The crystal structure described by LiLa4WNi3O12 crystallizes in the monoclinic P2/m space group. Li(1) is bonded in a square co-planar geometry to two equivalent La(2), two equivalent O(4), and two equivalent O(6) atoms. There are two inequivalent La sites. In the first La site, La(1) is bonded to two equivalent O(1), two equivalent O(2), two equivalent O(3), two equivalent O(4), two equivalent O(5), and two equivalent O(6) atoms to form distorted LaO12 cuboctahedra that share corners with four equivalent La(1)O12 cuboctahedra, faces with two equivalent La(1)O12 cuboctahedra, faces with two equivalent W(1)O6 octahedra, faces with two equivalent Ni(1)O6 octahedra, faces with two equivalent Ni(2)O6 octahedra, and faces with two equivalent Ni(3)O6 octahedra. In the second La site, La(2) is bonded in a 9-coordinate geometry to one Li(1), two equivalent O(1), two equivalent O(2), two equivalent O(3), and two equivalent O(5) atoms. W(1) is bonded to two equivalent O(2), two equivalent O(4), and two equivalent O(6) atoms to form WO6 octahedra that share corners with two equivalent Ni(2)O6 octahedra, corners with four equivalent Ni(1)O6 octahedra, and faces with four equivalent La(1)O12 cuboctahedra. The corner-sharing octahedral tilt angles range from 0-3°. There are three inequivalent Ni sites. In the first Ni site, Ni(1) is bonded to two equivalent O(1), two equivalent O(4), and two equivalent O(6) atoms to form NiO6 octahedra that share corners with two equivalent Ni(3)O6 octahedra, corners with four equivalent W(1)O6 octahedra, and faces with four equivalent La(1)O12 cuboctahedra. The corner-sharing octahedral tilt angles range from 0-3°. In the second Ni site, Ni(2) is bonded to two equivalent O(2), two equivalent O(3), and two equivalent O(5) atoms to form NiO6 octahedra that share corners with two equivalent W(1)O6 octahedra, corners with four equivalent Ni(3)O6 octahedra, and faces with four equivalent La(1)O12 cuboctahedra. The corner-sharing octahedral tilt angles range from 0-2°. In the third Ni site, Ni(3) is bonded to two equivalent O(1), two equivalent O(3), and two equivalent O(5) atoms to form NiO6 octahedra that share corners with two equivalent Ni(1)O6 octahedra, corners with four equivalent Ni(2)O6 octahedra, and faces with four equivalent La(1)O12 cuboctahedra. The corner-sharing octahedral tilt angles range from 0-2°. There are six inequivalent O sites. In the first O site, O(1) is bonded to two equivalent La(1), two equivalent La(2), one Ni(1), and one Ni(3) atom to form distorted OLa4Ni2 octahedra that share corners with four equivalent O(3)La4Ni2 octahedra, corners with four equivalent O(5)La4Ni2 octahedra, corners with six equivalent O(1)La4Ni2 octahedra, edges with four equivalent O(2)La4NiW octahedra, faces with two equivalent O(3)La4Ni2 octahedra, and faces with two equivalent O(5)La4Ni2 octahedra. The corner-sharing octahedral tilt angles range from 0-56°. In the second O site, O(2) is bonded to two equivalent La(1), two equivalent La(2), one W(1), and one Ni(2) atom to form distorted OLa4NiW octahedra that share corners with four equivalent O(3)La4Ni2 octahedra, corners with four equivalent O(5)La4Ni2 octahedra, corners with six equivalent O(2)La4NiW octahedra, edges with four equivalent O(1)La4Ni2 octahedra, faces with two equivalent O(3)La4Ni2 octahedra, and faces with two equivalent O(5)La4Ni2 octahedra. The corner-sharing octahedral tilt angles range from 0-55°. In the third O site, O(3) is bonded to two equivalent La(1), two equivalent La(2), one Ni(2), and one Ni(3) atom to form distorted OLa4Ni2 octahedra that share corners with two equivalent O(3)La4Ni2 octahedra, corners with four equivalent O(1)La4Ni2 octahedra, corners with four equivalent O(2)La4NiW octahedra, edges with two equivalent O(3)La4Ni2 octahedra, faces with two equivalent O(1)La4Ni2 octahedra, faces with two equivalent O(2)La4NiW octahedra, and faces with four equivalent O(5)La4Ni2 octahedra. The corner-sharing octahedral tilt