The crystal structure described by Sr5La2Mn8(O3F)6 is Orthorhombic Perovskite-derived structured and crystallizes in the triclinic P1 space group. There are five inequivalent Sr sites. In the first Sr site, Sr(1) is bonded in a 12-coordinate geometry to one O(12), one O(14), one O(16), one O(3), one O(5), one O(7), two equivalent O(17), two equivalent O(9), one F(2), and one F(5) atom. In the second Sr site, Sr(2) is bonded in a 11-coordinate geometry to one O(11), one O(12), one O(15), one O(3), one O(4), one O(7), two equivalent O(1), one F(3), one F(4), and one F(5) atom. In the third Sr site, Sr(3) is bonded in a 12-coordinate geometry to one O(13), one O(14), one O(16), one O(5), one O(6), two equivalent O(10), two equivalent O(2), one F(1), one F(2), and one F(6) atom. In the fourth Sr site, Sr(4) is bonded in a 12-coordinate geometry to one O(13), one O(15), one O(4), one O(6), two equivalent O(18), two equivalent O(8), one F(1), one F(3), one F(4), and one F(6) atom. In the fifth Sr site, Sr(5) is bonded in a 12-coordinate geometry to one O(12), one O(14), one O(16), one O(3), one O(5), one O(7), two equivalent O(17), two equivalent O(9), one F(2), and one F(5) atom. There are two inequivalent La sites. In the first La site, La(1) is bonded in a 11-coordinate geometry to one O(1), one O(12), one O(15), one O(3), one O(4), one O(7), two equivalent O(11), one F(3), one F(4), and one F(5) atom. In the second La site, La(2) is bonded in a 12-coordinate geometry to one O(13), one O(14), one O(16), one O(5), one O(6), two equivalent O(10), two equivalent O(2), one F(1), one F(2), and one F(6) atom. There are eight inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(13), one O(18), one O(2), one O(6), one F(1), and one F(6) atom to form MnO4F2 octahedra that share  a cornercorner with one Mn(6)O4F2 octahedra,  a cornercorner with one Mn(8)O5F octahedra, and corners with four equivalent Mn(4)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 9-24°. In the second Mn site, Mn(2) is bonded to one O(11), one O(15), one O(4), one O(8), one F(3), and one F(4) atom to form MnO4F2 octahedra that share  a cornercorner with one Mn(4)O4F2 octahedra,  a cornercorner with one Mn(5)O5F octahedra, and corners with four equivalent Mn(6)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 5-23°. In the third Mn site, Mn(3) is bonded to one O(10), one O(14), one O(16), one O(5), one O(9), and one F(2) atom to form MnO5F octahedra that share  a cornercorner with one Mn(4)O4F2 octahedra,  a cornercorner with one Mn(5)O5F octahedra, and corners with four equivalent Mn(8)O5F octahedra. The corner-sharing octahedral tilt angles range from 12-19°. In the fourth Mn site, Mn(4) is bonded to one O(10), one O(13), one O(6), one O(8), one F(1), and one F(6) atom to form MnO4F2 octahedra that share  a cornercorner with one Mn(2)O4F2 octahedra,  a cornercorner with one Mn(3)O5F octahedra, and corners with four equivalent Mn(1)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 9-24°. In the fifth Mn site, Mn(5) is bonded to one O(11), one O(12), one O(3), one O(7), one O(9), and one F(5) atom to form MnO5F octahedra that share  a cornercorner with one Mn(2)O4F2 octahedra,  a cornercorner with one Mn(3)O5F octahedra, and corners with four equivalent Mn(7)O5F octahedra. The corner-sharing octahedral tilt angles range from 9-19°. In the sixth Mn site, Mn(6) is bonded to one O(1), one O(15), one O(18), one O(4), one F(3), and one F(4) atom to form MnO4F2 octahedra that share  a cornercorner with one Mn(1)O4F2 octahedra,  a cornercorner with one Mn(7)O5F octahedra, and corners with four equivalent Mn(2)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 5-24°. In the seventh Mn site, Mn(7) is bonded to one O(1), one O(12), one O(17), one O(3), one O(7), and one F(5) atom to form MnO5F octahedra