The material described by Mn6O11F is Hydrophilite-derived structured and crystallizes in the monoclinic Cm space group. There are six inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(3), one O(7), two equivalent O(1), and two equivalent O(8) atoms to form MnO6 octahedra that share corners with two equivalent Mn(2)O5F octahedra, corners with three equivalent Mn(6)O5F octahedra, corners with three equivalent Mn(3)O6 octahedra,  an edgeedge with one Mn(5)O5F octahedra, and  an edgeedge with one Mn(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 47-53°. In the second Mn site, Mn(2) is bonded to one O(3), one O(6), one O(7), two equivalent O(2), and one F(1) atom to form MnO5F octahedra that share corners with two equivalent Mn(1)O6 octahedra, corners with three equivalent Mn(5)O5F octahedra, corners with three equivalent Mn(4)O6 octahedra,  an edgeedge with one Mn(6)O5F octahedra, and  an edgeedge with one Mn(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 47-52°. In the third Mn site, Mn(3) is bonded to one O(3), one O(4), one O(5), one O(6), and two equivalent O(1) atoms to form MnO6 octahedra that share corners with two equivalent Mn(4)O6 octahedra, corners with three equivalent Mn(5)O5F octahedra, corners with three equivalent Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O5F octahedra, and  an edgeedge with one Mn(6)O5F octahedra. The corner-sharing octahedral tilt angles range from 47-51°. In the fourth Mn site, Mn(4) is bonded to one O(4), one O(6), two equivalent O(2), and two equivalent O(8) atoms to form MnO6 octahedra that share corners with two equivalent Mn(3)O6 octahedra, corners with three equivalent Mn(2)O5F octahedra, corners with three equivalent Mn(6)O5F octahedra,  an edgeedge with one Mn(5)O5F octahedra, and  an edgeedge with one Mn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 47-51°. In the fifth Mn site, Mn(5) is bonded to one O(5), two equivalent O(1), two equivalent O(2), and one F(1) atom to form MnO5F octahedra that share corners with two equivalent Mn(6)O5F octahedra, corners with three equivalent Mn(2)O5F octahedra, corners with three equivalent Mn(3)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra, and  an edgeedge with one Mn(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 48-52°. In the sixth Mn site, Mn(6) is bonded to one O(4), one O(5), one O(7), two equivalent O(8), and one F(1) atom to form MnO5F octahedra that share corners with two equivalent Mn(5)O5F octahedra, corners with three equivalent Mn(1)O6 octahedra, corners with three equivalent Mn(4)O6 octahedra,  an edgeedge with one Mn(2)O5F octahedra, and  an edgeedge with one Mn(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 49-53°. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one Mn(1), one Mn(3), and one Mn(5) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one Mn(2), one Mn(4), and one Mn(5) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Mn(1), one Mn(2), and one Mn(3) atom. In the fourth O site, O(4) is bonded in a trigonal planar geometry to one Mn(3), one Mn(4), and one Mn(6) atom. In the fifth O site, O(5) is bonded in a trigonal planar geometry to one Mn(3), one Mn(5), and one Mn(6) atom. In the sixth O site, O(6) is bonded in a distorted trigonal planar geometry to one Mn(2), one Mn(3), and one Mn(4) atom. In the seventh O site, O(7) is bonded in a trigonal planar geometry to one Mn(1), one Mn(2), and one Mn(6) atom. In the eighth O site, O(8) is bonded in a trigonal planar geometry to one Mn(1), one Mn(4), and one Mn(6) atom. F(1) is bonded in a distorted trigonal planar geometry to one Mn(2), one Mn(5), and one Mn(6) atom. is represented by the CIF card [CIF]
data_Mn6O11F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.393
_cell_length_b   5.393
_cell_length_c   7.087
_cell_angle_alpha   71.963
_cell_angle_beta   71.963
_cell_angle_gamma   71.678
_symmetry_Int_Tables_number   1
_cell_volume   180.844
_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  0.332  0.332  0.166  1.0
  Mn  Mn1  1  0.344  0.344  0.668  1.0
  Mn  Mn2  1  0.662  0.662  0.331  1.0
  Mn  Mn3  1  0.669  0.669  0.838  1.0
  Mn  Mn4  1  0.994  0.994  0.489  1.0
  Mn  Mn5  1  0.999  0.999  0.010  1.0
  O  O6  1  0.972  0.360  0.336  1.0
  O  O7  1  0.639  0.029  0.665  1.0
  O  O8  1  0.435  0.435  0.371  1.0
  O  O9  1  0.768  0.768  0.039  1.0
  O  O10  1  0.894  0.894  0.298  1.0
  O  O11  1  0.568  0.568  0.629  1.0
  O  O12  1  0.233  0.233  0.962  1.0
  O  O13  1  0.694  0.304  0.999  1.0
  O  O14  1  0.029  0.639  0.665  1.0
  O  O15  1  0.360  0.972  0.336  1.0
  O  O16  1  0.304  0.694  0.999  1.0
  F  F17  1  0.103  0.103  0.700  1.0
[/CIF]