angles range from 0-56°. In the fourth O site, O(4) is bonded in a distorted T-shaped geometry to one Li(1), two equivalent La(1), one W(1), and one Ni(1) atom. In the fifth O site, O(5) is bonded to two equivalent La(1), two equivalent La(2), one Ni(2), and one Ni(3) atom to form distorted OLa4Ni2 octahedra that share corners with two equivalent O(5)La4Ni2 octahedra, corners with four equivalent O(1)La4Ni2 octahedra, corners with four equivalent O(2)La4NiW octahedra, edges with two equivalent O(5)La4Ni2 octahedra, faces with two equivalent O(1)La4Ni2 octahedra, faces with two equivalent O(2)La4NiW octahedra, and faces with four equivalent O(3)La4Ni2 octahedra. The corner-sharing octahedral tilt angles range from 0-56°. In the sixth O site, O(6) is bonded in a T-shaped geometry to one Li(1), two equivalent La(1), one W(1), and one Ni(1) atom. is represented by the CIF file [CIF]
data_LiLa4Ni3WO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.556
_cell_length_b   8.503
_cell_length_c   5.531
_cell_angle_alpha   90.000
_cell_angle_beta   89.377
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   261.317
_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
  Li  Li0  1  0.000  0.000  0.500  1.0
  La  La1  1  0.500  0.279  0.000  1.0
  La  La2  1  0.000  0.693  0.500  1.0
  La  La3  1  0.500  0.721  0.000  1.0
  La  La4  1  0.000  0.307  0.500  1.0
  Ni  Ni5  1  0.000  0.000  0.000  1.0
  Ni  Ni6  1  0.500  0.500  0.500  1.0
  Ni  Ni7  1  0.000  0.500  0.000  1.0
  W  W8  1  0.500  0.000  0.500  1.0
  O  O9  1  0.000  0.254  0.000  1.0
  O  O10  1  0.500  0.755  0.500  1.0
  O  O11  1  0.250  0.500  0.253  1.0
  O  O12  1  0.757  0.000  0.744  1.0
  O  O13  1  0.248  0.500  0.744  1.0
  O  O14  1  0.751  0.000  0.259  1.0
  O  O15  1  0.000  0.746  0.000  1.0
  O  O16  1  0.500  0.245  0.500  1.0
  O  O17  1  0.750  0.500  0.747  1.0
  O  O18  1  0.243  0.000  0.256  1.0
  O  O19  1  0.752  0.500  0.256  1.0
  O  O20  1  0.249  0.000  0.741  1.0
[/CIF]
.
The crystal structure described by LiLa4WNi3O12 crystallizes in the monoclinic P2/m space group. Li(1) is bonded in a square co-planar geometry to two equivalent La(2), two equivalent O(4), and two equivalent O(6) atoms. There are two inequivalent La sites. In the first La site, La(1) is bonded to two equivalent O(1), two equivalent O(2), two equivalent O(3), two equivalent O(4), two equivalent O(5), and two equivalent O(6) atoms to form distorted LaO12 cuboctahedra that share corners with four equivalent La(1)O12 cuboctahedra, faces with two equivalent La(1)O12 cuboctahedra, faces with two equivalent W(1)O6 octahedra, faces with two equivalent Ni(1)O6 octahedra, faces with two equivalent Ni(2)O6 octahedra, and faces with two equivalent Ni(3)O6 octahedra. In the second La site, La(2) is bonded in a 9-coordinate geometry to one Li(1), two equivalent O(1), two equivalent O(2), two equivalent O(3), and two equivalent O(5) atoms. W(1) is bonded to two equivalent O(2), two equivalent O(4), and two equivalent O(6) atoms to form WO6 octahedra that share corners with two equivalent Ni(2)O6 octahedra, corners with four equivalent Ni(1)O6 octahedra, and faces with four equivalent La(1)O12 cuboctahedra. The corner-sharing octahedral tilt angles range from 0-3°. There are three inequivalent Ni sites. In the first Ni site, Ni(1) is bonded to two equivalent O(1), two equivalent O(4), and two equivalent O(6) atoms to form NiO6 octahedra that share corners with two equivalent Ni(3)O6 octahedra, corners with four equivalent W(1)O6 octahedra, and faces with four equivalent La(1)O12 cuboctahedra. The corner-sharing octahedral tilt angles range from 0-3°. In the second Ni site, Ni(2) is bonded to two equivalent O(2), two equivalent O(3), and two equivalent O(5) atoms to form NiO6 octahedra that share corners with two equivalent W(1)O6 octahedra, corners with four equivalent Ni(3)O6 octahedra, and faces with four equivalent La(1)O12 cuboctahedra. The corner-sharing octahedral tilt