that share  a cornercorner with one Mn(6)O4F2 octahedra,  a cornercorner with one Mn(8)O5F octahedra, and corners with four equivalent Mn(5)O5F octahedra. The corner-sharing octahedral tilt angles range from 9-24°. In the eighth Mn site, Mn(8) is bonded to one O(14), one O(16), one O(17), one O(2), one O(5), and one F(2) atom to form MnO5F octahedra that share  a cornercorner with one Mn(1)O4F2 octahedra,  a cornercorner with one Mn(7)O5F octahedra, and corners with four equivalent Mn(3)O5F octahedra. The corner-sharing octahedral tilt angles range from 12-23°. There are eighteen inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to two equivalent Sr(2), one La(1), one Mn(6), and one Mn(7) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to two equivalent Sr(3), two equivalent La(2), one Mn(1), and one Mn(8) atom. In the third O site, O(3) is bonded in a 2-coordinate geometry to one Sr(1), one Sr(2), one Sr(5), one La(1), one Mn(5), and one Mn(7) atom. In the fourth O site, O(4) is bonded in a 4-coordinate geometry to one Sr(2), one Sr(4), one La(1), one Mn(2), and one Mn(6) atom. In the fifth O site, O(5) is bonded in a 2-coordinate geometry to one Sr(1), one Sr(3), one Sr(5), one La(2), one Mn(3), and one Mn(8) atom. In the sixth O site, O(6) is bonded in a 2-coordinate geometry to one Sr(3), one Sr(4), one La(2), one Mn(1), and one Mn(4) atom. In the seventh O site, O(7) is bonded in a 2-coordinate geometry to one Sr(1), one Sr(2), one Sr(5), one La(1), one Mn(5), and one Mn(7) atom. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to two equivalent Sr(4), one Mn(2), and one Mn(4) atom. In the ninth O site, O(9) is bonded in a 2-coordinate geometry to two equivalent Sr(1), two equivalent Sr(5), one Mn(3), and one Mn(5) atom. In the tenth O site, O(10) is bonded in a 4-coordinate geometry to two equivalent Sr(3), two equivalent La(2), one Mn(3), and one Mn(4) atom. In the eleventh O site, O(11) is bonded in a 2-coordinate geometry to one Sr(2), two equivalent La(1), one Mn(2), and one Mn(5) atom. In the twelfth O site, O(12) is bonded in a 6-coordinate geometry to one Sr(1), one Sr(2), one Sr(5), one La(1), one Mn(5), and one Mn(7) atom. In the thirteenth O site, O(13) is bonded in a 5-coordinate geometry to one Sr(3), one Sr(4), one La(2), one Mn(1), and one Mn(4) atom. In the fourteenth O site, O(14) is bonded in a 2-coordinate geometry to one Sr(1), one Sr(3), one Sr(5), one La(2), one Mn(3), and one Mn(8) atom. In the fifteenth O site, O(15) is bonded in a 5-coordinate geometry to one Sr(2), one Sr(4), one La(1), one Mn(2), and one Mn(6) atom. In the sixteenth O site, O(16) is bonded in a 6-coordinate geometry to one Sr(1), one Sr(3), one Sr(5), one La(2), one Mn(3), and one Mn(8) atom. In the seventeenth O site, O(17) is bonded in a 2-coordinate geometry to two equivalent Sr(1), two equivalent Sr(5), one Mn(7), and one Mn(8) atom. In the eighteenth O site, O(18) is bonded in a distorted bent 150 degrees geometry to two equivalent Sr(4), one Mn(1), and one Mn(6) atom. There are six inequivalent F sites. In the first F site, F(1) is bonded in a 4-coordinate geometry to one Sr(3), one Sr(4), one La(2), one Mn(1), and one Mn(4) atom. In the second F site, F(2) is bonded in a 6-coordinate geometry to one Sr(1), one Sr(3), one Sr(5), one La(2), one Mn(3), and one Mn(8) atom. In the third F site, F(3) is bonded in a 5-coordinate geometry to one Sr(2), one Sr(4), one La(1), one Mn(2), and one Mn(6) atom. In the fourth F site, F(4) is bonded in a 5-coordinate geometry to one Sr(2), one Sr(4), one La(1), one Mn(2), and one Mn(6) atom. In the fifth F site, F(5) is bonded in a 6-coordinate geometry to one Sr(1), one Sr(2), one Sr(5), one La(1), one Mn(5), and one Mn(7) atom. In the sixth F site, F(6) is bonded in a 2-coordinate geometry to one Sr(3), one Sr(4), one La(2), one Mn(1), and one Mn(4) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Sr5La2Mn8(O3F)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.634
