The material structure described by Li2Pt3B crystallizes in the cubic P4_332 space group. Li(1) is bonded to three equivalent Li(1) and nine equivalent Pt(1) atoms to form distorted LiLi3Pt9 cuboctahedra that share corners with fifteen equivalent Li(1)Li3Pt9 cuboctahedra, edges with three equivalent B(1)Pt6 octahedra, faces with ten equivalent Li(1)Li3Pt9 cuboctahedra, and faces with four equivalent B(1)Pt6 octahedra. Pt(1) is bonded in a 8-coordinate geometry to six equivalent Li(1) and two equivalent B(1) atoms. B(1) is bonded to six equivalent Pt(1) atoms to form distorted BPt6 octahedra that share corners with six equivalent B(1)Pt6 octahedra, edges with six equivalent Li(1)Li3Pt9 cuboctahedra, and faces with eight equivalent Li(1)Li3Pt9 cuboctahedra. The corner-sharing octahedral tilt angles are 32°. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li2BPt3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.792
_cell_length_b   6.792
_cell_length_c   6.792
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   313.327
_cell_formula_units_Z   4
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  0.303  0.303  0.303  1.0
  Li  Li1  1  0.053  0.447  0.553  1.0
  Li  Li2  1  0.553  0.053  0.447  1.0
  Li  Li3  1  0.447  0.553  0.053  1.0
  Li  Li4  1  0.197  0.697  0.803  1.0
  Li  Li5  1  0.947  0.947  0.947  1.0
  Li  Li6  1  0.803  0.197  0.697  1.0
  Li  Li7  1  0.697  0.803  0.197  1.0
  B  B8  1  0.875  0.375  0.125  1.0
  B  B9  1  0.375  0.125  0.875  1.0
  B  B10  1  0.625  0.625  0.625  1.0
  B  B11  1  0.125  0.875  0.375  1.0
  Pt  Pt12  1  0.187  0.063  0.625  1.0
  Pt  Pt13  1  0.437  0.375  0.687  1.0
  Pt  Pt14  1  0.063  0.625  0.187  1.0
  Pt  Pt15  1  0.937  0.125  0.313  1.0
  Pt  Pt16  1  0.313  0.937  0.125  1.0
  Pt  Pt17  1  0.687  0.437  0.375  1.0
  Pt  Pt18  1  0.563  0.875  0.813  1.0
  Pt  Pt19  1  0.625  0.187  0.063  1.0
  Pt  Pt20  1  0.375  0.687  0.437  1.0
  Pt  Pt21  1  0.875  0.813  0.563  1.0
  Pt  Pt22  1  0.125  0.313  0.937  1.0
  Pt  Pt23  1  0.813  0.563  0.875  1.0
[/CIF]
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The material structure described by Li2Pt3B crystallizes in the cubic P4_332 space group. Li(1) is bonded to three equivalent Li(1) and nine equivalent Pt(1) atoms to form distorted LiLi3Pt9 cuboctahedra that share corners with fifteen equivalent Li(1)Li3Pt9 cuboctahedra, edges with three equivalent B(1)Pt6 octahedra, faces with ten equivalent Li(1)Li3Pt9 cuboctahedra, and faces with four equivalent B(1)Pt6 octahedra. Pt(1) is bonded in a 8-coordinate geometry to six equivalent Li(1) and two equivalent B(1) atoms. B(1) is bonded to six equivalent Pt(1) atoms to form distorted BPt6 octahedra that share corners with six equivalent B(1)Pt6 octahedra, edges with six equivalent Li(1)Li3Pt9 cuboctahedra, and faces with eight equivalent Li(1)Li3Pt9 cuboctahedra. The corner-sharing octahedral tilt angles are 32°. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li2BPt3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.792
_cell_length_b   6.792
_cell_length_c   6.792
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   313.327
_cell_formula_units_Z   4
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  0.303  0.303  0.303  1.0
  Li  Li1  1  0.053  0.447  0.553  1.0
  Li  Li2  1  0.553  0.053  0.447  1.0
  Li  Li3  1  0.447  0.553  0.053  1.0
  Li  Li4  1  0.197  0.697  0.803  1.0
  Li  Li5  1  0.947  0.947  0.947  1.0
  Li  Li6  1  0.803  0.197  0.697  1.0
  Li  Li7  1  0.697  0.803  0.197  1.0
  B  B8  1  0.875  0.375  0.125  1.0
  B  B9  1  0.375  0.125  0.875  1.0
  B  B10  1  0.625  0.625  0.625  1.0
  B  B11  1  0.125  0.875  0.375  1.0
  Pt  Pt12  1  0.187  0.063  0.625  1.0
  Pt  Pt13  1  0.437  0.375  0.687  1.0
  Pt  Pt14  1  0.063  0.625  0.187  1.0
  Pt  Pt15  1  0.937  0.125  0.313  1.0
  Pt  Pt16  1  0.313  0.937  0.125  1.0
  Pt  Pt17  1  0.687  0.437  0.375  1.0
  Pt  Pt18  1  0.563  0.875  0.813  1.0
  Pt  Pt19  1  0.625  0.187  0.063  1.0
  Pt  Pt20  1  0.375  0.687  0.437  1.0
  Pt  Pt21  1  0.875  0.813  0.563  1.0
  Pt  Pt22  1  0.125  0.313  0.937  1.0
  Pt  Pt23  1  0.813  0.563  0.875  1.0
[/CIF]
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