The material structure described by Li10Fe3Sb7O24 crystallizes in the triclinic P1 space group. There are ten inequivalent Li sites. In the first Li site, Li(1) is bonded in a 4-coordinate geometry to one O(11), one O(5), one O(8), and one O(9) atom. In the second Li site, Li(2) is bonded in a distorted see-saw-like geometry to one O(10), one O(12), one O(6), and one O(7) atom. In the third Li site, Li(3) is bonded in a distorted see-saw-like geometry to one O(10), one O(11), one O(13), and one O(15) atom. In the fourth Li site, Li(4) is bonded in a 4-coordinate geometry to one O(14), one O(16), one O(18), and one O(9) atom. In the fifth Li site, Li(5) is bonded in a 3-coordinate geometry to one O(13), one O(18), one O(19), one O(22), and one O(23) atom. In the sixth Li site, Li(6) is bonded in a 4-coordinate geometry to one O(14), one O(17), one O(20), and one O(24) atom. In the seventh Li site, Li(7) is bonded in a 4-coordinate geometry to one O(16), one O(18), one O(19), and one O(22) atom. In the eighth Li site, Li(8) is bonded to one O(15), one O(17), one O(20), and one O(21) atom to form distorted LiO4 tetrahedra that share  a cornercorner with one Sb(1)O6 octahedra,  a cornercorner with one Sb(3)O6 octahedra,  a cornercorner with one Sb(6)O6 octahedra, and corners with two equivalent Sb(7)O6 octahedra. The corner-sharing octahedral tilt angles range from 44-65°. In the ninth Li site, Li(9) is bonded in a rectangular see-saw-like geometry to one O(1), one O(21), one O(3), and one O(7) atom. In the tenth Li site, Li(10) is bonded in a rectangular see-saw-like geometry to one O(2), one O(22), one O(4), and one O(8) atom. There are three inequivalent Fe sites. In the first Fe site, Fe(1) is bonded to one O(1), one O(10), one O(11), one O(3), one O(5), and one O(7) atom to form distorted FeO6 octahedra that share corners with two equivalent Sb(2)O6 octahedra, corners with two equivalent Sb(4)O6 octahedra,  an edgeedge with one Sb(1)O6 octahedra,  an edgeedge with one Sb(3)O6 octahedra, and  an edgeedge with one Sb(7)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-57°. In the second Fe site, Fe(2) is bonded to one O(12), one O(2), one O(4), one O(6), one O(8), and one O(9) atom to form FeO6 octahedra that share corners with two equivalent Sb(1)O6 octahedra, corners with two equivalent Sb(3)O6 octahedra,  an edgeedge with one Sb(2)O6 octahedra,  an edgeedge with one Sb(4)O6 octahedra, and  an edgeedge with one Sb(6)O6 octahedra. The corner-sharing octahedral tilt angles range from 44-52°. In the third Fe site, Fe(3) is bonded in a 6-coordinate geometry to one O(12), one O(14), one O(16), one O(18), one O(20), and one O(9) atom. There are seven inequivalent Sb sites. In the first Sb site, Sb(1) is bonded to one O(2), one O(21), one O(24), one O(3), one O(6), and one O(7) atom to form SbO6 octahedra that share corners with two equivalent Fe(2)O6 octahedra, corners with two equivalent Sb(6)O6 octahedra,  a cornercorner with one Li(8)O4 tetrahedra,  an edgeedge with one Fe(1)O6 octahedra,  an edgeedge with one Sb(3)O6 octahedra, and  an edgeedge with one Sb(7)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-52°. In the second Sb site, Sb(2) is bonded to one O(1), one O(22), one O(23), one O(4), one O(5), and one O(8) atom to form distorted SbO6 octahedra that share corners with two equivalent Fe(1)O6 octahedra, corners with two equivalent Sb(7)O6 octahedra,  an edgeedge with one Fe(2)O6 octahedra,  an edgeedge with one Sb(4)O6 octahedra, and  an edgeedge with one Sb(6)O6 octahedra. The corner-sharing octahedral tilt angles range from 48-57°. In the third Sb site, Sb(3) is bonded to one O(10), one O(12), one O(14), one O(15), one O(6), and one O(7) atom to form SbO6 octahedra that share corners with two equivalent Fe(2)O6 octahedra,  a cornercorner with one Li(8)O4 tetrahedra,  an edgeedge with one