The structure described by Mn6O5F7 crystallizes in the triclinic P1 space group. There are twelve inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(2), one O(5), one F(10), one F(13), one F(2), and one F(3) atom to form MnO2F4 octahedra that share corners with two equivalent Mn(2)O2F4 octahedra, corners with two equivalent Mn(7)O4F2 octahedra, corners with two equivalent Mn(6)OF5 octahedra, and edges with two equivalent Mn(8)O3F3 octahedra. The corner-sharing octahedral tilt angles range from 42-59°. In the second Mn site, Mn(2) is bonded to one O(10), one O(9), one F(1), one F(10), one F(14), and one F(2) atom to form MnO2F4 octahedra that share corners with two equivalent Mn(1)O2F4 octahedra, corners with two equivalent Mn(3)O2F4 octahedra, corners with two equivalent Mn(11)O3F3 octahedra, corners with two equivalent Mn(8)O3F3 octahedra, and edges with two equivalent Mn(7)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 43-59°. In the third Mn site, Mn(3) is bonded to one O(3), one O(6), one F(1), one F(14), one F(5), and one F(9) atom to form MnO2F4 octahedra that share corners with two equivalent Mn(2)O2F4 octahedra, corners with two equivalent Mn(7)O4F2 octahedra, corners with two equivalent Mn(4)OF5 octahedra, and edges with two equivalent Mn(11)O3F3 octahedra. The corner-sharing octahedral tilt angles range from 43-59°. In the fourth Mn site, Mn(4) is bonded to one O(8), one F(12), one F(4), one F(5), one F(7), and one F(9) atom to form MnOF5 octahedra that share corners with two equivalent Mn(3)O2F4 octahedra, corners with two equivalent Mn(11)O3F3 octahedra, corners with two equivalent Mn(5)O3F3 octahedra, and corners with two equivalent Mn(9)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 38-59°. In the fifth Mn site, Mn(5) is bonded to one O(1), one O(4), one O(7), one F(11), one F(12), and one F(4) atom to form MnO3F3 octahedra that share corners with two equivalent Mn(4)OF5 octahedra, corners with two equivalent Mn(6)OF5 octahedra, and edges with two equivalent Mn(9)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 38-58°. In the sixth Mn site, Mn(6) is bonded to one O(1), one F(11), one F(13), one F(3), one F(6), and one F(8) atom to form distorted MnOF5 octahedra that share corners with two equivalent Mn(1)O2F4 octahedra, corners with two equivalent Mn(5)O3F3 octahedra, corners with two equivalent Mn(8)O3F3 octahedra, and corners with two equivalent Mn(9)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 42-64°. In the seventh Mn site, Mn(7) is bonded to one O(10), one O(2), one O(3), one O(9), one F(10), and one F(14) atom to form distorted MnO4F2 octahedra that share corners with two equivalent Mn(1)O2F4 octahedra, corners with two equivalent Mn(3)O2F4 octahedra, corners with two equivalent Mn(11)O3F3 octahedra, corners with two equivalent Mn(8)O3F3 octahedra, and edges with two equivalent Mn(2)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 43-59°. In the eighth Mn site, Mn(8) is bonded to one O(10), one O(2), one O(5), one F(2), one F(3), and one F(6) atom to form distorted MnO3F3 octahedra that share corners with two equivalent Mn(2)O2F4 octahedra, corners with two equivalent Mn(7)O4F2 octahedra, corners with two equivalent Mn(6)OF5 octahedra, and edges with two equivalent Mn(1)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 43-59°. In the ninth Mn site, Mn(9) is bonded to one O(1), one O(4), one O(7), one O(8), one F(4), and one F(8) atom to form distorted MnO4F2 octahedra that share corners with two equivalent Mn(4)OF5 