The material described by LiMnOF2 is Ilmenite-derived structured and crystallizes in the triclinic P-1 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a 6-coordinate geometry to one O(1), one O(2), one F(1), one F(2), one F(3), and one F(4) atom. In the second Li site, Li(2) is bonded in a 6-coordinate geometry to one O(1), one O(2), one F(1), one F(2), one F(3), and one F(4) atom. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to two equivalent O(2), two equivalent F(2), and two equivalent F(4) atoms to form edge-sharing MnO2F4 octahedra. In the second Mn site, Mn(2) is bonded to two equivalent O(1), two equivalent F(1), and two equivalent F(3) atoms to form edge-sharing MnO2F4 octahedra. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), and two equivalent Mn(2) atoms. In the second O site, O(2) is bonded to one Li(1), one Li(2), and two equivalent Mn(1) atoms to form distorted OLi2Mn2 trigonal pyramids that share  an edgeedge with one O(2)Li2Mn2 trigonal pyramid and  an edgeedge with one F(1)Li2Mn2 trigonal pyramid. There are four inequivalent F sites. In the first F site, F(1) is bonded to one Li(1), one Li(2), and two equivalent Mn(2) atoms to form distorted FLi2Mn2 trigonal pyramids that share  an edgeedge with one O(2)Li2Mn2 trigonal pyramid and  an edgeedge with one F(1)Li2Mn2 trigonal pyramid. In the second F site, F(2) is bonded in a 4-coordinate geometry to one Li(1), one Li(2), and two equivalent Mn(1) atoms. In the third F site, F(3) is bonded in a 4-coordinate geometry to one Li(1), one Li(2), and two equivalent Mn(2) atoms. In the fourth F site, F(4) is bonded in a distorted rectangular see-saw-like geometry to one Li(1), one Li(2), and two equivalent Mn(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiMnOF2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.238
_cell_length_b   9.942
_cell_length_c   5.150
_cell_angle_alpha   106.961
_cell_angle_beta   61.864
_cell_angle_gamma   91.283
_symmetry_Int_Tables_number   1
_cell_volume   224.116
_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  0.479  0.707  0.102  1.0
  Li  Li1  1  0.085  0.794  0.856  1.0
  Li  Li2  1  0.915  0.206  0.144  1.0
  Li  Li3  1  0.521  0.293  0.898  1.0
  Mn  Mn4  1  0.337  0.016  0.316  1.0
  Mn  Mn5  1  0.159  0.486  0.645  1.0
  Mn  Mn6  1  0.663  0.984  0.684  1.0
  Mn  Mn7  1  0.841  0.514  0.355  1.0
  O  O8  1  0.138  0.383  0.288  1.0
  O  O9  1  0.599  0.115  0.061  1.0
  O  O10  1  0.401  0.885  0.939  1.0
  O  O11  1  0.862  0.617  0.712  1.0
  F  F12  1  0.152  0.617  0.024  1.0
  F  F13  1  0.100  0.884  0.536  1.0
  F  F14  1  0.493  0.624  0.423  1.0
  F  F15  1  0.300  0.128  0.721  1.0
  F  F16  1  0.700  0.872  0.279  1.0
  F  F17  1  0.507  0.376  0.577  1.0
  F  F18  1  0.900  0.116  0.464  1.0
  F  F19  1  0.848  0.383  0.976  1.0
[/CIF]
.
The material described by LiMnOF2 is Ilmenite-derived structured and crystallizes in the triclinic P-1 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a 6-coordinate geometry to one O(1), one O(2), one F(1), one F(2), one F(3), and one F(4) atom. In the second Li site, Li(2) is bonded in a 6-coordinate geometry to one O(1), one O(2), one F(1), one F(2), one F(3), and one F(4) atom. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to two equivalent O(2), two equivalent F(2), and two equivalent F(4) atoms to form edge-sharing MnO2F4 octahedra. In the second Mn site, Mn(2) is bonded to two equivalent O(1), two equivalent F(1), and two equivalent F(3) atoms to form edge-sharing MnO2F4 octahedra. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), and two equivalent Mn(2) atoms. In the second O site, O(2) is bonded to one Li(1), one Li(2), and two equivalent Mn(1) atoms to form distorted OLi2Mn2 trigonal pyramids that share  an edgeedge with one O(2)Li2Mn2 trigonal pyramid and  an edgeedge with one F(1)Li2Mn2 trigonal pyramid. There are four inequivalent F sites. In the first F site, F(1) is bonded to one Li(1), one Li(2), and two equivalent Mn(2) atoms to form distorted FLi2Mn2 trigonal pyramids that share  an edgeedge with one O(2)Li2Mn2 trigonal pyramid and  an edgeedge with one F(1)Li2Mn2 trigonal pyramid. In the second F site, F(2) is bonded in a 4-coordinate geometry to one Li(1), one Li(2), and two equivalent Mn(1) atoms. In the third F site, F(3) is bonded in a 4-coordinate geometry to one Li(1), one Li(2), and two equivalent Mn(2) atoms. In the fourth F site, F(4) is bonded in a distorted rectangular see-saw-like geometry to one Li(1), one Li(2), and two equivalent Mn(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiMnOF2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.238
_cell_length_b   9.942
_cell_length_c   5.150
_cell_angle_alpha   106.961
_cell_angle_beta   61.864
_cell_angle_gamma   91.283
_symmetry_Int_Tables_number   1
_cell_volume   224.116
_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  0.479  0.707  0.102  1.0
  Li  Li1  1  0.085  0.794  0.856  1.0
  Li  Li2  1  0.915  0.206  0.144  1.0
  Li  Li3  1  0.521  0.293  0.898  1.0
  Mn  Mn4  1  0.337  0.016  0.316  1.0
  Mn  Mn5  1  0.159  0.486  0.645  1.0
  Mn  Mn6  1  0.663  0.984  0.684  1.0
  Mn  Mn7  1  0.841  0.514  0.355  1.0
  O  O8  1  0.138  0.383  0.288  1.0
  O  O9  1  0.599  0.115  0.061  1.0
  O  O10  1  0.401  0.885  0.939  1.0
  O  O11  1  0.862  0.617  0.712  1.0
  F  F12  1  0.152  0.617  0.024  1.0
  F  F13  1  0.100  0.884  0.536  1.0
  F  F14  1  0.493  0.624  0.423  1.0
  F  F15  1  0.300  0.128  0.721  1.0
  F  F16  1  0.700  0.872  0.279  1.0
  F  F17  1  0.507  0.376  0.577  1.0
  F  F18  1  0.900  0.116  0.464  1.0
  F  F19  1  0.848  0.383  0.976  1.0
[/CIF]
.