Fe(1)O6 octahedra, and  an edgeedge with one Sb(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 44-51°. In the fourth Sb site, Sb(4) is bonded to one O(11), one O(13), one O(16), one O(5), one O(8), and one O(9) atom to form SbO6 octahedra that share corners with two equivalent Fe(1)O6 octahedra,  an edgeedge with one Fe(2)O6 octahedra, and  an edgeedge with one Sb(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-42°. In the fifth Sb site, Sb(5) is bonded in a 6-coordinate geometry to one O(10), one O(11), one O(13), one O(15), one O(17), and one O(19) atom. In the sixth Sb site, Sb(6) is bonded to one O(18), one O(2), one O(20), one O(22), one O(24), and one O(4) atom to form SbO6 octahedra that share corners with two equivalent Sb(1)O6 octahedra,  a cornercorner with one Li(8)O4 tetrahedra,  an edgeedge with one Fe(2)O6 octahedra, and  an edgeedge with one Sb(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-47°. In the seventh Sb site, Sb(7) is bonded to one O(1), one O(17), one O(19), one O(21), one O(23), and one O(3) atom to form SbO6 octahedra that share corners with two equivalent Sb(2)O6 octahedra, corners with two equivalent Li(8)O4 tetrahedra,  an edgeedge with one Fe(1)O6 octahedra, and  an edgeedge with one Sb(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 48-56°. There are twenty-four inequivalent O sites. In the first O site, O(1) is bonded to one Li(9), one Fe(1), one Sb(2), and one Sb(7) atom to form distorted OLiFeSb2 trigonal pyramids that share  a cornercorner with one O(17)Li2Sb2 tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid, corners with two equivalent O(5)LiFeSb2 trigonal pyramids, and  an edgeedge with one O(7)Li2FeSb2 trigonal bipyramid. In the second O site, O(2) is bonded to one Li(10), one Fe(2), one Sb(1), and one Sb(6) atom to form OLiFeSb2 trigonal pyramids that share  a cornercorner with one O(20)Li2FeSb tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(9)Li2Fe2Sb trigonal bipyramid,  a cornercorner with one O(7)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid, corners with two equivalent O(6)LiFeSb2 trigonal pyramids,  an edgeedge with one O(4)LiFeSb2 tetrahedra, and  an edgeedge with one O(8)Li2FeSb2 trigonal bipyramid. In the third O site, O(3) is bonded in a distorted rectangular see-saw-like geometry to one Li(9), one Fe(1), one Sb(1), and one Sb(7) atom. In the fourth O site, O(4) is bonded to one Li(10), one Fe(2), one Sb(2), and one Sb(6) atom to form distorted OLiFeSb2 tetrahedra that share  a cornercorner with one O(20)Li2FeSb tetrahedra,  a cornercorner with one O(9)Li2Fe2Sb trigonal bipyramid,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid,  a cornercorner with one O(1)LiFeSb2 trigonal pyramid,  a cornercorner with one O(2)LiFeSb2 trigonal pyramid,  a cornercorner with one O(5)LiFeSb2 trigonal pyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid,  an edgeedge with one O(8)Li2FeSb2 trigonal bipyramid, and  an edgeedge with one O(2)LiFeSb2 trigonal pyramid. In the fifth O site, O(5) is bonded to one Li(1), one Fe(1), one Sb(2), and one Sb(4) atom to form distorted OLiFeSb2 trigonal pyramids that share  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(7)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid, corners with two equivalent O(1)LiFeSb2 trigonal pyramids,  an edgeedge with one O(9)Li2Fe2Sb trigonal bipyramid, and  an edgeedge with one O(8)Li2FeSb2 trigonal bipyramid. In the sixth O site, O(6) is bonded to one Li(2), one Fe(2), one Sb(1), and one Sb(3) atom to form distorted OLiFeSb2 trigonal pyramids that share  a cornercorner with one O(14)Li2FeSb tetrahedra,  a cornercorner with one O(15)Li2Sb2 tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(9)Li2Fe2Sb trigonal bipyramid,  a cornercorner with one O(7)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid, corners with two equivalent