octahedra, corners with two equivalent Mn(6)OF5 octahedra, and edges with two equivalent Mn(5)O3F3 octahedra. The corner-sharing octahedral tilt angles range from 47-64°. In the tenth Mn site, Mn(10) is bonded in a 6-coordinate geometry to one O(4), one O(6), one O(8), one F(12), one F(7), and one F(9) atom. In the eleventh Mn site, Mn(11) is bonded to one O(3), one O(6), one O(9), one F(1), one F(5), and one F(7) atom to form MnO3F3 octahedra that share corners with two equivalent Mn(2)O2F4 octahedra, corners with two equivalent Mn(7)O4F2 octahedra, corners with two equivalent Mn(4)OF5 octahedra, and edges with two equivalent Mn(3)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 45-57°. In the twelfth Mn site, Mn(12) is bonded in a 5-coordinate geometry to one O(1), one O(5), one O(7), one F(6), and one F(8) atom. There are ten inequivalent O sites. In the first O site, O(1) is bonded in a distorted rectangular see-saw-like geometry to one Mn(12), one Mn(5), one Mn(6), and one Mn(9) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one Mn(1), one Mn(7), and one Mn(8) atom. In the third O site, O(3) is bonded in a trigonal planar geometry to one Mn(11), one Mn(3), and one Mn(7) atom. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one Mn(10), one Mn(5), and one Mn(9) atom. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to one Mn(1), one Mn(12), and one Mn(8) atom. In the sixth O site, O(6) is bonded in a trigonal planar geometry to one Mn(10), one Mn(11), and one Mn(3) atom. In the seventh O site, O(7) is bonded in a distorted trigonal non-coplanar geometry to one Mn(12), one Mn(5), and one Mn(9) atom. In the eighth O site, O(8) is bonded in a trigonal planar geometry to one Mn(10), one Mn(4), and one Mn(9) atom. In the ninth O site, O(9) is bonded in a trigonal planar geometry to one Mn(11), one Mn(2), and one Mn(7) atom. In the tenth O site, O(10) is bonded in a trigonal planar geometry to one Mn(2), one Mn(7), and one Mn(8) atom. There are fourteen inequivalent F sites. In the first F site, F(1) is bonded in a distorted T-shaped geometry to one Mn(11), one Mn(2), and one Mn(3) atom. In the second F site, F(2) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(2), and one Mn(8) atom. In the third F site, F(3) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(6), and one Mn(8) atom. In the fourth F site, F(4) is bonded in a distorted trigonal planar geometry to one Mn(4), one Mn(5), and one Mn(9) atom. In the fifth F site, F(5) is bonded in a distorted trigonal planar geometry to one Mn(11), one Mn(3), and one Mn(4) atom. In the sixth F site, F(6) is bonded in a trigonal planar geometry to one Mn(12), one Mn(6), and one Mn(8) atom. In the seventh F site, F(7) is bonded in a trigonal planar geometry to one Mn(10), one Mn(11), and one Mn(4) atom. In the eighth F site, F(8) is bonded in a trigonal planar geometry to one Mn(12), one Mn(6), and one Mn(9) atom. In the ninth F site, F(9) is bonded in a distorted T-shaped geometry to one Mn(10), one Mn(3), and one Mn(4) atom. In the tenth F site, F(10) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(2), and one Mn(7) atom. In the eleventh F site, F(11) is bonded in a bent 120 degrees geometry to one Mn(5) and one Mn(6) atom. In the twelfth F site, F(12) is bonded in a 3-coordinate geometry to one Mn(10), one Mn(4), and one Mn(5) atom. In the thirteenth F site, F(13) is bonded in a bent 120 degrees geometry to one Mn(1) and one Mn(6) atom. In the fourteenth F site, F(14) is bonded in a 3-coordinate geometry to one Mn(2), one Mn(3), and one Mn(7) atom. is represented by the CIF card [CIF]
