The material described by LuOs3B2 crystallizes in the hexagonal P6/mmm space group. Lu(1) is bonded in a 20-coordinate geometry to two equivalent Lu(1), twelve equivalent Os(1), and six equivalent B(1) atoms. Os(1) is bonded in a distorted square co-planar geometry to four equivalent Lu(1) and four equivalent B(1) atoms. B(1) is bonded in a 6-coordinate geometry to three equivalent Lu(1) and six equivalent Os(1) atoms. is represented by the CIF card [CIF]
data_LuB2Os3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.520
_cell_length_b   5.520
_cell_length_c   3.031
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   79.984
_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  0.000  0.000  0.000  1.0
  B  B1  1  0.333  0.667  0.000  1.0
  B  B2  1  0.667  0.333  0.000  1.0
  Os  Os3  1  0.500  0.000  0.500  1.0
  Os  Os4  1  0.500  0.500  0.500  1.0
  Os  Os5  1  0.000  0.500  0.500  1.0
[/CIF]
.
The material described by LuOs3B2 crystallizes in the hexagonal P6/mmm space group. Lu(1) is bonded in a 20-coordinate geometry to two equivalent Lu(1), twelve equivalent Os(1), and six equivalent B(1) atoms. Os(1) is bonded in a distorted square co-planar geometry to four equivalent Lu(1) and four equivalent B(1) atoms. B(1) is bonded in a 6-coordinate geometry to three equivalent Lu(1) and six equivalent Os(1) atoms. is represented by the CIF card [CIF]
data_LuB2Os3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.520
_cell_length_b   5.520
_cell_length_c   3.031
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   79.984
_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  0.000  0.000  0.000  1.0
  B  B1  1  0.333  0.667  0.000  1.0
  B  B2  1  0.667  0.333  0.000  1.0
  Os  Os3  1  0.500  0.000  0.500  1.0
  Os  Os4  1  0.500  0.500  0.500  1.0
  Os  Os5  1  0.000  0.500  0.500  1.0
[/CIF]
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