O(2)LiFeSb2 trigonal pyramids,  an edgeedge with one O(7)Li2FeSb2 trigonal bipyramid, and  an edgeedge with one O(12)LiFe2Sb trigonal pyramid. In the seventh O site, O(7) is bonded to one Li(2), one Li(9), one Fe(1), one Sb(1), and one Sb(3) atom to form distorted OLi2FeSb2 trigonal bipyramids that share  a cornercorner with one O(14)Li2FeSb tetrahedra,  a cornercorner with one O(15)Li2Sb2 tetrahedra,  a cornercorner with one O(2)LiFeSb2 trigonal pyramid,  a cornercorner with one O(5)LiFeSb2 trigonal pyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid,  an edgeedge with one O(12)LiFe2Sb trigonal pyramid,  an edgeedge with one O(1)LiFeSb2 trigonal pyramid, and  an edgeedge with one O(6)LiFeSb2 trigonal pyramid. In the eighth O site, O(8) is bonded to one Li(1), one Li(10), one Fe(2), one Sb(2), and one Sb(4) atom to form distorted OLi2FeSb2 trigonal bipyramids that share  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(9)Li2Fe2Sb trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid,  a cornercorner with one O(1)LiFeSb2 trigonal pyramid,  a cornercorner with one O(5)LiFeSb2 trigonal pyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid,  an edgeedge with one O(4)LiFeSb2 tetrahedra,  an edgeedge with one O(9)Li2Fe2Sb trigonal bipyramid,  an edgeedge with one O(2)LiFeSb2 trigonal pyramid, and  an edgeedge with one O(5)LiFeSb2 trigonal pyramid. In the ninth O site, O(9) is bonded to one Li(1), one Li(4), one Fe(2), one Fe(3), and one Sb(4) atom to form distorted OLi2Fe2Sb trigonal bipyramids that share  a cornercorner with one O(20)Li2FeSb tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(2)LiFeSb2 trigonal pyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid,  an edgeedge with one O(14)Li2FeSb tetrahedra,  an edgeedge with one O(8)Li2FeSb2 trigonal bipyramid,  an edgeedge with one O(12)LiFe2Sb trigonal pyramid, and  an edgeedge with one O(5)LiFeSb2 trigonal pyramid. In the tenth O site, O(10) is bonded in a 5-coordinate geometry to one Li(2), one Li(3), one Fe(1), one Sb(3), and one Sb(5) atom. In the eleventh O site, O(11) is bonded in a 5-coordinate geometry to one Li(1), one Li(3), one Fe(1), one Sb(4), and one Sb(5) atom. In the twelfth O site, O(12) is bonded to one Li(2), one Fe(2), one Fe(3), and one Sb(3) atom to form distorted OLiFe2Sb trigonal pyramids that share  a cornercorner with one O(20)Li2FeSb tetrahedra,  a cornercorner with one O(15)Li2Sb2 tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra, corners with two equivalent O(14)Li2FeSb tetrahedra,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(2)LiFeSb2 trigonal pyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid,  an edgeedge with one O(9)Li2Fe2Sb trigonal bipyramid,  an edgeedge with one O(7)Li2FeSb2 trigonal bipyramid, and  an edgeedge with one O(6)LiFeSb2 trigonal pyramid. In the thirteenth O site, O(13) is bonded in a 4-coordinate geometry to one Li(3), one Li(5), one Sb(4), and one Sb(5) atom. In the fourteenth O site, O(14) is bonded to one Li(4), one Li(6), one Fe(3), and one Sb(3) atom to form distorted OLi2FeSb tetrahedra that share  a cornercorner with one O(15)Li2Sb2 tetrahedra,  a cornercorner with one O(17)Li2Sb2 tetrahedra, corners with two equivalent O(20)Li2FeSb tetrahedra,  a cornercorner with one O(7)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid, corners with two equivalent O(12)LiFe2Sb trigonal pyramids, and  an edgeedge with one O(9)Li2Fe2Sb trigonal bipyramid. In the fifteenth O site, O(15) is bonded to one Li(3), one Li(8), one Sb(3), and one Sb(5) atom to form distorted OLi2Sb2 tetrahedra that share  a cornercorner with one O(14)Li2FeSb tetrahedra,  a cornercorner with one O(20)Li2FeSb tetrahedra, corners with two equivalent O(17)Li2Sb2 tetrahedra,  a cornercorner with one O(7)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid, and  a cornercorner with one