The material structure described by Ca4La4Mn7NiO24 is Orthorhombic Perovskite-derived structured and crystallizes in the triclinic P1 space group. There are four inequivalent Ca sites. In the first Ca site, Ca(1) is bonded in a 8-coordinate geometry to one O(10), one O(13), one O(17), one O(18), one O(2), one O(4), one O(6), and one O(9) atom. In the second Ca site, Ca(2) is bonded in a 8-coordinate geometry to one O(10), one O(11), one O(16), one O(17), one O(20), one O(22), one O(24), and one O(8) atom. In the third Ca site, Ca(3) is bonded in a 6-coordinate geometry to one O(13), one O(15), one O(16), one O(19), one O(2), one O(22), one O(3), and one O(5) atom. In the fourth Ca site, Ca(4) is bonded in a 8-coordinate geometry to one O(1), one O(14), one O(17), one O(18), one O(20), one O(21), one O(4), and one O(6) atom. There are four inequivalent La sites. In the first La site, La(1) is bonded in a 12-coordinate geometry to one O(16), one O(17), one O(19), one O(21), one O(23), one O(24), one O(4), one O(5), one O(7), one O(9), and two equivalent O(11) atoms. In the second La site, La(2) is bonded in a 12-coordinate geometry to one O(10), one O(15), one O(18), one O(20), one O(22), one O(23), one O(24), one O(3), one O(6), one O(8), and two equivalent O(12) atoms. In the third La site, La(3) is bonded in a 6-coordinate geometry to one O(1), one O(14), one O(15), one O(16), one O(3), one O(5), one O(7), and one O(8) atom. In the fourth La site, La(4) is bonded in a 9-coordinate geometry to one O(12), one O(15), one O(18), one O(19), one O(21), one O(7), one O(9), and two equivalent O(23) atoms. There are seven inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(1), one O(16), one O(20), one O(24), one O(5), and one O(8) atom to form MnO6 octahedra that share  a cornercorner with one Mn(7)O6 octahedra,  a cornercorner with one Ni(1)O6 octahedra, corners with two equivalent Mn(3)O6 octahedra, and corners with two equivalent Mn(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 20-25°. In the second Mn site, Mn(2) is bonded to one O(18), one O(19), one O(2), one O(23), one O(6), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Mn(7)O6 octahedra,  a cornercorner with one Ni(1)O6 octahedra, corners with two equivalent Mn(3)O6 octahedra, and corners with two equivalent Mn(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 19-28°. In the third Mn site, Mn(3) is bonded to one O(11), one O(13), one O(16), one O(19), one O(5), and one O(9) atom to form corner-sharing MnO6 octahedra. The corner-sharing octahedral tilt angles range from 20-27°. In the fourth Mn site, Mn(4) is bonded to one O(12), one O(14), one O(18), one O(20), one O(6), and one O(8) atom to form corner-sharing MnO6 octahedra. The corner-sharing octahedral tilt angles range from 19-24°. In the fifth Mn site, Mn(5) is bonded to one O(10), one O(12), one O(13), one O(15), one O(22), and one O(3) atom to form MnO6 octahedra that share  a cornercorner with one Mn(3)O6 octahedra,  a cornercorner with one Mn(4)O6 octahedra, corners with two equivalent Mn(7)O6 octahedra, and corners with two equivalent Ni(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 17-27°. In the sixth Mn site, Mn(6) is bonded to one O(11), one O(14), one O(17), one O(21), one O(4), and one O(7) atom to form MnO6 octahedra that share  a cornercorner with one Mn(3)O6 octahedra,  a cornercorner with one Mn(4)O6 octahedra, corners with two equivalent Mn(7)O6 octahedra, and corners with two equivalent Ni(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 20-24°. In the seventh Mn site, Mn(7) is bonded to one O(10), one O(17), one O(2), one O(22), one O(24), and one O(4) atom to form