twenty-second O site, O(22) is bonded in a distorted trigonal planar geometry to one Li(1), one Mn(1), and one P(8) atom. In the twenty-third O site, O(23) is bonded in a distorted trigonal planar geometry to one Li(5), one V(2), and one P(7) atom. In the twenty-fourth O site, O(24) is bonded in a distorted trigonal planar geometry to one Li(6), one V(1), and one P(8) atom. In the twenty-fifth O site, O(25) is bonded in a 4-coordinate geometry to one Li(4), one Li(5), one Mn(1), and one P(6) atom. In the twenty-sixth O site, O(26) is bonded in a 4-coordinate geometry to one Li(3), one Li(6), one Mn(2), and one P(5) atom. In the twenty-seventh O site, O(27) is bonded in a distorted bent 150 degrees geometry to one Mn(2) and one P(4) atom. In the twenty-eighth O site, O(28) is bonded in a distorted bent 150 degrees geometry to one Mn(1) and one P(3) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li3MnV(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.046
_cell_length_b   7.094
_cell_length_c   8.380
_cell_angle_alpha   89.143
_cell_angle_beta   89.824
_cell_angle_gamma   70.905
_symmetry_Int_Tables_number   1
_cell_volume   283.487
_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  0.821  0.662  0.851  1.0
  Li  Li1  1  0.726  0.096  0.161  1.0
  Li  Li2  1  0.181  0.343  0.357  1.0
  Mn  Mn3  1  0.197  0.270  0.984  1.0
  O  O4  1  0.928  0.879  0.335  1.0
  O  O5  1  0.830  0.882  0.694  1.0
  O  O6  1  0.794  0.505  0.040  1.0
  O  O7  1  0.775  0.521  0.341  1.0
  O  O8  1  0.616  0.585  0.671  1.0
  O  O9  1  0.396  0.907  0.439  1.0
  O  O10  1  0.373  0.744  0.170  1.0
  O  O11  1  0.563  0.242  0.661  1.0
  O  O12  1  0.622  0.074  0.940  1.0
  O  O13  1  0.456  0.369  0.195  1.0
  O  O14  1  0.239  0.510  0.837  1.0
  O  O15  1  0.195  0.525  0.534  1.0
  O  O16  1  0.132  0.111  0.203  1.0
  O  O17  1  0.036  0.138  0.804  1.0
  P  P18  1  0.608  0.525  0.186  1.0
  P  P19  1  0.776  0.081  0.782  1.0
  P  P20  1  0.209  0.912  0.297  1.0
  P  P21  1  0.395  0.478  0.679  1.0
  V  V22  1  0.785  0.724  0.505  1.0
[/CIF]
.