data_Mn6O5F7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.179
_cell_length_b   5.739
_cell_length_c   14.425
_cell_angle_alpha   88.909
_cell_angle_beta   87.394
_cell_angle_gamma   89.933
_symmetry_Int_Tables_number   1
_cell_volume   428.206
_cell_formula_units_Z   2
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  0.032  0.125  0.009  1.0
  Mn  Mn1  1  0.509  0.849  0.169  1.0
  Mn  Mn2  1  0.993  0.115  0.330  1.0
  Mn  Mn3  1  0.489  0.894  0.504  1.0
  Mn  Mn4  1  0.988  0.145  0.667  1.0
  Mn  Mn5  1  0.489  0.962  0.827  1.0
  Mn  Mn6  1  0.009  0.558  0.167  1.0
  Mn  Mn7  1  0.526  0.419  0.008  1.0
  Mn  Mn8  1  0.474  0.425  0.661  1.0
  Mn  Mn9  1  0.961  0.549  0.497  1.0
  Mn  Mn10  1  0.499  0.396  0.325  1.0
  Mn  Mn11  1  0.020  0.489  0.832  1.0
  O  O12  1  0.266  0.204  0.745  1.0
  O  O13  1  0.840  0.365  0.077  1.0
  O  O14  1  0.182  0.356  0.260  1.0
  O  O15  1  0.157  0.373  0.588  1.0
  O  O16  1  0.220  0.363  0.942  1.0
  O  O17  1  0.803  0.349  0.397  1.0
  O  O18  1  0.785  0.365  0.730  1.0
  O  O19  1  0.651  0.614  0.567  1.0
  O  O20  1  0.682  0.611  0.238  1.0
  O  O21  1  0.334  0.619  0.099  1.0
  F  F22  1  0.657  0.090  0.249  1.0
  F  F23  1  0.368  0.104  0.092  1.0
  F  F24  1  0.701  0.166  0.923  1.0
  F  F25  1  0.685  0.124  0.587  1.0
  F  F26  1  0.336  0.135  0.410  1.0
  F  F27  1  0.697  0.638  0.903  1.0
  F  F28  1  0.297  0.624  0.425  1.0
  F  F29  1  0.321  0.677  0.758  1.0
  F  F30  1  0.841  0.865  0.418  1.0
  F  F31  1  0.861  0.870  0.086  1.0
  F  F32  1  0.832  0.906  0.746  1.0
  F  F33  1  0.153  0.897  0.588  1.0
  F  F34  1  0.190  0.895  0.927  1.0
  F  F35  1  0.153  0.862  0.252  1.0
[/CIF]
.
The structure described by Mn6O5F7 crystallizes in the triclinic P1 space group. There are twelve inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(2), one O(5), one F(10), one F(13), one F(2), and one F(3) atom to form MnO2F4 octahedra that share corners with two equivalent Mn(2)O2F4 octahedra, corners with two equivalent Mn(7)O4F2 octahedra, corners with two equivalent Mn(6)OF5 octahedra, and edges with two equivalent Mn(8)O3F3 octahedra. The corner-sharing octahedral tilt angles range from 42-59°. In the second Mn site, Mn(2) is bonded to one O(10), one O(9), one F(1), one F(10), one F(14), and one F(2) atom to form MnO2F4 octahedra that share corners with two equivalent Mn(1)O2F4 octahedra, corners with two equivalent Mn(3)O2F4 octahedra, corners with two equivalent Mn(11)O3F3 octahedra, corners with two equivalent Mn(8)O3F3 octahedra, and edges with two equivalent Mn(7)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 43-59°. In the third Mn site, Mn(3) is bonded to one O(3), one O(6), one F(1), one F(14), one F(5), and one F(9) atom to form MnO2F4 octahedra that share corners with two equivalent Mn(2)O2F4 octahedra, corners with two equivalent Mn(7)O4F2 octahedra, corners with two equivalent Mn(4)OF5 octahedra, and edges with two equivalent Mn(11)O3F3 octahedra. The corner-sharing octahedral tilt angles range from 43-59°. In the fourth Mn site, Mn(4) is bonded to one O(8), one F(12), one F(4), one F(5), one F(7), and one F(9) atom to form MnOF5 octahedra that share corners with two equivalent Mn(3)O2F4 octahedra, corners with two equivalent Mn(11)O3F3 octahedra, corners with two equivalent Mn(5)O3F3 octahedra, and corners with two equivalent Mn(9)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 38-59°. In the fifth Mn