corner-sharing MnO6 octahedra. The corner-sharing octahedral tilt angles range from 22-28°. Ni(1) is bonded to one O(1), one O(15), one O(21), one O(23), one O(3), and one O(7) atom to form NiO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra, corners with two equivalent Mn(5)O6 octahedra, and corners with two equivalent Mn(6)O6 octahedra. The corner-sharing octahedral tilt angles range from 17-25°. There are twenty-four inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to one Ca(4), one La(3), one Mn(1), and one Ni(1) atom. In the second O site, O(2) is bonded in a 4-coordinate geometry to one Ca(1), one Ca(3), one Mn(2), and one Mn(7) atom. In the third O site, O(3) is bonded in a 5-coordinate geometry to one Ca(3), one La(2), one La(3), one Mn(5), and one Ni(1) atom. In the fourth O site, O(4) is bonded in a 5-coordinate geometry to one Ca(1), one Ca(4), one La(1), one Mn(6), and one Mn(7) atom. In the fifth O site, O(5) is bonded in a 5-coordinate geometry to one Ca(3), one La(1), one La(3), one Mn(1), and one Mn(3) atom. In the sixth O site, O(6) is bonded in a 5-coordinate geometry to one Ca(1), one Ca(4), one La(2), one Mn(2), and one Mn(4) atom. In the seventh O site, O(7) is bonded in a 5-coordinate geometry to one La(1), one La(3), one La(4), one Mn(6), and one Ni(1) atom. In the eighth O site, O(8) is bonded in a 5-coordinate geometry to one Ca(2), one La(2), one La(3), one Mn(1), and one Mn(4) atom. In the ninth O site, O(9) is bonded in a 5-coordinate geometry to one Ca(1), one La(1), one La(4), one Mn(2), and one Mn(3) atom. In the tenth O site, O(10) is bonded in a 5-coordinate geometry to one Ca(1), one Ca(2), one La(2), one Mn(5), and one Mn(7) atom. In the eleventh O site, O(11) is bonded in a 3-coordinate geometry to one Ca(2), two equivalent La(1), one Mn(3), and one Mn(6) atom. In the twelfth O site, O(12) is bonded in a 4-coordinate geometry to one La(4), two equivalent La(2), one Mn(4), and one Mn(5) atom. In the thirteenth O site, O(13) is bonded in a 4-coordinate geometry to one Ca(1), one Ca(3), one Mn(3), and one Mn(5) atom. In the fourteenth O site, O(14) is bonded in a 4-coordinate geometry to one Ca(4), one La(3), one Mn(4), and one Mn(6) atom. In the fifteenth O site, O(15) is bonded in a 5-coordinate geometry to one Ca(3), one La(2), one La(3), one La(4), one Mn(5), and one Ni(1) atom. In the sixteenth O site, O(16) is bonded in a 2-coordinate geometry to one Ca(2), one Ca(3), one La(1), one La(3), one Mn(1), and one Mn(3) atom. In the seventeenth O site, O(17) is bonded in a 5-coordinate geometry to one Ca(1), one Ca(2), one Ca(4), one La(1), one Mn(6), and one Mn(7) atom. In the eighteenth O site, O(18) is bonded in a 5-coordinate geometry to one Ca(1), one Ca(4), one La(2), one La(4), one Mn(2), and one Mn(4) atom. In the nineteenth O site, O(19) is bonded in a 5-coordinate geometry to one Ca(3), one La(1), one La(4), one Mn(2), and one Mn(3) atom. In the twentieth O site, O(20) is bonded in a 2-coordinate geometry to one Ca(2), one Ca(4), one La(2), one Mn(1), and one Mn(4) atom. In the twenty-first O site, O(21) is bonded in a 5-coordinate geometry to one Ca(4), one La(1), one La(4), one Mn(6), and one Ni(1) atom. In the twenty-second O site, O(22) is bonded in a 5-coordinate geometry to one Ca(2), one Ca(3), one La(2), one Mn(5), and one Mn(7) atom. In the twenty-third O site, O(23) is bonded in a 4-coordinate geometry to one La(1), one La(2), two equivalent La(4), one Mn(2), and one Ni(1) atom. In the twenty-fourth O site, O(24) is bonded in a 4-coordinate geometry to one Ca(2), one La(1), one La(2), one Mn(1), and one Mn(7) atom. is represented by the CIF card [CIF]
data_Ca4La4Mn7NiO24
