The material described by LiY3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. Li(1) is bonded to twelve equivalent Y(1) atoms to form LiY12 cuboctahedra that share corners with twelve equivalent Li(1)Y12 cuboctahedra, edges with twenty-four equivalent Y(1)Li4Y8 cuboctahedra, faces with six equivalent Li(1)Y12 cuboctahedra, and faces with twelve equivalent Y(1)Li4Y8 cuboctahedra. Y(1) is bonded to four equivalent Li(1) and eight equivalent Y(1) atoms to form YLi4Y8 cuboctahedra that share corners with twelve equivalent Y(1)Li4Y8 cuboctahedra, edges with eight equivalent Li(1)Y12 cuboctahedra, edges with sixteen equivalent Y(1)Li4Y8 cuboctahedra, faces with four equivalent Li(1)Y12 cuboctahedra, and faces with fourteen equivalent Y(1)Li4Y8 cuboctahedra. is represented by the CIF file [CIF]
data_LiY3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.920
_cell_length_b   4.920
_cell_length_c   4.920
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   119.074
_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  0.000  1.0
  Y  Y1  1  0.500  0.500  0.000  1.0
  Y  Y2  1  0.500  0.000  0.500  1.0
  Y  Y3  1  0.000  0.500  0.500  1.0
[/CIF]
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The material described by LiY3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. Li(1) is bonded to twelve equivalent Y(1) atoms to form LiY12 cuboctahedra that share corners with twelve equivalent Li(1)Y12 cuboctahedra, edges with twenty-four equivalent Y(1)Li4Y8 cuboctahedra, faces with six equivalent Li(1)Y12 cuboctahedra, and faces with twelve equivalent Y(1)Li4Y8 cuboctahedra. Y(1) is bonded to four equivalent Li(1) and eight equivalent Y(1) atoms to form YLi4Y8 cuboctahedra that share corners with twelve equivalent Y(1)Li4Y8 cuboctahedra, edges with eight equivalent Li(1)Y12 cuboctahedra, edges with sixteen equivalent Y(1)Li4Y8 cuboctahedra, faces with four equivalent Li(1)Y12 cuboctahedra, and faces with fourteen equivalent Y(1)Li4Y8 cuboctahedra. is represented by the CIF file [CIF]
data_LiY3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.920
_cell_length_b   4.920
_cell_length_c   4.920
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   119.074
_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  0.000  1.0
  Y  Y1  1  0.500  0.500  0.000  1.0
  Y  Y2  1  0.500  0.000  0.500  1.0
  Y  Y3  1  0.000  0.500  0.500  1.0
[/CIF]
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