O(6)LiFeSb2 trigonal pyramid. In the sixteenth O site, O(16) is bonded in a 4-coordinate geometry to one Li(4), one Li(7), one Fe(3), and one Sb(4) atom. In the seventeenth O site, O(17) is bonded to one Li(6), one Li(8), one Sb(5), and one Sb(7) atom to form distorted OLi2Sb2 tetrahedra that share  a cornercorner with one O(14)Li2FeSb tetrahedra, corners with two equivalent O(20)Li2FeSb tetrahedra, corners with two equivalent O(15)Li2Sb2 tetrahedra, and  a cornercorner with one O(1)LiFeSb2 trigonal pyramid. In the eighteenth O site, O(18) is bonded in a 5-coordinate geometry to one Li(4), one Li(5), one Li(7), one Fe(3), and one Sb(6) atom. In the nineteenth O site, O(19) is bonded in a 4-coordinate geometry to one Li(5), one Li(7), one Sb(5), and one Sb(7) atom. In the twentieth O site, O(20) is bonded to one Li(6), one Li(8), one Fe(3), and one Sb(6) atom to form distorted OLi2FeSb tetrahedra that share  a cornercorner with one O(15)Li2Sb2 tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra, corners with two equivalent O(14)Li2FeSb tetrahedra, corners with two equivalent O(17)Li2Sb2 tetrahedra,  a cornercorner with one O(9)Li2Fe2Sb trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid, and  a cornercorner with one O(2)LiFeSb2 trigonal pyramid. In the twenty-first O site, O(21) is bonded in a distorted rectangular see-saw-like geometry to one Li(8), one Li(9), one Sb(1), and one Sb(7) atom. In the twenty-second O site, O(22) is bonded in a 5-coordinate geometry to one Li(10), one Li(5), one Li(7), one Sb(2), and one Sb(6) atom. In the twenty-third O site, O(23) is bonded in a distorted trigonal planar geometry to one Li(5), one Sb(2), and one Sb(7) atom. In the twenty-fourth O site, O(24) is bonded in a distorted trigonal non-coplanar geometry to one Li(6), one Sb(1), and one Sb(6) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li10Fe3Sb7O24
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.260
_cell_length_b   9.594
_cell_length_c   10.216
_cell_angle_alpha   90.553
_cell_angle_beta   90.458
_cell_angle_gamma   90.701
_symmetry_Int_Tables_number   1
_cell_volume   515.476
_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  0.441  0.688  0.073  1.0
  Li  Li1  1  0.048  0.689  0.599  1.0
  Li  Li2  1  0.972  0.532  0.386  1.0
  Li  Li3  1  0.450  0.448  0.912  1.0
  Li  Li4  1  0.005  0.248  0.161  1.0
  Li  Li5  1  0.504  0.252  0.680  1.0
  Li  Li6  1  0.558  0.235  0.041  1.0
  Li  Li7  1  0.965  0.237  0.557  1.0
  Li  Li8  1  0.924  0.911  0.439  1.0
  Li  Li9  1  0.575  0.933  0.933  1.0
  Fe  Fe10  1  0.459  0.742  0.347  1.0
  Fe  Fe11  1  0.025  0.750  0.855  1.0
  Fe  Fe12  1  0.006  0.418  0.840  1.0
  Sb  Sb13  1  0.529  0.920  0.636  1.0
  Sb  Sb14  1  0.987  0.928  0.131  1.0
  Sb  Sb15  1  0.546  0.578  0.627  1.0
  Sb  Sb16  1  0.940  0.574  0.112  1.0
  Sb  Sb17  1  0.477  0.394  0.345  1.0
  Sb  Sb18  1  0.046  0.100  0.854  1.0
  Sb  Sb19  1  0.466  0.075  0.365  1.0
  O  O20  1  0.652  0.911  0.295  1.0
  O  O21  1  0.802  0.927  0.774  1.0
  O  O22  1  0.285  0.916  0.472  1.0
  O  O23  1  0.208  0.931  0.949  1.0
  O  O24  1  0.192  0.733  0.209  1.0
  O  O25  1  0.345  0.753  0.711  1.0
  O  O26  1  0.715  0.760  0.533  1.0
  O  O27  1  0.775  0.741  0.017  1.0
  O  O28  1  0.198  0.585  0.969  1.0
  O  O29  1  0.293  0.604  0.475  1.0
  O  O30  1  0.689  0.613  0.259  1.0
  O  O31  1  0.850  0.595  0.740  1.0
  O  O32  1  0.086  0.435  0.228  1.0
  O  O33  1  0.359  0.439  0.724  1.0
  O  O34  1  0.728  0.442  0.508  1.0
  O  O35  1  0.752  0.428  0.009  1.0
  O  O36  1  0.304  0.236  0.461  1.0
  O  O37  1  0.241  0.251  0.941  1.0
  O  O38  1  0.682  0.218  0.279  1.0
  O  O39  1  0.869  0.236  0.744  1.0
  O  O40  1  0.715  0.059  0.523  1.0
  O  O41  1  0.799  0.086  0.004  1.0
  O  O42  1  0.214  0.083  0.223  1.0
  O  O43  1  0.323  0.068  0.717  1.0
[/CIF]
.
