data_Lu(VSn)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.47
_cell_length_b   5.47
_cell_length_c   9.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu(VSn)6
_chemical_formula_sum   'Lu1 V6 Sn6'
_cell_volume   238.36
_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  0.0  0.0  0.0  1.0
  V  V7  1  0.74  0.0  0.28  1.0
  V  V8  1  0.63  0.37  0.28  1.0
  V  V9  1  0.37  0.37  0.28  1.0
  V  V10  1  0.74  0.0  0.91  1.0
  V  V11  1  0.63  0.37  0.91  1.0
  V  V12  1  0.37  0.37  0.91  1.0
  Sn  Sn1  1  0.74  0.58  0.0  1.0
  Sn  Sn2  1  0.0  0.16  0.0  1.0
  Sn  Sn3  1  0.0  0.0  0.03  1.0
  Sn  Sn4  1  0.74  0.58  0.59  1.0
  Sn  Sn5  1  0.0  0.16  0.59  1.0
  Sn  Sn6  1  0.0  0.0  0.16  1.0

data_Lu(VSn)6
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.47
_cell_length_b   5.47
_cell_length_c   9.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu(VSn)6
_chemical_formula_sum   'Lu1 V6 Sn6'
_cell_volume   238.36
_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  0.0  0.0  0.0  1.0
  V  V1  1  0.37  0.37  0.28  1.0
  V  V2  1  0.37  0.37  0.91  1.0
  V  V3  1  0.63  0.37  0.28  1.0
  V  V4  1  0.63  0.37  0.91  1.0
  V  V5  1  0.74  0.0  0.28  1.0
  V  V6  1  0.74  0.0  0.91  1.0
  Sn  Sn7  1  -0.0  0.16  0.0  1.0
  Sn  Sn8  1  -0.0  0.16  0.59  1.0
  Sn  Sn9  1  0.0  0.0  0.03  1.0
  Sn  Sn10  1  0.0  0.0  0.16  1.0
  Sn  Sn11  1  0.74  0.58  0.0  1.0
  Sn  Sn12  1  0.74  0.58  0.59  1.0

Lu V V V V V V Sn Sn Sn Sn Sn Sn
Lu V V V V V V Sn Sn Sn Sn Sn Sn 0 9 o o o 0 4 - o - 0 8 o o o 1 12 + o o 1 11 + o o 2 3 o o o 2 10 o o o 3 10 o o o 3 11 o o o 4 9 + o + 4 8 + o + 4 11 + o o 5 7 o o + 5 6 o o o 5 10 o o o 6 10 o o o 6 11 o o o 8 9 o o o 9 12 o o o 10 11 o o o 10 11 + + o 10 11 + o o 
Lu(VSn)6 crystallizes in the triclinic P1 space group. Lu(1) is bonded in a distorted L-shaped geometry to one V(4), one Sn(2), and one Sn(3) atom. The Lu(1)-V(4) bond length is 1.67 Å. The Lu(1)-Sn(2) bond length is 0.88 Å. The Lu(1)-Sn(3) bond length is 0.27 Å. There are six inequivalent V sites. In the first V site, V(1) is bonded in a single-bond geometry to one Sn(5) and one Sn(6) atom. The V(1)-Sn(5) bond length is 3.14 Å. The V(1)-Sn(6) bond length is 1.83 Å. In the second V site, V(2) is bonded in a 1-coordinate geometry to one V(3) and one Sn(4) atom. The V(2)-V(3) bond length is 1.44 Å. The V(2)-Sn(4) bond length is 3.05 Å. In the third V site, V(3) is bonded in a distorted bent 120 degrees geometry to one V(2), one Sn(4), one Sn(5), and one Sn(6) atom. The V(3)-Sn(4) bond length is 3.37 Å. The V(3)-Sn(5) bond length is 3.37 Å. The V(3)-Sn(6) bond length is 2.31 Å. In the fourth V site, V(4) is bonded in a 2-coordinate geometry to one Lu(1), one Sn(2), and one Sn(5) atom. The V(4)-Sn(2) bond length is 1.52 Å. The V(4)-Sn(5) bond length is 3.14 Å. In the fifth V site, V(5) is bonded in a distorted single-bond geometry to one V(6), one Sn(1), and one Sn(4) atom. The V(5)-V(6) bond length is 1.44 Å. The V(5)-Sn(1) bond length is 1.31 Å. The V(5)-Sn(4) bond length is 3.05 Å. In the sixth V site, V(6) is bonded in a 3-coordinate geometry to one V(5), one Sn(1), one Sn(2), one Sn(4), and one Sn(5) atom. The V(6)-Sn(1) bond length is 1.95 Å. The V(6)-Sn(2) bond length is 1.95 Å. The V(6)-Sn(4) bond length is 3.37 Å. The V(6)-Sn(5) bond length is 3.37 Å. There are six inequivalent Sn sites. In the first Sn site, Sn(1) is bonded in a distorted single-bond geometry to one V(5) and one V(6) atom. In the second Sn site, Sn(2) is bonded in a distorted single-bond geometry to one Lu(1), one V(4), and one V(6) atom. In the third Sn site, Sn(3) is bonded in a single-bond geometry to one Lu(1) and one Sn(6) atom. The Sn(3)-Sn(6) bond length is 1.19 Å. In the fourth Sn site, Sn(4) is bonded in a 6-coordinate geometry to one V(2), one V(3), one V(5), one V(6), and two equivalent Sn(5) atoms. There is one shorter (2.75 Å) and one longer (3.27 Å) Sn(4)-Sn(5) bond length. In the fifth Sn site, Sn(5) is bonded in a 6-coordinate geometry to one V(1), one V(3), one V(4), one V(6), and two equivalent Sn(4) atoms. In the sixth Sn site, Sn(6) is bonded in a 3-coordinate geometry to one V(1), one V(3), and one Sn(3) atom.