The structure described by LiMn2OF3 is Spinel-derived structured and crystallizes in the triclinic P1 space group. There are four inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one F(1), one F(11), one F(5), one F(7), and one F(9) atom to form LiOF5 octahedra that share  a cornercorner with one Mn(2)OF3 tetrahedra,  a cornercorner with one Mn(8)OF3 tetrahedra, corners with two equivalent Mn(3)OF3 tetrahedra, corners with two equivalent Mn(4)OF3 tetrahedra,  an edgeedge with one Li(2)OF5 octahedra,  an edgeedge with one Li(3)OF5 octahedra,  an edgeedge with one Mn(5)O2F4 octahedra,  an edgeedge with one Mn(6)O2F4 octahedra, and edges with two equivalent Mn(7)O2F4 octahedra. In the second Li site, Li(2) is bonded to one O(2), one F(11), one F(12), one F(3), one F(5), and one F(6) atom to form LiOF5 octahedra that share  a cornercorner with one Mn(3)OF3 tetrahedra,  a cornercorner with one Mn(8)OF3 tetrahedra, corners with two equivalent Mn(2)OF3 tetrahedra, corners with two equivalent Mn(4)OF3 tetrahedra,  an edgeedge with one Li(1)OF5 octahedra,  an edgeedge with one Li(4)OF5 octahedra,  an edgeedge with one Mn(1)O2F4 octahedra,  an edgeedge with one Mn(7)O2F4 octahedra, and edges with two equivalent Mn(5)O2F4 octahedra. In the third Li site, Li(3) is bonded to one O(3), one F(10), one F(2), one F(7), one F(8), and one F(9) atom to form LiOF5 octahedra that share  a cornercorner with one Mn(2)OF3 tetrahedra,  a cornercorner with one Mn(4)OF3 tetrahedra, corners with two equivalent Mn(3)OF3 tetrahedra, corners with two equivalent Mn(8)OF3 tetrahedra,  an edgeedge with one Li(1)OF5 octahedra,  an edgeedge with one Li(4)OF5 octahedra,  an edgeedge with one Mn(1)O2F4 octahedra,  an edgeedge with one Mn(7)O2F4 octahedra, and edges with two equivalent Mn(6)O2F4 octahedra. In the fourth Li site, Li(4) is bonded to one O(4), one F(10), one F(12), one F(4), one F(6), and one F(8) atom to form LiOF5 octahedra that share  a cornercorner with one Mn(3)OF3 tetrahedra,  a cornercorner with one Mn(4)OF3 tetrahedra, corners with two equivalent Mn(2)OF3 tetrahedra, corners with two equivalent Mn(8)OF3 tetrahedra,  an edgeedge with one Li(2)OF5 octahedra,  an edgeedge with one Li(3)OF5 octahedra,  an edgeedge with one Mn(5)O2F4 octahedra,  an edgeedge with one Mn(6)O2F4 octahedra, and edges with two equivalent Mn(1)O2F4 octahedra. There are eight inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(3), one O(4), one F(10), one F(3), one F(4), and one F(6) atom to form MnO2F4 octahedra that share  a cornercorner with one Mn(3)OF3 tetrahedra,  a cornercorner with one Mn(4)OF3 tetrahedra, corners with two equivalent Mn(2)OF3 tetrahedra, corners with two equivalent Mn(8)OF3 tetrahedra,  an edgeedge with one Li(2)OF5 octahedra,  an edgeedge with one Li(3)OF5 octahedra,  an edgeedge with one Mn(5)O2F4 octahedra,  an edgeedge with one Mn(6)O2F4 octahedra, and edges with two equivalent Li(4)OF5 octahedra. In the second Mn site, Mn(2) is bonded to one O(2), one F(10), one F(4), and one F(5) atom to form MnOF3 tetrahedra that share  a cornercorner with one Li(1)OF5 octahedra,  a cornercorner with one Li(3)OF5 octahedra,  a cornercorner with one Mn(6)O2F4 octahedra,  a cornercorner with one Mn(7)O2F4 octahedra, corners with two equivalent Li(2)OF5 octahedra, corners with two equivalent Li(4)OF5 octahedra, corners with two equivalent Mn(1)O2F4 octahedra, and corners with two equivalent