The material structure described by Li10Fe3Sb7O24 crystallizes in the triclinic P1 space group. There are ten inequivalent Li sites. In the first Li site, Li(1) is bonded in a 4-coordinate geometry to one O(11), one O(5), one O(8), and one O(9) atom. In the second Li site, Li(2) is bonded in a distorted see-saw-like geometry to one O(10), one O(12), one O(6), and one O(7) atom. In the third Li site, Li(3) is bonded in a distorted see-saw-like geometry to one O(10), one O(11), one O(13), and one O(15) atom. In the fourth Li site, Li(4) is bonded in a 4-coordinate geometry to one O(14), one O(16), one O(18), and one O(9) atom. In the fifth Li site, Li(5) is bonded in a 3-coordinate geometry to one O(13), one O(18), one O(19), one O(22), and one O(23) atom. In the sixth Li site, Li(6) is bonded in a 4-coordinate geometry to one O(14), one O(17), one O(20), and one O(24) atom. In the seventh Li site, Li(7) is bonded in a 4-coordinate geometry to one O(16), one O(18), one O(19), and one O(22) atom. In the eighth Li site, Li(8) is bonded to one O(15), one O(17), one O(20), and one O(21) atom to form distorted LiO4 tetrahedra that share  a cornercorner with one Sb(1)O6 octahedra,  a cornercorner with one Sb(3)O6 octahedra,  a cornercorner with one Sb(6)O6 octahedra, and corners with two equivalent Sb(7)O6 octahedra. The corner-sharing octahedral tilt angles range from 44-65°. In the ninth Li site, Li(9) is bonded in a rectangular see-saw-like geometry to one O(1), one O(21), one O(3), and one O(7) atom. In the tenth Li site, Li(10) is bonded in a rectangular see-saw-like geometry to one O(2), one O(22), one O(4), and one O(8) atom. There are three inequivalent Fe sites. In the first Fe site, Fe(1) is bonded to one O(1), one O(10), one O(11), one O(3), one O(5), and one O(7) atom to form distorted FeO6 octahedra that share corners with two equivalent Sb(2)O6 octahedra, corners with two equivalent Sb(4)O6 octahedra,  an edgeedge with one Sb(1)O6 octahedra,  an edgeedge with one Sb(3)O6 octahedra, and  an edgeedge with one Sb(7)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-57°. In the second Fe site, Fe(2) is bonded to one O(12), one O(2), one O(4), one O(6), one O(8), and one O(9) atom to form FeO6 octahedra that share corners with two equivalent Sb(1)O6 octahedra, corners with two equivalent Sb(3)O6 octahedra,  an edgeedge with one Sb(2)O6 octahedra,  an edgeedge with one Sb(4)O6 octahedra, and  an edgeedge with one Sb(6)O6 octahedra. The corner-sharing octahedral tilt angles range from 44-52°. In the third Fe site, Fe(3) is bonded in a 6-coordinate geometry to one O(12), one O(14), one O(16), one O(18), one O(20), and one O(9) atom. There are seven inequivalent Sb sites. In the first Sb site, Sb(1) is bonded to one O(2), one O(21), one O(24), one O(3), one O(6), and one O(7) atom to form SbO6 octahedra that share corners with two equivalent Fe(2)O6 octahedra, corners with two equivalent Sb(6)O6 octahedra,  a cornercorner with one Li(8)O4 tetrahedra,  an edgeedge with one Fe(1)O6 octahedra,  an edgeedge with one Sb(3)O6 octahedra, and  an edgeedge with one Sb(7)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-52°. In the second Sb site, Sb(2) is bonded to one O(1), one O(22), one O(23), one O(4), one O(5), and one O(8) atom to form distorted SbO6 octahedra that share corners with two equivalent Fe(1)O6 octahedra, corners with two equivalent Sb(7)O6 octahedra,  an edgeedge with one Fe(2)O6 octahedra,  an edgeedge with one Sb(4)O6 octahedra, and  an edgeedge with one Sb(6)O6 octahedra. The corner-sharing octahedral tilt angles range from 48-57°. In the third Sb site, Sb(3) is bonded to one O(10), one O(12), one O(14), one O(15), one O(6), and one O(7) atom to form SbO6 octahedra that share corners with two equivalent Fe(2)O6 octahedra,  a cornercorner with one Li(8)O4 tetrahedra,  an edgeedge with one Fe(1)O6 octahedra, and  