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.477
_cell_length_b   9.455
_cell_length_c   9.466
_cell_angle_alpha   70.721
_cell_angle_beta   89.928
_cell_angle_gamma   89.959
_symmetry_Int_Tables_number   1
_cell_volume   462.660
_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
  Ca  Ca0  1  0.468  0.620  0.134  1.0
  Ca  Ca1  1  0.533  0.879  0.367  1.0
  Ca  Ca2  1  0.969  0.880  0.872  1.0
  Ca  Ca3  1  0.968  0.381  0.370  1.0
  La  La4  1  0.020  0.623  0.624  1.0
  La  La5  1  0.022  0.121  0.127  1.0
  La  La6  1  0.478  0.124  0.629  1.0
  La  La7  1  0.522  0.376  0.872  1.0
  Mn  Mn8  1  0.001  0.002  0.500  1.0
  Mn  Mn9  1  1.000  0.503  0.004  1.0
  Mn  Mn10  1  0.500  0.752  0.752  1.0
  Mn  Mn11  1  0.500  0.252  0.252  1.0
  Mn  Mn12  1  0.499  0.991  0.001  1.0
  Mn  Mn13  1  0.501  0.505  0.496  1.0
  Mn  Mn14  1  0.001  0.748  0.248  1.0
  Ni  Ni15  1  0.001  0.248  0.748  1.0
  O  O16  1  0.012  0.160  0.581  1.0
  O  O17  1  0.022  0.667  0.085  1.0
  O  O18  1  0.234  0.086  0.875  1.0
  O  O19  1  0.215  0.590  0.369  1.0
  O  O20  1  0.224  0.883  0.661  1.0
  O  O21  1  0.221  0.379  0.158  1.0
  O  O22  1  0.281  0.388  0.650  1.0
  O  O23  1  0.279  0.089  0.369  1.0
  O  O24  1  0.273  0.594  0.863  1.0
  O  O25  1  0.276  0.881  0.163  1.0
  O  O26  1  0.491  0.665  0.586  1.0
  O  O27  1  0.494  0.157  0.091  1.0
  O  O28  1  0.520  0.833  0.918  1.0
  O  O29  1  0.514  0.341  0.411  1.0
  O  O30  1  0.719  0.113  0.852  1.0
  O  O31  1  0.728  0.906  0.635  1.0
  O  O32  1  0.725  0.620  0.338  1.0
  O  O33  1  0.721  0.409  0.129  1.0
  O  O34  1  0.771  0.615  0.842  1.0
  O  O35  1  0.774  0.117  0.345  1.0
  O  O36  1  0.762  0.410  0.629  1.0
  O  O37  1  0.779  0.906  0.135  1.0
  O  O38  1  0.994  0.347  0.912  1.0
  O  O39  1  0.985  0.840  0.408  1.0
[/CIF]
.
The material structure described by Ca4La4Mn7NiO24 is Orthorhombic Perovskite-derived structured and crystallizes in the triclinic P1 space group. There are four inequivalent Ca sites. In the first Ca site, Ca(1) is bonded in a 8-coordinate geometry to one O(10), one O(13), one O(17), one O(18), one O(2), one O(4), one O(6), and one O(9) atom. In the second Ca site, Ca(2) is bonded in a 8-coordinate geometry to one O(10), one O(11), one O(16), one O(17), one O(20), one O(22), one O(24), and one O(8) atom. In the third Ca site, Ca(3) is bonded in a 6-coordinate geometry to one O(13), one O(15), one O(16), one O(19), one O(2), one O(22), one O(3), and one O(5) atom. In the fourth Ca site, Ca(4) is bonded in a 8-coordinate geometry to one O(1), one O(14), one O(17), one O(18), one O(20), one O(21), one O(4), and one O(6) atom. There are four inequivalent La sites. In the first La site, La(1) is bonded in a 12-coordinate geometry to one O(16), one O(17), one O(19), one O(21), one O(23), one O(24), one O(4), one O(5), one O(7), one O(9), and two equivalent O(11) atoms. In the second La site, La(2) is bonded in a 12-coordinate geometry to one O(10), one O(15), one O(18), one O(20), one O(22), one O(23), one O(24), one O(3), one O(6), one O(8), and two equivalent O(12) atoms. In the third La site, La(3) is bonded in a 6-coordinate geometry to one O(1), one O(14), one O(15), one O(16), one O(3), one O(5), one O(7), and one O(8) atom. In the fourth La site, La(4) is bonded in a 9-coordinate geometry to one O(12), one O(15), one O(18), one O(19), one O(21), one O(7), one O(9), and two equivalent O(23) atoms. There are seven inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(1), one O(16), one O(20), one O(24), one O(5), and one O(8) atom to form MnO6 octahedra that share  a cornercorner with one Mn(7)O6 octahedra,  a