Mn(5)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 52-64°. In the third Mn site, Mn(3) is bonded to one O(3), one F(1), one F(11), and one F(8) atom to form MnOF3 tetrahedra that share  a cornercorner with one Li(2)OF5 octahedra,  a cornercorner with one Li(4)OF5 octahedra,  a cornercorner with one Mn(1)O2F4 octahedra,  a cornercorner with one Mn(5)O2F4 octahedra, corners with two equivalent Li(1)OF5 octahedra, corners with two equivalent Li(3)OF5 octahedra, corners with two equivalent Mn(6)O2F4 octahedra, and corners with two equivalent Mn(7)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 52-64°. In the fourth Mn site, Mn(4) is bonded to one O(1), one F(12), one F(3), and one F(7) atom to form MnOF3 tetrahedra that share  a cornercorner with one Li(3)OF5 octahedra,  a cornercorner with one Li(4)OF5 octahedra,  a cornercorner with one Mn(1)O2F4 octahedra,  a cornercorner with one Mn(6)O2F4 octahedra, corners with two equivalent Li(1)OF5 octahedra, corners with two equivalent Li(2)OF5 octahedra, corners with two equivalent Mn(5)O2F4 octahedra, and corners with two equivalent Mn(7)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 52-65°. In the fifth Mn site, Mn(5) is bonded to one O(2), one O(4), one F(1), one F(12), one F(3), and one F(5) atom to form MnO2F4 octahedra that share  a cornercorner with one Mn(3)OF3 tetrahedra,  a cornercorner with one Mn(8)OF3 tetrahedra, corners with two equivalent Mn(2)OF3 tetrahedra, corners with two equivalent Mn(4)OF3 tetrahedra,  an edgeedge with one Li(1)OF5 octahedra,  an edgeedge with one Li(4)OF5 octahedra,  an edgeedge with one Mn(1)O2F4 octahedra,  an edgeedge with one Mn(7)O2F4 octahedra, and edges with two equivalent Li(2)OF5 octahedra. In the sixth Mn site, Mn(6) is bonded to one O(1), one O(3), one F(2), one F(4), one F(8), and one F(9) atom to form MnO2F4 octahedra that share  a cornercorner with one Mn(2)OF3 tetrahedra,  a cornercorner with one Mn(4)OF3 tetrahedra, corners with two equivalent Mn(3)OF3 tetrahedra, corners with two equivalent Mn(8)OF3 tetrahedra,  an edgeedge with one Li(1)OF5 octahedra,  an edgeedge with one Li(4)OF5 octahedra,  an edgeedge with one Mn(1)O2F4 octahedra,  an edgeedge with one Mn(7)O2F4 octahedra, and edges with two equivalent Li(3)OF5 octahedra. In the seventh Mn site, Mn(7) is bonded to one O(1), one O(2), one F(1), one F(11), one F(2), and one F(7) atom to form MnO2F4 octahedra that share  a cornercorner with one Mn(2)OF3 tetrahedra,  a cornercorner with one Mn(8)OF3 tetrahedra, corners with two equivalent Mn(3)OF3 tetrahedra, corners with two equivalent Mn(4)OF3 tetrahedra,  an edgeedge with one Li(2)OF5 octahedra,  an edgeedge with one Li(3)OF5 octahedra,  an edgeedge with one Mn(5)O2F4 octahedra,  an edgeedge with one Mn(6)O2F4 octahedra, and edges with two equivalent Li(1)OF5 octahedra. In the eighth Mn site, Mn(8) is bonded to one O(4), one F(2), one F(6), and one F(9) atom to form MnOF3 tetrahedra that share  a cornercorner with one Li(1)OF5 octahedra,  a cornercorner with one Li(2)OF5 octahedra,  a cornercorner with one Mn(5)O2F4 octahedra,  a cornercorner with one Mn(7)O2F4 octahedra, corners with two equivalent Li(3)OF5 octahedra, corners with two equivalent Li(4)OF5 octahedra, corners with two equivalent Mn(1)O2F4 octahedra, and corners with two equivalent Mn(6)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 52-64°. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Li(1), one Mn(4), one Mn(6), and one Mn(7) atom to form corner-sharing OLiMn3 tetrahedra. In the second O site, O(2) is bonded to one Li(2), one Mn(2), one Mn(5), and one Mn(7) atom to form corner-sharing OLiMn3 tetrahedra. In the third O site, O(3) is bonded to one Li(3), one Mn(1), one Mn(3), and one Mn(6) atom to form distorted corner-sharing OLiMn3 tetrahedra. In the fourth O site, O(4) is bonded to one Li(4), one Mn(1), one Mn(5), and one Mn(8) atom to form distorted corner-sharing OLiMn3 tetrahedra. There are twelve inequivalent F sites. In the first F site, F(1) is bonded in a rectangular see-saw-like geometry to one Li(1), one Mn(3), one Mn(5), and one Mn(7) atom. In the second F site, F(2) is bonded in a rectangular see-saw-like geometry to one Li(3), one Mn(6), one Mn(7), and one Mn(8) atom. In the third F site, F(3) is bonded in a rectangular see-saw-like geometry to one Li(2), one Mn(1), one Mn(4), and one Mn(5) atom. In the fourth F site, F(4) is bonded in a rectangular see-saw-like geometry to one Li(4), one Mn(1), one Mn(2), and one Mn(6) atom. In the fifth F site, F(5) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(2), one Mn(2), and one Mn(5) atom. In the sixth F site, F(6) is bonded in a rectangular see-saw-like geometry to one Li(2), one Li(4), one Mn(1), and one Mn(8) atom. In the seventh F site, F(7) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(3), one Mn(4), and one Mn(7) atom. In the eighth F site, F(8) is bonded in a rectangular see-saw-like geometry to one Li(3), one Li(4), one Mn(3), and one Mn(6) atom. In the ninth F site, F(9) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(3), one Mn(6), and one Mn(8) atom. In the tenth F site, F(10) is bonded in a rectangular see-saw-like geometry to one Li(3), one Li(4), one Mn(1), and one Mn(2) atom. In the eleventh F site, F(11) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(2), one Mn(3), and one Mn(7) atom. In the twelfth F site, F(12) is bonded in a rectangular see-saw-like geometry to one Li(2), one Li(4), one Mn(4), and one Mn(5) atom. is represented by the CIF card [CIF]
data_LiMn2OF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.276
_cell_length_b   6.278
_cell_length_c   8.982
_cell_angle_alpha   90.157
_cell_angle_beta   90.073
_cell_angle_gamma   90.011
_symmetry_Int_Tables_number   1
_cell_volume   353.916
_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  0.252  0.511  0.250  1.0
  Li  Li1  1  0.489  0.251  1.000  1.0
  Li  Li2  1  0.509  0.749  0.500  1.0
  Li  Li3  1  0.749  0.490  0.750  1.0
  Mn  Mn4  1  0.751  0.015  0.734  1.0
  Mn  Mn5  1  0.258  0.775  0.886  1.0
  Mn  Mn6  1  0.743  0.226  0.385  1.0
  Mn  Mn7  1  0.775  0.742  0.136  1.0
  Mn  Mn8  1  0.013  0.251  0.984  1.0
  Mn  Mn9  1  0.984  0.750  0.483  1.0
  Mn  Mn10  1  0.252  0.986  0.233  1.0
  Mn  Mn11  1  0.226  0.258  0.635  1.0
  O  O12  1  0.033  0.744  0.258  1.0
  O  O13  1  0.255  0.033  0.008  1.0
  O  O14  1  0.743  0.967  0.508  1.0
  O  O15  1  0.967  0.256  0.758  1.0
  F  F16  1  0.009  0.261  0.242  1.0
  F  F17  1  0.261  0.990  0.492  1.0
  F  F18  1  0.737  0.008  0.994  1.0
  F  F19  1  0.992  0.737  0.743  1.0
  F  F20  1  0.262  0.497  0.013  1.0
  F  F21  1  0.503  0.262  0.763  1.0
  F  F22  1  0.497  0.738  0.263  1.0
  F  F23  1  0.738  0.503  0.513  1.0
  F  F24  1  0.255  0.518  0.493  1.0
  F  F25  1  0.519  0.745  0.743  1.0
  F  F26  1  0.483  0.256  0.243  1.0
  F  F27  1  0.744  0.482  0.993  1.0
[/CIF]
.