_cell_length_b   5.694
_cell_length_c   15.327
_cell_angle_alpha   89.953
_cell_angle_beta   89.965
_cell_angle_gamma   89.892
_symmetry_Int_Tables_number   1
_cell_volume   491.681
_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
  Sr  Sr0  1  0.995  0.493  0.625  1.0
  Sr  Sr1  1  0.504  0.994  0.375  1.0
  Sr  Sr2  1  0.505  0.995  0.875  1.0
  Sr  Sr3  1  0.494  0.004  0.124  1.0
  Sr  Sr4  1  0.494  0.002  0.624  1.0
  La  La5  1  0.995  0.501  0.371  1.0
  La  La6  1  0.026  0.500  0.879  1.0
  Mn  Mn7  1  0.996  0.997  0.005  1.0
  Mn  Mn8  1  0.502  0.501  0.244  1.0
  Mn  Mn9  1  0.491  0.488  0.751  1.0
  Mn  Mn10  1  0.502  0.502  0.006  1.0
  Mn  Mn11  1  0.511  0.488  0.498  1.0
  Mn  Mn12  1  0.004  0.997  0.245  1.0
  Mn  Mn13  1  0.986  0.010  0.498  1.0
  Mn  Mn14  1  0.014  0.010  0.751  1.0
  O  O15  1  0.000  0.932  0.374  1.0
  O  O16  1  0.003  0.933  0.876  1.0
  O  O17  1  0.756  0.257  0.482  1.0
  O  O18  1  0.756  0.253  0.271  1.0
  O  O19  1  0.771  0.272  0.769  1.0
  O  O20  1  0.727  0.771  0.005  1.0
  O  O21  1  0.750  0.748  0.509  1.0
  O  O22  1  0.504  0.436  0.125  1.0
  O  O23  1  0.505  0.449  0.625  1.0
  O  O24  1  0.482  0.552  0.876  1.0
  O  O25  1  0.495  0.550  0.374  1.0
  O  O26  1  0.240  0.258  0.483  1.0
  O  O27  1  0.255  0.242  0.981  1.0
  O  O28  1  0.256  0.247  0.765  1.0
  O  O29  1  0.262  0.760  0.244  1.0
  O  O30  1  0.238  0.738  0.740  1.0
  O  O31  1  0.996  0.047  0.625  1.0
  O  O32  1  1.000  0.059  0.125  1.0
  F  F33  1  0.756  0.257  0.978  1.0
  F  F34  1  0.737  0.763  0.737  1.0
  F  F35  1  0.747  0.757  0.237  1.0
  F  F36  1  0.256  0.245  0.269  1.0
  F  F37  1  0.249  0.750  0.514  1.0
  F  F38  1  0.241  0.743  0.016  1.0
[/CIF]
.
The crystal structure described by Sr5La2Mn8(O3F)6 is Orthorhombic Perovskite-derived structured and crystallizes in the triclinic P1 space group. There are five inequivalent Sr sites. In the first Sr site, Sr(1) is bonded in a 12-coordinate geometry to one O(12), one O(14), one O(16), one O(3), one O(5), one O(7), two equivalent O(17), two equivalent O(9), one F(2), and one F(5) atom. In the second Sr site, Sr(2) is bonded in a 11-coordinate geometry to one O(11), one O(12), one O(15), one O(3), one O(4), one O(7), two equivalent O(1), one F(3), one F(4), and one F(5) atom. In the third Sr site, Sr(3) is bonded in a 12-coordinate geometry to one O(13), one O(14), one O(16), one O(5), one O(6), two equivalent O(10), two equivalent O(2), one F(1), one F(2), and one F(6) atom. In the fourth Sr site, Sr(4) is bonded in a 12-coordinate geometry to one O(13), one O(15), one O(4), one O(6), two equivalent O(18), two equivalent O(8), one F(1), one F(3), one F(4), and one F(6) atom. In the fifth Sr site, Sr(5) is bonded in a 12-coordinate geometry to one O(12), one O(14), one O(16), one O(3), one O(5), one O(7), two equivalent O(17), two equivalent O(9), one F(2), and one F(5) atom. There are two inequivalent La sites. In the first La site, La(1) is bonded in a 11-coordinate geometry to one O(1), one O(12), one O(15), one O(3), one O(4), one O(7), two equivalent O(11), one F(3), one F(4), and one F(5) atom. In the second La site, La(2) is bonded in a 12-coordinate geometry to one O(13), one O(14), one O(16), one O(5), one O(6), two equivalent O(10), two equivalent O(2), one F(1), one F(2), and one F(6) atom. There are eight inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(13), one O(18), one O(2), one O(6), one F(1), and one F(6) atom to form MnO4F2 octahedra that share  a cornercorner with one Mn(6)O4F2 octahedra,  a cornercorner with one Mn(8)O5F octahedra, and corners with four equivalent