an edgeedge with one Sb(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 44-51°. In the fourth Sb site, Sb(4) is bonded to one O(11), one O(13), one O(16), one O(5), one O(8), and one O(9) atom to form SbO6 octahedra that share corners with two equivalent Fe(1)O6 octahedra,  an edgeedge with one Fe(2)O6 octahedra, and  an edgeedge with one Sb(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-42°. In the fifth Sb site, Sb(5) is bonded in a 6-coordinate geometry to one O(10), one O(11), one O(13), one O(15), one O(17), and one O(19) atom. In the sixth Sb site, Sb(6) is bonded to one O(18), one O(2), one O(20), one O(22), one O(24), and one O(4) atom to form SbO6 octahedra that share corners with two equivalent Sb(1)O6 octahedra,  a cornercorner with one Li(8)O4 tetrahedra,  an edgeedge with one Fe(2)O6 octahedra, and  an edgeedge with one Sb(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-47°. In the seventh Sb site, Sb(7) is bonded to one O(1), one O(17), one O(19), one O(21), one O(23), and one O(3) atom to form SbO6 octahedra that share corners with two equivalent Sb(2)O6 octahedra, corners with two equivalent Li(8)O4 tetrahedra,  an edgeedge with one Fe(1)O6 octahedra, and  an edgeedge with one Sb(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 48-56°. There are twenty-four inequivalent O sites. In the first O site, O(1) is bonded to one Li(9), one Fe(1), one Sb(2), and one Sb(7) atom to form distorted OLiFeSb2 trigonal pyramids that share  a cornercorner with one O(17)Li2Sb2 tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid, corners with two equivalent O(5)LiFeSb2 trigonal pyramids, and  an edgeedge with one O(7)Li2FeSb2 trigonal bipyramid. In the second O site, O(2) is bonded to one Li(10), one Fe(2), one Sb(1), and one Sb(6) atom to form OLiFeSb2 trigonal pyramids that share  a cornercorner with one O(20)Li2FeSb tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(9)Li2Fe2Sb trigonal bipyramid,  a cornercorner with one O(7)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid, corners with two equivalent O(6)LiFeSb2 trigonal pyramids,  an edgeedge with one O(4)LiFeSb2 tetrahedra, and  an edgeedge with one O(8)Li2FeSb2 trigonal bipyramid. In the third O site, O(3) is bonded in a distorted rectangular see-saw-like geometry to one Li(9), one Fe(1), one Sb(1), and one Sb(7) atom. In the fourth O site, O(4) is bonded to one Li(10), one Fe(2), one Sb(2), and one Sb(6) atom to form distorted OLiFeSb2 tetrahedra that share  a cornercorner with one O(20)Li2FeSb tetrahedra,  a cornercorner with one O(9)Li2Fe2Sb trigonal bipyramid,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid,  a cornercorner with one O(1)LiFeSb2 trigonal pyramid,  a cornercorner with one O(2)LiFeSb2 trigonal pyramid,  a cornercorner with one O(5)LiFeSb2 trigonal pyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid,  an edgeedge with one O(8)Li2FeSb2 trigonal bipyramid, and  an edgeedge with one O(2)LiFeSb2 trigonal pyramid. In the fifth O site, O(5) is bonded to one Li(1), one Fe(1), one Sb(2), and one Sb(4) atom to form distorted OLiFeSb2 trigonal pyramids that share  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(7)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid, corners with two equivalent O(1)LiFeSb2 trigonal pyramids,  an edgeedge with one O(9)Li2Fe2Sb trigonal bipyramid, and  an edgeedge with one O(8)Li2FeSb2 trigonal bipyramid. In the sixth O site, O(6) is bonded to one Li(2), one Fe(2), one Sb(1), and one Sb(3) atom to form distorted OLiFeSb2 trigonal pyramids that share  a cornercorner with one O(14)Li2FeSb tetrahedra,  a cornercorner with one O(15)Li2Sb2 tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(9)Li2Fe2Sb trigonal bipyramid,  a cornercorner with one O(7)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid, corners with two equivalent O(2)LiFeSb2 trigonal pyramids,  an edgeedge