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The material described by Mn6O11F is Hydrophilite-derived structured and crystallizes in the monoclinic Cm space group. There are six inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(3), one O(7), two equivalent O(1), and two equivalent O(8) atoms to form MnO6 octahedra that share corners with two equivalent Mn(2)O5F octahedra, corners with three equivalent Mn(6)O5F octahedra, corners with three equivalent Mn(3)O6 octahedra,  an edgeedge with one Mn(5)O5F octahedra, and  an edgeedge with one Mn(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 47-53°. In the second Mn site, Mn(2) is bonded to one O(3), one O(6), one O(7), two equivalent O(2), and one F(1) atom to form MnO5F octahedra that share corners with two equivalent Mn(1)O6 octahedra, corners with three equivalent Mn(5)O5F octahedra, corners with three equivalent Mn(4)O6 octahedra,  an edgeedge with one Mn(6)O5F octahedra, and  an edgeedge with one Mn(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 47-52°. In the third Mn site, Mn(3) is bonded to one O(3), one O(4), one O(5), one O(6), and two equivalent O(1) atoms to form MnO6 octahedra that share corners with two equivalent Mn(4)O6 octahedra, corners with three equivalent Mn(5)O5F octahedra, corners with three equivalent Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O5F octahedra, and  an edgeedge with one Mn(6)O5F octahedra. The corner-sharing octahedral tilt angles range from 47-51°. In the fourth Mn site, Mn(4) is bonded to one O(4), one O(6), two equivalent O(2), and two equivalent O(8) atoms to form MnO6 octahedra that share corners with two equivalent Mn(3)O6 octahedra, corners with three equivalent Mn(2)O5F octahedra, corners with three equivalent Mn(6)O5F octahedra,  an edgeedge with one Mn(5)O5F octahedra, and  an edgeedge with one Mn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 47-51°. In the fifth Mn site, Mn(5) is bonded to one O(5), two equivalent O(1), two equivalent O(2), and one F(1) atom to form MnO5F octahedra that share corners with two equivalent Mn(6)O5F octahedra, corners with three equivalent Mn(2)O5F octahedra, corners with three equivalent Mn(3)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra, and  an edgeedge with one Mn(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 48-52°. In the sixth Mn site, Mn(6) is bonded to one O(4), one O(5), one O(7), two equivalent O(8), and one F(1) atom to form MnO5F octahedra that share corners with two equivalent Mn(5)O5F octahedra, corners with three equivalent Mn(1)O6 octahedra, corners with three equivalent Mn(4)O6 octahedra,  an edgeedge with one Mn(2)O5F octahedra, and  an edgeedge with one Mn(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 49-53°. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one Mn(1), one Mn(3), and one Mn(5) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one Mn(2), one Mn(4), and one Mn(5) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Mn(1), one Mn(2), and one Mn(3) atom. In the fourth O site, O(4) is bonded in a trigonal planar geometry to one Mn(3), one Mn(4), and one Mn(6) atom. In the fifth O site, O(5) is bonded in a trigonal planar geometry to one Mn(3), one Mn(5), and one Mn(6) atom. In the sixth O site, O(6) is bonded in a distorted trigonal planar geometry to one Mn(2), one Mn(3), and one Mn(4) atom. In the seventh O site, O(7) is bonded in a trigonal planar geometry to one Mn(1), one Mn(2), and one Mn(6) atom. In the eighth O site, O(8) is bonded in a trigonal planar geometry to one Mn(1), one Mn(4), and one Mn(6) atom. F(1) is bonded in a distorted trigonal planar geometry to one Mn(2), one Mn(5), and one Mn(6) atom. is represented by the CIF card [CIF]
data_Mn6O11F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.393
_cell_length_b   5.393
_cell_length_c   7.087
_cell_angle_alpha   71.963
_cell_angle_beta   71.963
_cell_angle_gamma   71.678
_symmetry_Int_Tables_number   1
_cell_volume   180.844
_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  0.332  0.332  0.166  1.0
  Mn  Mn1  1  0.344  0.344  0.668  1.0
  Mn  Mn2  1  0.662  0.662  0.331  1.0
  Mn  Mn3  1  0.669  0.669  0.838  1.0
  Mn  Mn4  1  0.994  0.994  0.489  1.0
  Mn  Mn5  1  0.999  0.999  0.010  1.0
  O  O6  1  0.972  0.360  0.336  1.0
  O  O7  1  0.639  0.029  0.665  1.0
  O  O8  1  0.435  0.435  0.371  1.0
  O  O9  1  0.768  0.768  0.039  1.0
  O  O10  1  0.894  0.894  0.298  1.0
  O  O11  1  0.568  0.568  0.629  1.0
  O  O12  1  0.233  0.233  0.962  1.0
  O  O13  1  0.694  0.304  0.999  1.0
  O  O14  1  0.029  0.639  0.665  1.0
  O  O15  1  0.360  0.972  0.336  1.0
  O  O16  1  0.304  0.694  0.999  1.0
  F  F17  1  0.103  0.103  0.700  1.0
[/CIF]
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