cornercorner with one Ni(1)O6 octahedra, corners with two equivalent Mn(3)O6 octahedra, and corners with two equivalent Mn(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 20-25°. In the second Mn site, Mn(2) is bonded to one O(18), one O(19), one O(2), one O(23), one O(6), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Mn(7)O6 octahedra,  a cornercorner with one Ni(1)O6 octahedra, corners with two equivalent Mn(3)O6 octahedra, and corners with two equivalent Mn(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 19-28°. In the third Mn site, Mn(3) is bonded to one O(11), one O(13), one O(16), one O(19), one O(5), and one O(9) atom to form corner-sharing MnO6 octahedra. The corner-sharing octahedral tilt angles range from 20-27°. In the fourth Mn site, Mn(4) is bonded to one O(12), one O(14), one O(18), one O(20), one O(6), and one O(8) atom to form corner-sharing MnO6 octahedra. The corner-sharing octahedral tilt angles range from 19-24°. In the fifth Mn site, Mn(5) is bonded to one O(10), one O(12), one O(13), one O(15), one O(22), and one O(3) atom to form MnO6 octahedra that share  a cornercorner with one Mn(3)O6 octahedra,  a cornercorner with one Mn(4)O6 octahedra, corners with two equivalent Mn(7)O6 octahedra, and corners with two equivalent Ni(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 17-27°. In the sixth Mn site, Mn(6) is bonded to one O(11), one O(14), one O(17), one O(21), one O(4), and one O(7) atom to form MnO6 octahedra that share  a cornercorner with one Mn(3)O6 octahedra,  a cornercorner with one Mn(4)O6 octahedra, corners with two equivalent Mn(7)O6 octahedra, and corners with two equivalent Ni(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 20-24°. In the seventh Mn site, Mn(7) is bonded to one O(10), one O(17), one O(2), one O(22), one O(24), and one O(4) atom to form corner-sharing MnO6 octahedra. The corner-sharing octahedral tilt angles range from 22-28°. Ni(1) is bonded to one O(1), one O(15), one O(21), one O(23), one O(3), and one O(7) atom to form NiO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra, corners with two equivalent Mn(5)O6 octahedra, and corners with two equivalent Mn(6)O6 octahedra. The corner-sharing octahedral tilt angles range from 17-25°. There are twenty-four inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to one Ca(4), one La(3), one Mn(1), and one Ni(1) atom. In the second O site, O(2) is bonded in a 4-coordinate geometry to one Ca(1), one Ca(3), one Mn(2), and one Mn(7) atom. In the third O site, O(3) is bonded in a 5-coordinate geometry to one Ca(3), one La(2), one La(3), one Mn(5), and one Ni(1) atom. In the fourth O site, O(4) is bonded in a 5-coordinate geometry to one Ca(1), one Ca(4), one La(1), one Mn(6), and one Mn(7) atom. In the fifth O site, O(5) is bonded in a 5-coordinate geometry to one Ca(3), one La(1), one La(3), one Mn(1), and one Mn(3) atom. In the sixth O site, O(6) is bonded in a 5-coordinate geometry to one Ca(1), one Ca(4), one La(2), one Mn(2), and one Mn(4) atom. In the seventh O site, O(7) is bonded in a 5-coordinate geometry to one La(1), one La(3), one La(4), one Mn(6), and one Ni(1) atom. In the eighth O site, O(8) is bonded in a 5-coordinate geometry to one Ca(2), one La(2), one La(3), one Mn(1), and one Mn(4) atom. In the ninth O site, O(9) is bonded in a 5-coordinate geometry to one Ca(1), one La(1), one La(4), one Mn(2), and one Mn(3) atom. In the tenth O site, O(10) is bonded in a 5-coordinate geometry to one Ca(1), one Ca(2), one La(2), one Mn(5), and one Mn(7) atom. In the eleventh O site, O(11) is bonded in a 3-coordinate geometry to one Ca(2), two equivalent La(1), one Mn(3), and one Mn(6) atom. In the