with one O(7)Li2FeSb2 trigonal bipyramid, and  an edgeedge with one O(12)LiFe2Sb trigonal pyramid. In the seventh O site, O(7) is bonded to one Li(2), one Li(9), one Fe(1), one Sb(1), and one Sb(3) atom to form distorted OLi2FeSb2 trigonal bipyramids that share  a cornercorner with one O(14)Li2FeSb tetrahedra,  a cornercorner with one O(15)Li2Sb2 tetrahedra,  a cornercorner with one O(2)LiFeSb2 trigonal pyramid,  a cornercorner with one O(5)LiFeSb2 trigonal pyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid,  an edgeedge with one O(12)LiFe2Sb trigonal pyramid,  an edgeedge with one O(1)LiFeSb2 trigonal pyramid, and  an edgeedge with one O(6)LiFeSb2 trigonal pyramid. In the eighth O site, O(8) is bonded to one Li(1), one Li(10), one Fe(2), one Sb(2), and one Sb(4) atom to form distorted OLi2FeSb2 trigonal bipyramids that share  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(9)Li2Fe2Sb trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid,  a cornercorner with one O(1)LiFeSb2 trigonal pyramid,  a cornercorner with one O(5)LiFeSb2 trigonal pyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid,  an edgeedge with one O(4)LiFeSb2 tetrahedra,  an edgeedge with one O(9)Li2Fe2Sb trigonal bipyramid,  an edgeedge with one O(2)LiFeSb2 trigonal pyramid, and  an edgeedge with one O(5)LiFeSb2 trigonal pyramid. In the ninth O site, O(9) is bonded to one Li(1), one Li(4), one Fe(2), one Fe(3), and one Sb(4) atom to form distorted OLi2Fe2Sb trigonal bipyramids that share  a cornercorner with one O(20)Li2FeSb tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(2)LiFeSb2 trigonal pyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid,  an edgeedge with one O(14)Li2FeSb tetrahedra,  an edgeedge with one O(8)Li2FeSb2 trigonal bipyramid,  an edgeedge with one O(12)LiFe2Sb trigonal pyramid, and  an edgeedge with one O(5)LiFeSb2 trigonal pyramid. In the tenth O site, O(10) is bonded in a 5-coordinate geometry to one Li(2), one Li(3), one Fe(1), one Sb(3), and one Sb(5) atom. In the eleventh O site, O(11) is bonded in a 5-coordinate geometry to one Li(1), one Li(3), one Fe(1), one Sb(4), and one Sb(5) atom. In the twelfth O site, O(12) is bonded to one Li(2), one Fe(2), one Fe(3), and one Sb(3) atom to form distorted OLiFe2Sb trigonal pyramids that share  a cornercorner with one O(20)Li2FeSb tetrahedra,  a cornercorner with one O(15)Li2Sb2 tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra, corners with two equivalent O(14)Li2FeSb tetrahedra,  a cornercorner with one O(8)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(2)LiFeSb2 trigonal pyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid,  an edgeedge with one O(9)Li2Fe2Sb trigonal bipyramid,  an edgeedge with one O(7)Li2FeSb2 trigonal bipyramid, and  an edgeedge with one O(6)LiFeSb2 trigonal pyramid. In the thirteenth O site, O(13) is bonded in a 4-coordinate geometry to one Li(3), one Li(5), one Sb(4), and one Sb(5) atom. In the fourteenth O site, O(14) is bonded to one Li(4), one Li(6), one Fe(3), and one Sb(3) atom to form distorted OLi2FeSb tetrahedra that share  a cornercorner with one O(15)Li2Sb2 tetrahedra,  a cornercorner with one O(17)Li2Sb2 tetrahedra, corners with two equivalent O(20)Li2FeSb tetrahedra,  a cornercorner with one O(7)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(6)LiFeSb2 trigonal pyramid, corners with two equivalent O(12)LiFe2Sb trigonal pyramids, and  an edgeedge with one O(9)Li2Fe2Sb trigonal bipyramid. In the fifteenth O site, O(15) is bonded to one Li(3), one Li(8), one Sb(3), and one Sb(5) atom to form distorted OLi2Sb2 tetrahedra that share  a cornercorner with one O(14)Li2FeSb tetrahedra,  a cornercorner with one O(20)Li2FeSb tetrahedra, corners with two equivalent O(17)Li2Sb2 tetrahedra,  a cornercorner with one O(7)Li2FeSb2 trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid, and  a cornercorner with one