The compound described by Lu6MnSb2 crystallizes in the hexagonal P-62m space group. There are two inequivalent Lu sites. In the first Lu site, Lu(1) is bonded to two equivalent Mn(1) and two equivalent Sb(1) atoms to form a mixture of distorted corner and edge-sharing LuMn2Sb2 tetrahedra. In the second Lu site, Lu(2) is bonded in a 5-coordinate geometry to one Mn(1) and four equivalent Sb(1) atoms. Mn(1) is bonded in a 9-coordinate geometry to three equivalent Lu(2) and six equivalent Lu(1) atoms. Sb(1) is bonded in a 9-coordinate geometry to three equivalent Lu(1) and six equivalent Lu(2) atoms. is represented by the CIF file [CIF]
data_Lu6MnSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.922
_cell_length_b   7.922
_cell_length_c   4.247
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   230.874
_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  0.237  0.000  0.500  1.0
  Lu  Lu1  1  0.000  0.237  0.500  1.0
  Lu  Lu2  1  0.763  0.763  0.500  1.0
  Lu  Lu3  1  0.604  0.000  0.000  1.0
  Lu  Lu4  1  0.000  0.604  0.000  1.0
  Lu  Lu5  1  0.396  0.396  0.000  1.0
  Mn  Mn6  1  1.000  1.000  0.000  1.0
  Sb  Sb7  1  0.333  0.667  0.500  1.0
  Sb  Sb8  1  0.667  0.333  0.500  1.0
[/CIF]
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The compound described by Lu6MnSb2 crystallizes in the hexagonal P-62m space group. There are two inequivalent Lu sites. In the first Lu site, Lu(1) is bonded to two equivalent Mn(1) and two equivalent Sb(1) atoms to form a mixture of distorted corner and edge-sharing LuMn2Sb2 tetrahedra. In the second Lu site, Lu(2) is bonded in a 5-coordinate geometry to one Mn(1) and four equivalent Sb(1) atoms. Mn(1) is bonded in a 9-coordinate geometry to three equivalent Lu(2) and six equivalent Lu(1) atoms. Sb(1) is bonded in a 9-coordinate geometry to three equivalent Lu(1) and six equivalent Lu(2) atoms. is represented by the CIF file [CIF]
data_Lu6MnSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.922
_cell_length_b   7.922
_cell_length_c   4.247
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   230.874
_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  0.237  0.000  0.500  1.0
  Lu  Lu1  1  0.000  0.237  0.500  1.0
  Lu  Lu2  1  0.763  0.763  0.500  1.0
  Lu  Lu3  1  0.604  0.000  0.000  1.0
  Lu  Lu4  1  0.000  0.604  0.000  1.0
  Lu  Lu5  1  0.396  0.396  0.000  1.0
  Mn  Mn6  1  1.000  1.000  0.000  1.0
  Sb  Sb7  1  0.333  0.667  0.500  1.0
  Sb  Sb8  1  0.667  0.333  0.500  1.0
[/CIF]
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