angles range from 0-2°. In the third Ni site, Ni(3) is bonded to two equivalent O(1), two equivalent O(3), and two equivalent O(5) atoms to form NiO6 octahedra that share corners with two equivalent Ni(1)O6 octahedra, corners with four equivalent Ni(2)O6 octahedra, and faces with four equivalent La(1)O12 cuboctahedra. The corner-sharing octahedral tilt angles range from 0-2°. There are six inequivalent O sites. In the first O site, O(1) is bonded to two equivalent La(1), two equivalent La(2), one Ni(1), and one Ni(3) atom to form distorted OLa4Ni2 octahedra that share corners with four equivalent O(3)La4Ni2 octahedra, corners with four equivalent O(5)La4Ni2 octahedra, corners with six equivalent O(1)La4Ni2 octahedra, edges with four equivalent O(2)La4NiW octahedra, faces with two equivalent O(3)La4Ni2 octahedra, and faces with two equivalent O(5)La4Ni2 octahedra. The corner-sharing octahedral tilt angles range from 0-56°. In the second O site, O(2) is bonded to two equivalent La(1), two equivalent La(2), one W(1), and one Ni(2) atom to form distorted OLa4NiW octahedra that share corners with four equivalent O(3)La4Ni2 octahedra, corners with four equivalent O(5)La4Ni2 octahedra, corners with six equivalent O(2)La4NiW octahedra, edges with four equivalent O(1)La4Ni2 octahedra, faces with two equivalent O(3)La4Ni2 octahedra, and faces with two equivalent O(5)La4Ni2 octahedra. The corner-sharing octahedral tilt angles range from 0-55°. In the third O site, O(3) is bonded to two equivalent La(1), two equivalent La(2), one Ni(2), and one Ni(3) atom to form distorted OLa4Ni2 octahedra that share corners with two equivalent O(3)La4Ni2 octahedra, corners with four equivalent O(1)La4Ni2 octahedra, corners with four equivalent O(2)La4NiW octahedra, edges with two equivalent O(3)La4Ni2 octahedra, faces with two equivalent O(1)La4Ni2 octahedra, faces with two equivalent O(2)La4NiW octahedra, and faces with four equivalent O(5)La4Ni2 octahedra. The corner-sharing octahedral tilt angles range from 0-56°. In the fourth O site, O(4) is bonded in a distorted T-shaped geometry to one Li(1), two equivalent La(1), one W(1), and one Ni(1) atom. In the fifth O site, O(5) is bonded to two equivalent La(1), two equivalent La(2), one Ni(2), and one Ni(3) atom to form distorted OLa4Ni2 octahedra that share corners with two equivalent O(5)La4Ni2 octahedra, corners with four equivalent O(1)La4Ni2 octahedra, corners with four equivalent O(2)La4NiW octahedra, edges with two equivalent O(5)La4Ni2 octahedra, faces with two equivalent O(1)La4Ni2 octahedra, faces with two equivalent O(2)La4NiW octahedra, and faces with four equivalent O(3)La4Ni2 octahedra. The corner-sharing octahedral tilt angles range from 0-56°. In the sixth O site, O(6) is bonded in a T-shaped geometry to one Li(1), two equivalent La(1), one W(1), and one Ni(1) atom. is represented by the CIF file [CIF]
data_LiLa4Ni3WO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.556
_cell_length_b   8.503
_cell_length_c   5.531
_cell_angle_alpha   90.000
_cell_angle_beta   89.377
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   261.317
_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
  Li  Li0  1  0.000  0.000  0.500  1.0
  La  La1  1  0.500  0.279  0.000  1.0
  La  La2  1  0.000  0.693  0.500  1.0
  La  La3  1  0.500  0.721  0.000  1.0
  La  La4  1  0.000  0.307  0.500  1.0
  Ni  Ni5  1  0.000  0.000  0.000  1.0
  Ni  Ni6  1  0.500  0.500  0.500  1.0
  Ni  Ni7  1  0.000  0.500  0.000  1.0
  W  W8  1  0.500  0.000  0.500  1.0
  O  O9  1  0.000  0.254  0.000  1.0
  O  O10  1  0.500  0.755  0.500  1.0
  O  O11  1  0.250  0.500  0.253  1.0
  O  O12  1  0.757  0.000  0.744  1.0
  O  O13  1  0.248  0.500  0.744  1.0
  O  O14  1  0.751  0.000  0.259  1.0
  O  O15  1  0.000  0.746  0.000  1.0
  O  O16  1  0.500  0.245  0.500  1.0
  O  O17  1  0.750  0.500  0.747  1.0
  O  O18  1  0.243  0.000  0.256  1.0
  O  O19  1  0.752  0.500  0.256  1.0
  O  O20  1  0.249  0.000  0.741  1.0
[/CIF]
.