site, Mn(5) is bonded to one O(1), one O(4), one O(7), one F(11), one F(12), and one F(4) atom to form MnO3F3 octahedra that share corners with two equivalent Mn(4)OF5 octahedra, corners with two equivalent Mn(6)OF5 octahedra, and edges with two equivalent Mn(9)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 38-58°. In the sixth Mn site, Mn(6) is bonded to one O(1), one F(11), one F(13), one F(3), one F(6), and one F(8) atom to form distorted MnOF5 octahedra that share corners with two equivalent Mn(1)O2F4 octahedra, corners with two equivalent Mn(5)O3F3 octahedra, corners with two equivalent Mn(8)O3F3 octahedra, and corners with two equivalent Mn(9)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 42-64°. In the seventh Mn site, Mn(7) is bonded to one O(10), one O(2), one O(3), one O(9), one F(10), and one F(14) atom to form distorted MnO4F2 octahedra that share corners with two equivalent Mn(1)O2F4 octahedra, corners with two equivalent Mn(3)O2F4 octahedra, corners with two equivalent Mn(11)O3F3 octahedra, corners with two equivalent Mn(8)O3F3 octahedra, and edges with two equivalent Mn(2)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 43-59°. In the eighth Mn site, Mn(8) is bonded to one O(10), one O(2), one O(5), one F(2), one F(3), and one F(6) atom to form distorted MnO3F3 octahedra that share corners with two equivalent Mn(2)O2F4 octahedra, corners with two equivalent Mn(7)O4F2 octahedra, corners with two equivalent Mn(6)OF5 octahedra, and edges with two equivalent Mn(1)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 43-59°. In the ninth Mn site, Mn(9) is bonded to one O(1), one O(4), one O(7), one O(8), one F(4), and one F(8) atom to form distorted MnO4F2 octahedra that share corners with two equivalent Mn(4)OF5 octahedra, corners with two equivalent Mn(6)OF5 octahedra, and edges with two equivalent Mn(5)O3F3 octahedra. The corner-sharing octahedral tilt angles range from 47-64°. In the tenth Mn site, Mn(10) is bonded in a 6-coordinate geometry to one O(4), one O(6), one O(8), one F(12), one F(7), and one F(9) atom. In the eleventh Mn site, Mn(11) is bonded to one O(3), one O(6), one O(9), one F(1), one F(5), and one F(7) atom to form MnO3F3 octahedra that share corners with two equivalent Mn(2)O2F4 octahedra, corners with two equivalent Mn(7)O4F2 octahedra, corners with two equivalent Mn(4)OF5 octahedra, and edges with two equivalent Mn(3)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 45-57°. In the twelfth Mn site, Mn(12) is bonded in a 5-coordinate geometry to one O(1), one O(5), one O(7), one F(6), and one F(8) atom. There are ten inequivalent O sites. In the first O site, O(1) is bonded in a distorted rectangular see-saw-like geometry to one Mn(12), one Mn(5), one Mn(6), and one Mn(9) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one Mn(1), one Mn(7), and one Mn(8) atom. In the third O site, O(3) is bonded in a trigonal planar geometry to one Mn(11), one Mn(3), and one Mn(7) atom. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one Mn(10), one Mn(5), and one Mn(9) atom. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to one Mn(1), one Mn(12), and one Mn(8) atom. In the sixth O site, O(6) is bonded in a trigonal planar geometry to one Mn(10), one Mn(11), and one Mn(3) atom. In the seventh O site, O(7) is bonded in a distorted trigonal non-coplanar geometry to one Mn(12), one Mn(5), and one Mn(9) atom. In the eighth O site, O(8) is bonded in a trigonal planar geometry to one Mn(10), one Mn(4), and one Mn(9) atom. In the ninth O site, O(9) is bonded in a trigonal planar geometry to one Mn(11), one Mn(2), and one Mn(7) atom. In the tenth O site, O(10) is bonded in a trigonal planar geometry to one Mn(2), one Mn(7), and one Mn(8) atom. There are fourteen inequivalent F sites. In the first F site, F(1) is bonded in a distorted T-shaped geometry to one Mn(11), one Mn(2), and one Mn(3) atom. In the second F site, F(2) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(2), and one Mn(8) atom. In the third F site, F(3) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(6), and one Mn(8) atom. In the fourth F site, F(4) is bonded in a distorted trigonal planar geometry to one Mn(4), one Mn(5), and one Mn(9) atom. In the fifth F site, F(5) is bonded in a distorted trigonal planar geometry to one Mn(11), one Mn(3), and one Mn(4) atom. In the sixth F site, F(6) is bonded in a trigonal planar geometry to one Mn(12), one Mn(6), and one Mn(8) atom. In the seventh F site, F(7) is bonded in a trigonal planar geometry to one Mn(10), one Mn(11), and one Mn(4) atom. In the eighth F site, F(8) is bonded in a trigonal planar geometry to one Mn(12), one Mn(6), and one Mn(9) atom. In the ninth F site, F(9) is bonded in a distorted T-shaped geometry to one Mn(10), one Mn(3), and one Mn(4) atom. In the tenth F site, F(10) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(2), and one Mn(7) atom. In the eleventh F site, F(11) is bonded in a bent 120 degrees geometry to one Mn(5) and one Mn(6) atom. In the twelfth F site, F(12) is bonded in a 3-coordinate geometry to one Mn(10), one Mn(4), and one Mn(5) atom. In the thirteenth F site, F(13) is bonded in a bent 120 degrees geometry to one Mn(1) and one Mn(6) atom. In the fourteenth F site, F(14) is bonded in a 3-coordinate geometry to one Mn(2), one Mn(3), and one Mn(7) atom. is represented by the CIF card [CIF]
data_Mn6O5F7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.179
_cell_length_b   5.739
_cell_length_c   14.425
_cell_angle_alpha   88.909
_cell_angle_beta   87.394
_cell_angle_gamma   89.933
_symmetry_Int_Tables_number   1
_cell_volume   428.206
_cell_formula_units_Z   2
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  0.032  0.125  0.009  1.0
  Mn  Mn1  1  0.509  0.849  0.169  1.0
  Mn  Mn2  1  0.993  0.115  0.330  1.0
  Mn  Mn3  1  0.489  0.894  0.504  1.0
  Mn  Mn4  1  0.988  0.145  0.667  1.0
  Mn  Mn5  1  0.489  0.962  0.827  1.0
  Mn  Mn6  1  0.009  0.558  0.167  1.0
  Mn  Mn7  1  0.526  0.419  0.008  1.0
  Mn  Mn8  1  0.474  0.425  0.661  1.0
  Mn  Mn9  1  0.961  0.549  0.497  1.0
  Mn  Mn10  1  0.499  0.396  0.325  1.0
  Mn  Mn11  1  0.020  0.489  0.832  1.0
  O  O12  1  0.266  0.204  0.745  1.0
  O  O13  1  0.840  0.365  0.077  1.0
  O  O14  1  0.182  0.356  0.260  1.0
  O  O15  1  0.157  0.373  0.588  1.0
  O  O16  1  0.220  0.363  0.942  1.0
  O  O17  1  0.803  0.349  0.397  1.0
  O  O18  1  0.785  0.365  0.730  1.0
  O  O19  1  0.651  0.614  0.567  1.0
  O  O20  1  0.682  0.611  0.238  1.0
  O  O21  1  0.334  0.619  0.099  1.0
  F  F22  1  0.657  0.090  0.249  1.0
  F  F23  1  0.368  0.104  0.092  1.0
  F  F24  1  0.701  0.166  0.923  1.0
  F  F25  1  0.685  0.124  0.587  1.0
  F  F26  1  0.336  0.135  0.410  1.0
  F  F27  1  0.697  0.638  0.903  1.0
  F  F28  1  0.297  0.624  0.425  1.0
  F  F29  1  0.321  0.677  0.758  1.0
  F  F30  1  0.841  0.865  0.418  1.0
  F  F31  1  0.861  0.870  0.086  1.0
  F  F32  1  0.832  0.906  0.746  1.0
  F  F33  1  0.153  0.897  0.588  1.0
  F  F34  1  0.190  0.895  0.927  1.0
  F  F35  1  0.153  0.862  0.252  1.0
[/CIF]
.