The structure described by LuZr crystallizes in the hexagonal P-6m2 space group. Lu(1) is bonded to six equivalent Lu(1) and six equivalent Zr(1) atoms to form LuLu6Zr6 cuboctahedra that share corners with eighteen equivalent Lu(1)Lu6Zr6 cuboctahedra, edges with six equivalent Lu(1)Lu6Zr6 cuboctahedra, edges with twelve equivalent Zr(1)Lu6Zr6 cuboctahedra, faces with eight equivalent Lu(1)Lu6Zr6 cuboctahedra, and faces with twelve equivalent Zr(1)Lu6Zr6 cuboctahedra. Zr(1) is bonded to six equivalent Lu(1) and six equivalent Zr(1) atoms to form ZrLu6Zr6 cuboctahedra that share corners with eighteen equivalent Zr(1)Lu6Zr6 cuboctahedra, edges with six equivalent Zr(1)Lu6Zr6 cuboctahedra, edges with twelve equivalent Lu(1)Lu6Zr6 cuboctahedra, faces with eight equivalent Zr(1)Lu6Zr6 cuboctahedra, and faces with twelve equivalent Lu(1)Lu6Zr6 cuboctahedra. is represented by the CIF card [CIF]
data_LuZr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.372
_cell_length_b   3.372
_cell_length_c   5.261
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   51.802
_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
  Lu  Lu0  1  0.333  0.667  0.000  1.0
  Zr  Zr1  1  0.667  0.333  0.500  1.0
[/CIF]
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The structure described by LuZr crystallizes in the hexagonal P-6m2 space group. Lu(1) is bonded to six equivalent Lu(1) and six equivalent Zr(1) atoms to form LuLu6Zr6 cuboctahedra that share corners with eighteen equivalent Lu(1)Lu6Zr6 cuboctahedra, edges with six equivalent Lu(1)Lu6Zr6 cuboctahedra, edges with twelve equivalent Zr(1)Lu6Zr6 cuboctahedra, faces with eight equivalent Lu(1)Lu6Zr6 cuboctahedra, and faces with twelve equivalent Zr(1)Lu6Zr6 cuboctahedra. Zr(1) is bonded to six equivalent Lu(1) and six equivalent Zr(1) atoms to form ZrLu6Zr6 cuboctahedra that share corners with eighteen equivalent Zr(1)Lu6Zr6 cuboctahedra, edges with six equivalent Zr(1)Lu6Zr6 cuboctahedra, edges with twelve equivalent Lu(1)Lu6Zr6 cuboctahedra, faces with eight equivalent Zr(1)Lu6Zr6 cuboctahedra, and faces with twelve equivalent Lu(1)Lu6Zr6 cuboctahedra. is represented by the CIF card [CIF]
data_LuZr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.372
_cell_length_b   3.372
_cell_length_c   5.261
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   51.802
_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
  Lu  Lu0  1  0.333  0.667  0.000  1.0
  Zr  Zr1  1  0.667  0.333  0.500  1.0
[/CIF]
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