twelfth O site, O(12) is bonded in a 4-coordinate geometry to one La(4), two equivalent La(2), one Mn(4), and one Mn(5) atom. In the thirteenth O site, O(13) is bonded in a 4-coordinate geometry to one Ca(1), one Ca(3), one Mn(3), and one Mn(5) atom. In the fourteenth O site, O(14) is bonded in a 4-coordinate geometry to one Ca(4), one La(3), one Mn(4), and one Mn(6) atom. In the fifteenth O site, O(15) is bonded in a 5-coordinate geometry to one Ca(3), one La(2), one La(3), one La(4), one Mn(5), and one Ni(1) atom. In the sixteenth O site, O(16) is bonded in a 2-coordinate geometry to one Ca(2), one Ca(3), one La(1), one La(3), one Mn(1), and one Mn(3) atom. In the seventeenth O site, O(17) is bonded in a 5-coordinate geometry to one Ca(1), one Ca(2), one Ca(4), one La(1), one Mn(6), and one Mn(7) atom. In the eighteenth O site, O(18) is bonded in a 5-coordinate geometry to one Ca(1), one Ca(4), one La(2), one La(4), one Mn(2), and one Mn(4) atom. In the nineteenth O site, O(19) is bonded in a 5-coordinate geometry to one Ca(3), one La(1), one La(4), one Mn(2), and one Mn(3) atom. In the twentieth O site, O(20) is bonded in a 2-coordinate geometry to one Ca(2), one Ca(4), one La(2), one Mn(1), and one Mn(4) atom. In the twenty-first O site, O(21) is bonded in a 5-coordinate geometry to one Ca(4), one La(1), one La(4), one Mn(6), and one Ni(1) atom. In the twenty-second O site, O(22) is bonded in a 5-coordinate geometry to one Ca(2), one Ca(3), one La(2), one Mn(5), and one Mn(7) atom. In the twenty-third O site, O(23) is bonded in a 4-coordinate geometry to one La(1), one La(2), two equivalent La(4), one Mn(2), and one Ni(1) atom. In the twenty-fourth O site, O(24) is bonded in a 4-coordinate geometry to one Ca(2), one La(1), one La(2), one Mn(1), and one Mn(7) atom. is represented by the CIF card [CIF]
data_Ca4La4Mn7NiO24
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.477
_cell_length_b   9.455
_cell_length_c   9.466
_cell_angle_alpha   70.721
_cell_angle_beta   89.928
_cell_angle_gamma   89.959
_symmetry_Int_Tables_number   1
_cell_volume   462.660
_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
  Ca  Ca0  1  0.468  0.620  0.134  1.0
  Ca  Ca1  1  0.533  0.879  0.367  1.0
  Ca  Ca2  1  0.969  0.880  0.872  1.0
  Ca  Ca3  1  0.968  0.381  0.370  1.0
  La  La4  1  0.020  0.623  0.624  1.0
  La  La5  1  0.022  0.121  0.127  1.0
  La  La6  1  0.478  0.124  0.629  1.0
  La  La7  1  0.522  0.376  0.872  1.0
  Mn  Mn8  1  0.001  0.002  0.500  1.0
  Mn  Mn9  1  1.000  0.503  0.004  1.0
  Mn  Mn10  1  0.500  0.752  0.752  1.0
  Mn  Mn11  1  0.500  0.252  0.252  1.0
  Mn  Mn12  1  0.499  0.991  0.001  1.0
  Mn  Mn13  1  0.501  0.505  0.496  1.0
  Mn  Mn14  1  0.001  0.748  0.248  1.0
  Ni  Ni15  1  0.001  0.248  0.748  1.0
  O  O16  1  0.012  0.160  0.581  1.0
  O  O17  1  0.022  0.667  0.085  1.0
  O  O18  1  0.234  0.086  0.875  1.0
  O  O19  1  0.215  0.590  0.369  1.0
  O  O20  1  0.224  0.883  0.661  1.0
  O  O21  1  0.221  0.379  0.158  1.0
  O  O22  1  0.281  0.388  0.650  1.0
  O  O23  1  0.279  0.089  0.369  1.0
  O  O24  1  0.273  0.594  0.863  1.0
  O  O25  1  0.276  0.881  0.163  1.0
  O  O26  1  0.491  0.665  0.586  1.0
  O  O27  1  0.494  0.157  0.091  1.0
  O  O28  1  0.520  0.833  0.918  1.0
  O  O29  1  0.514  0.341  0.411  1.0
  O  O30  1  0.719  0.113  0.852  1.0
  O  O31  1  0.728  0.906  0.635  1.0
  O  O32  1  0.725  0.620  0.338  1.0
  O  O33  1  0.721  0.409  0.129  1.0
  O  O34  1  0.771  0.615  0.842  1.0
  O  O35  1  0.774  0.117  0.345  1.0
  O  O36  1  0.762  0.410  0.629  1.0
  O  O37  1  0.779  0.906  0.135  1.0
  O  O38  1  0.994  0.347  0.912  1.0
  O  O39  1  0.985  0.840  0.408  1.0
[/CIF]
.