The structure described by LiMn2OF3 is Spinel-derived structured and crystallizes in the triclinic P1 space group. There are four inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one F(1), one F(11), one F(5), one F(7), and one F(9) atom to form LiOF5 octahedra that share  a cornercorner with one Mn(2)OF3 tetrahedra,  a cornercorner with one Mn(8)OF3 tetrahedra, corners with two equivalent Mn(3)OF3 tetrahedra, corners with two equivalent Mn(4)OF3 tetrahedra,  an edgeedge with one Li(2)OF5 octahedra,  an edgeedge with one Li(3)OF5 octahedra,  an edgeedge with one Mn(5)O2F4 octahedra,  an edgeedge with one Mn(6)O2F4 octahedra, and edges with two equivalent Mn(7)O2F4 octahedra. In the second Li site, Li(2) is bonded to one O(2), one F(11), one F(12), one F(3), one F(5), and one F(6) atom to form LiOF5 octahedra that share  a cornercorner with one Mn(3)OF3 tetrahedra,  a cornercorner with one Mn(8)OF3 tetrahedra, corners with two equivalent Mn(2)OF3 tetrahedra, corners with two equivalent Mn(4)OF3 tetrahedra,  an edgeedge with one Li(1)OF5 octahedra,  an edgeedge with one Li(4)OF5 octahedra,  an edgeedge with one Mn(1)O2F4 octahedra,  an edgeedge with one Mn(7)O2F4 octahedra, and edges with two equivalent Mn(5)O2F4 octahedra. In the third Li site, Li(3) is bonded to one O(3), one F(10), one F(2), one F(7), one F(8), and one F(9) atom to form LiOF5 octahedra that share  a cornercorner with one Mn(2)OF3 tetrahedra,  a cornercorner with one Mn(4)OF3 tetrahedra, corners with two equivalent Mn(3)OF3 tetrahedra, corners with two equivalent Mn(8)OF3 tetrahedra,  an edgeedge with one Li(1)OF5 octahedra,  an edgeedge with one Li(4)OF5 octahedra,  an edgeedge with one Mn(1)O2F4 octahedra,  an edgeedge with one Mn(7)O2F4 octahedra, and edges with two equivalent Mn(6)O2F4 octahedra. In the fourth Li site, Li(4) is bonded to one O(4), one F(10), one F(12), one F(4), one F(6), and one F(8) atom to form LiOF5 octahedra that share  a cornercorner with one Mn(3)OF3 tetrahedra,  a cornercorner with one Mn(4)OF3 tetrahedra, corners with two equivalent Mn(2)OF3 tetrahedra, corners with two equivalent Mn(8)OF3 tetrahedra,  an edgeedge with one Li(2)OF5 octahedra,  an edgeedge with one Li(3)OF5 octahedra,  an edgeedge with one Mn(5)O2F4 octahedra,  an edgeedge with one Mn(6)O2F4 octahedra, and edges with two equivalent Mn(1)O2F4 octahedra. There are eight inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(3), one O(4), one F(10), one F(3), one F(4), and one F(6) atom to form MnO2F4 octahedra that share  a cornercorner with one Mn(3)OF3 tetrahedra,  a cornercorner with one Mn(4)OF3 tetrahedra, corners with two equivalent Mn(2)OF3 tetrahedra, corners with two equivalent Mn(8)OF3 tetrahedra,  an edgeedge with one Li(2)OF5 octahedra,  an edgeedge with one Li(3)OF5 octahedra,  an edgeedge with one Mn(5)O2F4 octahedra,  an edgeedge with one Mn(6)O2F4 octahedra, and edges with two equivalent Li(4)OF5 octahedra. In the second Mn site, Mn(2) is bonded to one O(2), one F(10), one F(4), and one F(5) atom to form MnOF3 tetrahedra that share  a cornercorner with one Li(1)OF5 octahedra,  a cornercorner with one Li(3)OF5 octahedra,  a cornercorner with one Mn(6)O2F4 octahedra,  a cornercorner with one Mn(7)O2F4 octahedra, corners with two equivalent Li(2)OF5 octahedra, corners with two equivalent Li(4)OF5 octahedra, corners with two equivalent Mn(1)O2F4 octahedra, and corners with two equivalent