The material structure described by Mn5OF11 crystallizes in the triclinic P1 space group. There are five inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 4-coordinate geometry to one F(1), one F(10), one F(2), one F(5), one F(8), and one F(9) atom. In the second Mn site, Mn(2) is bonded in a 4-coordinate geometry to one F(1), one F(5), one F(7), and one F(9) atom. In the third Mn site, Mn(3) is bonded in a distorted linear geometry to one O(1), one F(8), and one F(9) atom. In the fourth Mn site, Mn(4) is bonded in a distorted rectangular see-saw-like geometry to one F(10), one F(3), one F(4), and one F(6) atom. In the fifth Mn site, Mn(5) is bonded in a rectangular see-saw-like geometry to one O(1), one F(11), one F(3), and one F(6) atom. O(1) is bonded in a 4-coordinate geometry to one Mn(3), one Mn(5), one F(7), and one F(8) atom. There are eleven inequivalent F sites. In the first F site, F(1) is bonded in a distorted L-shaped geometry to one Mn(1) and one Mn(2) atom. In the second F site, F(2) is bonded in a 3-coordinate geometry to one Mn(1), one F(10), and one F(11) atom. In the third F site, F(3) is bonded in a distorted L-shaped geometry to one Mn(4), one Mn(5), and one F(11) atom. In the fourth F site, F(4) is bonded in a single-bond geometry to one Mn(4) atom. In the fifth F site, F(5) is bonded in a distorted bent 120 degrees geometry to one Mn(1) and one Mn(2) atom. In the sixth F site, F(6) is bonded in a water-like geometry to one Mn(4) and one Mn(5) atom. In the seventh F site, F(7) is bonded in a water-like geometry to one Mn(2) and one O(1) atom. In the eighth F site, F(8) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(3), and one O(1) atom. In the ninth F site, F(9) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(2), and one Mn(3) atom. In the tenth F site, F(10) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(4), and one F(2) atom. In the eleventh F site, F(11) is bonded in a distorted single-bond geometry to one Mn(5), one F(2), and one F(3) atom. is represented by the CIF file [CIF]
data_Mn5OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.538
_cell_length_b   5.800
_cell_length_c   9.332
_cell_angle_alpha   107.431
_cell_angle_beta   89.742
_cell_angle_gamma   115.412
_symmetry_Int_Tables_number   1
_cell_volume   255.643
_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
  Mn  Mn0  1  0.995  0.674  0.670  1.0
  Mn  Mn1  1  0.475  0.269  0.839  1.0
  Mn  Mn2  1  0.767  0.708  0.929  1.0
  Mn  Mn3  1  0.006  0.350  0.335  1.0
  Mn  Mn4  1  0.506  0.668  0.159  1.0
  O  O5  1  0.542  0.845  0.967  1.0
  F  F6  1  0.050  0.171  0.805  1.0
  F  F7  1  0.030  0.918  0.444  1.0
  F  F8  1  0.055  0.523  0.131  1.0
  F  F9  1  0.588  0.261  0.258  1.0
  F  F10  1  0.576  0.422  0.667  1.0
  F  F11  1  0.425  0.522  0.334  1.0
  F  F12  1  0.492  0.143  0.036  1.0
  F  F13  1  0.429  0.696  0.751  1.0
  F  F14  1  0.899  0.543  0.859  1.0
  F  F15  1  0.990  0.181  0.530  1.0
  F  F16  1  0.940  0.758  0.232  1.0
[/CIF]
.
The material structure described by Mn5OF11 crystallizes in the triclinic P1 space group. There are five inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 4-coordinate geometry to one F(1), one F(10), one F(2), one F(5), one F(8), and one F(9) atom. In the second Mn site, Mn(2) is bonded in a 4-coordinate geometry to one F(1), one F(5), one F(7), and one F(9) atom. In the third Mn site, Mn(3) is bonded in a distorted linear geometry to one O(1), one F(8), and one F(9) atom. In the fourth Mn site, Mn(4) is bonded in a distorted rectangular see-saw-like geometry to one F(10), one F(3), one F(4), and one F(6) atom. In the fifth Mn site, Mn(5) is bonded in a rectangular see-saw-like geometry to one O(1), one F(11), one F(3), and one F(6) atom. O(1) is bonded in a 4-coordinate geometry to one Mn(3), one Mn(5), one F(7), and one F(8) atom. There are eleven inequivalent F sites. In the first F site, F(1) is bonded in a distorted L-shaped geometry to one Mn(1) and one Mn(2) atom. In the second F site, F(2) is bonded in a 3-coordinate geometry to one Mn(1), one F(10), and one F(11) atom. In the third F site, F(3) is bonded in a distorted L-shaped geometry to one Mn(4), one Mn(5), and one F(11) atom. In the fourth F site, F(4) is bonded in a single-bond geometry to one Mn(4) atom. In the fifth F site, F(5) is bonded in a distorted bent 120 degrees geometry to one Mn(1) and one Mn(2) atom. In the sixth F site, F(6) is bonded in a water-like geometry to one Mn(4) and one Mn(5) atom. In the seventh F site, F(7) is bonded in a water-like geometry to one Mn(2) and one O(1) atom. In the eighth F site, F(8) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(3), and one O(1) atom. In the ninth F site, F(9) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(2), and one Mn(3) atom. In the tenth F site, F(10) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(4), and one F(2) atom. In the eleventh F site, F(11) is bonded in a distorted single-bond geometry to one Mn(5), one F(2), and one F(3) atom. is represented by the CIF file [CIF]
data_Mn5OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.538
_cell_length_b   5.800
_cell_length_c   9.332
_cell_angle_alpha   107.431
_cell_angle_beta   89.742
_cell_angle_gamma   115.412
_symmetry_Int_Tables_number   1
_cell_volume   255.643
_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
  Mn  Mn0  1  0.995  0.674  0.670  1.0
  Mn  Mn1  1  0.475  0.269  0.839  1.0
  Mn  Mn2  1  0.767  0.708  0.929  1.0
  Mn  Mn3  1  0.006  0.350  0.335  1.0
  Mn  Mn4  1  0.506  0.668  0.159  1.0
  O  O5  1  0.542  0.845  0.967  1.0
  F  F6  1  0.050  0.171  0.805  1.0
  F  F7  1  0.030  0.918  0.444  1.0
  F  F8  1  0.055  0.523  0.131  1.0
  F  F9  1  0.588  0.261  0.258  1.0
  F  F10  1  0.576  0.422  0.667  1.0
  F  F11  1  0.425  0.522  0.334  1.0
  F  F12  1  0.492  0.143  0.036  1.0
  F  F13  1  0.429  0.696  0.751  1.0
  F  F14  1  0.899  0.543  0.859  1.0
  F  F15  1  0.990  0.181  0.530  1.0
  F  F16  1  0.940  0.758  0.232  1.0
[/CIF]
.