O(6)LiFeSb2 trigonal pyramid. In the sixteenth O site, O(16) is bonded in a 4-coordinate geometry to one Li(4), one Li(7), one Fe(3), and one Sb(4) atom. In the seventeenth O site, O(17) is bonded to one Li(6), one Li(8), one Sb(5), and one Sb(7) atom to form distorted OLi2Sb2 tetrahedra that share  a cornercorner with one O(14)Li2FeSb tetrahedra, corners with two equivalent O(20)Li2FeSb tetrahedra, corners with two equivalent O(15)Li2Sb2 tetrahedra, and  a cornercorner with one O(1)LiFeSb2 trigonal pyramid. In the eighteenth O site, O(18) is bonded in a 5-coordinate geometry to one Li(4), one Li(5), one Li(7), one Fe(3), and one Sb(6) atom. In the nineteenth O site, O(19) is bonded in a 4-coordinate geometry to one Li(5), one Li(7), one Sb(5), and one Sb(7) atom. In the twentieth O site, O(20) is bonded to one Li(6), one Li(8), one Fe(3), and one Sb(6) atom to form distorted OLi2FeSb tetrahedra that share  a cornercorner with one O(15)Li2Sb2 tetrahedra,  a cornercorner with one O(4)LiFeSb2 tetrahedra, corners with two equivalent O(14)Li2FeSb tetrahedra, corners with two equivalent O(17)Li2Sb2 tetrahedra,  a cornercorner with one O(9)Li2Fe2Sb trigonal bipyramid,  a cornercorner with one O(12)LiFe2Sb trigonal pyramid, and  a cornercorner with one O(2)LiFeSb2 trigonal pyramid. In the twenty-first O site, O(21) is bonded in a distorted rectangular see-saw-like geometry to one Li(8), one Li(9), one Sb(1), and one Sb(7) atom. In the twenty-second O site, O(22) is bonded in a 5-coordinate geometry to one Li(10), one Li(5), one Li(7), one Sb(2), and one Sb(6) atom. In the twenty-third O site, O(23) is bonded in a distorted trigonal planar geometry to one Li(5), one Sb(2), and one Sb(7) atom. In the twenty-fourth O site, O(24) is bonded in a distorted trigonal non-coplanar geometry to one Li(6), one Sb(1), and one Sb(6) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li10Fe3Sb7O24
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.260
_cell_length_b   9.594
_cell_length_c   10.216
_cell_angle_alpha   90.553
_cell_angle_beta   90.458
_cell_angle_gamma   90.701
_symmetry_Int_Tables_number   1
_cell_volume   515.476
_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  0.441  0.688  0.073  1.0
  Li  Li1  1  0.048  0.689  0.599  1.0
  Li  Li2  1  0.972  0.532  0.386  1.0
  Li  Li3  1  0.450  0.448  0.912  1.0
  Li  Li4  1  0.005  0.248  0.161  1.0
  Li  Li5  1  0.504  0.252  0.680  1.0
  Li  Li6  1  0.558  0.235  0.041  1.0
  Li  Li7  1  0.965  0.237  0.557  1.0
  Li  Li8  1  0.924  0.911  0.439  1.0
  Li  Li9  1  0.575  0.933  0.933  1.0
  Fe  Fe10  1  0.459  0.742  0.347  1.0
  Fe  Fe11  1  0.025  0.750  0.855  1.0
  Fe  Fe12  1  0.006  0.418  0.840  1.0
  Sb  Sb13  1  0.529  0.920  0.636  1.0
  Sb  Sb14  1  0.987  0.928  0.131  1.0
  Sb  Sb15  1  0.546  0.578  0.627  1.0
  Sb  Sb16  1  0.940  0.574  0.112  1.0
  Sb  Sb17  1  0.477  0.394  0.345  1.0
  Sb  Sb18  1  0.046  0.100  0.854  1.0
  Sb  Sb19  1  0.466  0.075  0.365  1.0
  O  O20  1  0.652  0.911  0.295  1.0
  O  O21  1  0.802  0.927  0.774  1.0
  O  O22  1  0.285  0.916  0.472  1.0
  O  O23  1  0.208  0.931  0.949  1.0
  O  O24  1  0.192  0.733  0.209  1.0
  O  O25  1  0.345  0.753  0.711  1.0
  O  O26  1  0.715  0.760  0.533  1.0
  O  O27  1  0.775  0.741  0.017  1.0
  O  O28  1  0.198  0.585  0.969  1.0
  O  O29  1  0.293  0.604  0.475  1.0
  O  O30  1  0.689  0.613  0.259  1.0
  O  O31  1  0.850  0.595  0.740  1.0
  O  O32  1  0.086  0.435  0.228  1.0
  O  O33  1  0.359  0.439  0.724  1.0
  O  O34  1  0.728  0.442  0.508  1.0
  O  O35  1  0.752  0.428  0.009  1.0
  O  O36  1  0.304  0.236  0.461  1.0
  O  O37  1  0.241  0.251  0.941  1.0
  O  O38  1  0.682  0.218  0.279  1.0
  O  O39  1  0.869  0.236  0.744  1.0
  O  O40  1  0.715  0.059  0.523  1.0
  O  O41  1  0.799  0.086  0.004  1.0
  O  O42  1  0.214  0.083  0.223  1.0
  O  O43  1  0.323  0.068  0.717  1.0
[/CIF]
.