Mn(5)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 52-64°. In the third Mn site, Mn(3) is bonded to one O(3), one F(1), one F(11), and one F(8) atom to form MnOF3 tetrahedra that share  a cornercorner with one Li(2)OF5 octahedra,  a cornercorner with one Li(4)OF5 octahedra,  a cornercorner with one Mn(1)O2F4 octahedra,  a cornercorner with one Mn(5)O2F4 octahedra, corners with two equivalent Li(1)OF5 octahedra, corners with two equivalent Li(3)OF5 octahedra, corners with two equivalent Mn(6)O2F4 octahedra, and corners with two equivalent Mn(7)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 52-64°. In the fourth Mn site, Mn(4) is bonded to one O(1), one F(12), one F(3), and one F(7) atom to form MnOF3 tetrahedra that share  a cornercorner with one Li(3)OF5 octahedra,  a cornercorner with one Li(4)OF5 octahedra,  a cornercorner with one Mn(1)O2F4 octahedra,  a cornercorner with one Mn(6)O2F4 octahedra, corners with two equivalent Li(1)OF5 octahedra, corners with two equivalent Li(2)OF5 octahedra, corners with two equivalent Mn(5)O2F4 octahedra, and corners with two equivalent Mn(7)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 52-65°. In the fifth Mn site, Mn(5) is bonded to one O(2), one O(4), one F(1), one F(12), one F(3), and one F(5) atom to form MnO2F4 octahedra that share  a cornercorner with one Mn(3)OF3 tetrahedra,  a cornercorner with one Mn(8)OF3 tetrahedra, corners with two equivalent Mn(2)OF3 tetrahedra, corners with two equivalent Mn(4)OF3 tetrahedra,  an edgeedge with one Li(1)OF5 octahedra,  an edgeedge with one Li(4)OF5 octahedra,  an edgeedge with one Mn(1)O2F4 octahedra,  an edgeedge with one Mn(7)O2F4 octahedra, and edges with two equivalent Li(2)OF5 octahedra. In the sixth Mn site, Mn(6) is bonded to one O(1), one O(3), one F(2), one F(4), one F(8), and one F(9) atom to form MnO2F4 octahedra that share  a cornercorner with one Mn(2)OF3 tetrahedra,  a cornercorner with one Mn(4)OF3 tetrahedra, corners with two equivalent Mn(3)OF3 tetrahedra, corners with two equivalent Mn(8)OF3 tetrahedra,  an edgeedge with one Li(1)OF5 octahedra,  an edgeedge with one Li(4)OF5 octahedra,  an edgeedge with one Mn(1)O2F4 octahedra,  an edgeedge with one Mn(7)O2F4 octahedra, and edges with two equivalent Li(3)OF5 octahedra. In the seventh Mn site, Mn(7) is bonded to one O(1), one O(2), one F(1), one F(11), one F(2), and one F(7) atom to form MnO2F4 octahedra that share  a cornercorner with one Mn(2)OF3 tetrahedra,  a cornercorner with one Mn(8)OF3 tetrahedra, corners with two equivalent Mn(3)OF3 tetrahedra, corners with two equivalent Mn(4)OF3 tetrahedra,  an edgeedge with one Li(2)OF5 octahedra,  an edgeedge with one Li(3)OF5 octahedra,  an edgeedge with one Mn(5)O2F4 octahedra,  an edgeedge with one Mn(6)O2F4 octahedra, and edges with two equivalent Li(1)OF5 octahedra. In the eighth Mn site, Mn(8) is bonded to one O(4), one F(2), one F(6), and one F(9) atom to form MnOF3 tetrahedra that share  a cornercorner with one Li(1)OF5 octahedra,  a cornercorner with one Li(2)OF5 octahedra,  a cornercorner with one Mn(5)O2F4 octahedra,  a cornercorner with one Mn(7)O2F4 octahedra, corners with two equivalent Li(3)OF5 octahedra, corners with two equivalent Li(4)OF5 octahedra, corners with two equivalent Mn(1)O2F4 octahedra, and corners with two equivalent Mn(6)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 52-64°. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Li(1), one Mn(4), one Mn(6), and one Mn(7) atom to form corner-sharing OLiMn3 tetrahedra. In the second O site, O(2) is bonded to one Li(2), one Mn(2), one Mn(5), and one Mn(7) atom to form corner-sharing OLiMn3 tetrahedra. In the third O site, O(3) is bonded to one Li(3), one Mn(1), one Mn(3), and one Mn(6) atom to form distorted corner-sharing OLiMn3 tetrahedra. In the fourth O site, O(4) is bonded to one Li(4), one Mn(1), one Mn(5), and one Mn(8) atom to form distorted corner-sharing OLiMn3 tetrahedra. There are twelve inequivalent F sites. In the first F site, F(1) is bonded in a rectangular see-saw-like geometry to one Li(1), one Mn(3), one Mn(5), and one Mn(7) atom. In the second F site, F(2) is bonded in a rectangular see-saw-like geometry to one Li(3), one Mn(6), one Mn(7), and one Mn(8) atom. In the third F site, F(3) is bonded in a rectangular see-saw-like geometry to one Li(2), one Mn(1), one Mn(4), and one Mn(5) atom. In the fourth F site, F(4) is bonded in a rectangular see-saw-like geometry to one Li(4), one Mn(1), one Mn(2), and one Mn(6) atom. In the fifth F site, F(5) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(2), one Mn(2), and one Mn(5) atom. In the sixth F site, F(6) is bonded in a rectangular see-saw-like geometry to one Li(2), one Li(4), one Mn(1), and one Mn(8) atom. In the seventh F site, F(7) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(3), one Mn(4), and one Mn(7) atom. In the eighth F site, F(8) is bonded in a rectangular see-saw-like geometry to one Li(3), one Li(4), one Mn(3), and one Mn(6) atom. In the ninth F site, F(9) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(3), one Mn(6), and one Mn(8) atom. In the tenth F site, F(10) is bonded in a rectangular see-saw-like geometry to one Li(3), one Li(4), one Mn(1), and one Mn(2) atom. In the eleventh F site, F(11) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(2), one Mn(3), and one Mn(7) atom. In the twelfth F site, F(12) is bonded in a rectangular see-saw-like geometry to one Li(2), one Li(4), one Mn(4), and one Mn(5) atom. is represented by the CIF card [CIF]
data_LiMn2OF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.276
_cell_length_b   6.278
_cell_length_c   8.982
_cell_angle_alpha   90.157
_cell_angle_beta   90.073
_cell_angle_gamma   90.011
_symmetry_Int_Tables_number   1
_cell_volume   353.916
_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  0.252  0.511  0.250  1.0
  Li  Li1  1  0.489  0.251  1.000  1.0
  Li  Li2  1  0.509  0.749  0.500  1.0
  Li  Li3  1  0.749  0.490  0.750  1.0
  Mn  Mn4  1  0.751  0.015  0.734  1.0
  Mn  Mn5  1  0.258  0.775  0.886  1.0
  Mn  Mn6  1  0.743  0.226  0.385  1.0
  Mn  Mn7  1  0.775  0.742  0.136  1.0
  Mn  Mn8  1  0.013  0.251  0.984  1.0
  Mn  Mn9  1  0.984  0.750  0.483  1.0
  Mn  Mn10  1  0.252  0.986  0.233  1.0
  Mn  Mn11  1  0.226  0.258  0.635  1.0
  O  O12  1  0.033  0.744  0.258  1.0
  O  O13  1  0.255  0.033  0.008  1.0
  O  O14  1  0.743  0.967  0.508  1.0
  O  O15  1  0.967  0.256  0.758  1.0
  F  F16  1  0.009  0.261  0.242  1.0
  F  F17  1  0.261  0.990  0.492  1.0
  F  F18  1  0.737  0.008  0.994  1.0
  F  F19  1  0.992  0.737  0.743  1.0
  F  F20  1  0.262  0.497  0.013  1.0
  F  F21  1  0.503  0.262  0.763  1.0
  F  F22  1  0.497  0.738  0.263  1.0
  F  F23  1  0.738  0.503  0.513  1.0
  F  F24  1  0.255  0.518  0.493  1.0
  F  F25  1  0.519  0.745  0.743  1.0
  F  F26  1  0.483  0.256  0.243  1.0
  F  F27  1  0.744  0.482  0.993  1.0
[/CIF]
.