Mn(4)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 9-24°. In the second Mn site, Mn(2) is bonded to one O(11), one O(15), one O(4), one O(8), one F(3), and one F(4) atom to form MnO4F2 octahedra that share  a cornercorner with one Mn(4)O4F2 octahedra,  a cornercorner with one Mn(5)O5F octahedra, and corners with four equivalent Mn(6)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 5-23°. In the third Mn site, Mn(3) is bonded to one O(10), one O(14), one O(16), one O(5), one O(9), and one F(2) atom to form MnO5F octahedra that share  a cornercorner with one Mn(4)O4F2 octahedra,  a cornercorner with one Mn(5)O5F octahedra, and corners with four equivalent Mn(8)O5F octahedra. The corner-sharing octahedral tilt angles range from 12-19°. In the fourth Mn site, Mn(4) is bonded to one O(10), one O(13), one O(6), one O(8), one F(1), and one F(6) atom to form MnO4F2 octahedra that share  a cornercorner with one Mn(2)O4F2 octahedra,  a cornercorner with one Mn(3)O5F octahedra, and corners with four equivalent Mn(1)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 9-24°. In the fifth Mn site, Mn(5) is bonded to one O(11), one O(12), one O(3), one O(7), one O(9), and one F(5) atom to form MnO5F octahedra that share  a cornercorner with one Mn(2)O4F2 octahedra,  a cornercorner with one Mn(3)O5F octahedra, and corners with four equivalent Mn(7)O5F octahedra. The corner-sharing octahedral tilt angles range from 9-19°. In the sixth Mn site, Mn(6) is bonded to one O(1), one O(15), one O(18), one O(4), one F(3), and one F(4) atom to form MnO4F2 octahedra that share  a cornercorner with one Mn(1)O4F2 octahedra,  a cornercorner with one Mn(7)O5F octahedra, and corners with four equivalent Mn(2)O4F2 octahedra. The corner-sharing octahedral tilt angles range from 5-24°. In the seventh Mn site, Mn(7) is bonded to one O(1), one O(12), one O(17), one O(3), one O(7), and one F(5) atom to form MnO5F octahedra that share  a cornercorner with one Mn(6)O4F2 octahedra,  a cornercorner with one Mn(8)O5F octahedra, and corners with four equivalent Mn(5)O5F octahedra. The corner-sharing octahedral tilt angles range from 9-24°. In the eighth Mn site, Mn(8) is bonded to one O(14), one O(16), one O(17), one O(2), one O(5), and one F(2) atom to form MnO5F octahedra that share  a cornercorner with one Mn(1)O4F2 octahedra,  a cornercorner with one Mn(7)O5F octahedra, and corners with four equivalent Mn(3)O5F octahedra. The corner-sharing octahedral tilt angles range from 12-23°. There are eighteen inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to two equivalent Sr(2), one La(1), one Mn(6), and one Mn(7) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to two equivalent Sr(3), two equivalent La(2), one Mn(1), and one Mn(8) atom. In the third O site, O(3) is bonded in a 2-coordinate geometry to one Sr(1), one Sr(2), one Sr(5), one La(1), one Mn(5), and one Mn(7) atom. In the fourth O site, O(4) is bonded in a 4-coordinate geometry to one Sr(2), one Sr(4), one La(1), one Mn(2), and one Mn(6) atom. In the fifth O site, O(5) is bonded in a 2-coordinate geometry to one Sr(1), one Sr(3), one Sr(5), one La(2), one Mn(3), and one Mn(8) atom. In the sixth O site, O(6) is bonded in a 2-coordinate geometry to one Sr(3), one Sr(4), one La(2), one Mn(1), and one Mn(4) atom. In the seventh O site, O(7) is bonded in a 2-coordinate geometry to one Sr(1), one Sr(2), one Sr(5), one La(1), one Mn(5), and one Mn(7) atom. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to two equivalent Sr(4), one Mn(2), and one Mn(4) atom. In the ninth O site, O(9) is bonded in a 2-coordinate geometry to two equivalent Sr(1), two equivalent Sr(5), one Mn(3), and one Mn(5) atom. In the tenth O site, O(10) is bonded in a 4-coordinate geometry to two equivalent Sr(3), two equivalent La(2), one Mn(3), and one Mn(4) atom. In the eleventh O site, O(11) is bonded in a 2-coordinate geometry to one Sr(2), two equivalent La(1), one Mn(2), and one Mn(5) atom. In the twelfth O site, O(12) is bonded in a 6-coordinate geometry to one Sr(1), one Sr(2), one Sr(5), one La(1), one Mn(5), and one Mn(7) atom. In the thirteenth O site, O(13) is bonded in a 5-coordinate geometry to one Sr(3), one Sr(4), one La(2), one Mn(1), and one Mn(4) atom. In the fourteenth O site, O(14) is bonded in a 2-coordinate geometry to one Sr(1), one Sr(3), one Sr(5), one La(2), one Mn(3), and one Mn(8) atom. In the fifteenth O site, O(15) is bonded in a 5-coordinate geometry to one Sr(2), one Sr(4), one La(1), one Mn(2), and one Mn(6) atom. In the sixteenth O site, O(16) is bonded in a 6-coordinate geometry to one Sr(1), one Sr(3), one Sr(5), one La(2), one Mn(3), and one Mn(8) atom. In the seventeenth O site, O(17) is bonded in a 2-coordinate geometry to two equivalent Sr(1), two equivalent Sr(5), one Mn(7), and one Mn(8) atom. In the eighteenth O site, O(18) is bonded in a distorted bent 150 degrees geometry to two equivalent Sr(4), one Mn(1), and one Mn(6) atom. There are six inequivalent F sites. In the first F site, F(1) is bonded in a 4-coordinate geometry to one Sr(3), one Sr(4), one La(2), one Mn(1), and one Mn(4) atom. In the second F site, F(2) is bonded in a 6-coordinate geometry to one Sr(1), one Sr(3), one Sr(5), one La(2), one Mn(3), and one Mn(8) atom. In the third F site, F(3) is bonded in a 5-coordinate geometry to one Sr(2), one Sr(4), one La(1), one Mn(2), and one Mn(6) atom. In the fourth F site, F(4) is bonded in a 5-coordinate geometry to one Sr(2), one Sr(4), one La(1), one Mn(2), and one Mn(6) atom. In the fifth F site, F(5) is bonded in a 6-coordinate geometry to one Sr(1), one Sr(2), one Sr(5), one La(1), one Mn(5), and one Mn(7) atom. In the sixth F site, F(6) is bonded in a 2-coordinate geometry to one Sr(3), one Sr(4), one La(2), one Mn(1), and one Mn(4) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Sr5La2Mn8(O3F)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.634
_cell_length_b   5.694
_cell_length_c   15.327
_cell_angle_alpha   89.953
_cell_angle_beta   89.965
_cell_angle_gamma   89.892
_symmetry_Int_Tables_number   1
_cell_volume   491.681
_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
  Sr  Sr0  1  0.995  0.493  0.625  1.0
  Sr  Sr1  1  0.504  0.994  0.375  1.0
  Sr  Sr2  1  0.505  0.995  0.875  1.0
  Sr  Sr3  1  0.494  0.004  0.124  1.0
  Sr  Sr4  1  0.494  0.002  0.624  1.0
  La  La5  1  0.995  0.501  0.371  1.0
  La  La6  1  0.026  0.500  0.879  1.0
  Mn  Mn7  1  0.996  0.997  0.005  1.0
  Mn  Mn8  1  0.502  0.501  0.244  1.0
  Mn  Mn9  1  0.491  0.488  0.751  1.0
  Mn  Mn10  1  0.502  0.502  0.006  1.0
  Mn  Mn11  1  0.511  0.488  0.498  1.0
  Mn  Mn12  1  0.004  0.997  0.245  1.0
  Mn  Mn13  1  0.986  0.010  0.498  1.0
  Mn  Mn14  1  0.014  0.010  0.751  1.0
  O  O15  1  0.000  0.932  0.374  1.0
  O  O16  1  0.003  0.933  0.876  1.0
  O  O17  1  0.756  0.257  0.482  1.0
  O  O18  1  0.756  0.253  0.271  1.0
  O  O19  1  0.771  0.272  0.769  1.0
  O  O20  1  0.727  0.771  0.005  1.0
  O  O21  1  0.750  0.748  0.509  1.0
  O  O22  1  0.504  0.436  0.125  1.0
  O  O23  1  0.505  0.449  0.625  1.0
  O  O24  1  0.482  0.552  0.876  1.0
  O  O25  1  0.495  0.550  0.374  1.0
  O  O26  1  0.240  0.258  0.483  1.0
  O  O27  1  0.255  0.242  0.981  1.0
  O  O28  1  0.256  0.247  0.765  1.0
  O  O29  1  0.262  0.760  0.244  1.0
  O  O30  1  0.238  0.738  0.740  1.0
  O  O31  1  0.996  0.047  0.625  1.0
  O  O32  1  1.000  0.059  0.125  1.0
  F  F33  1  0.756  0.257  0.978  1.0
  F  F34  1  0.737  0.763  0.737  1.0
  F  F35  1  0.747  0.757  0.237  1.0
  F  F36  1  0.256  0.245  0.269  1.0
  F  F37  1  0.249  0.750  0.514  1.0
  F  F38  1  0.241  0.743  0.016  1.0
[/CIF]
.