data_VTe2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.83
_cell_length_b   4.83
_cell_length_c   4.83
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VTe2Ru
_chemical_formula_sum   'V1 Te2 Ru1'
_cell_volume   79.7
_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
  V  V3  1  0.0  0.0  0.0  1.0
  Te  Te1  1  0.71  0.71  0.71  1.0
  Te  Te2  1  0.42  0.42  0.42  1.0
  Ru  Ru0  1  0.12  0.12  0.12  1.0

data_VTe2Ru
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.83
_cell_length_b   4.83
_cell_length_c   11.83
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   VTe2Ru
_chemical_formula_sum   'V3 Te6 Ru3'
_cell_volume   239.11
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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
  V  V0  3  0.0  0.0  0.0  1.0
  Te  Te1  3  0.0  0.0  0.29  1.0
  Te  Te2  3  0.0  0.0  0.58  1.0
  Ru  Ru3  3  0.0  0.0  0.88  1.0

V Te Te Ru
VRuTe2 crystallizes in the trigonal R3m space group. V(1) is bonded in a single-bond geometry to one Ru(1), three equivalent Te(2), and four equivalent Te(1) atoms. The V(1)-Ru(1) bond length is 1.46 Å. All V(1)-Te(2) bond lengths are 2.95 Å. There are three shorter (2.83 Å) and one longer (3.46 Å) V(1)-Te(1) bond length. Ru(1) is bonded in a single-bond geometry to one V(1), three equivalent Te(1), and four equivalent Te(2) atoms. All Ru(1)-Te(1) bond lengths are 2.95 Å. There are three shorter (2.83 Å) and one longer (3.46 Å) Ru(1)-Te(2) bond length. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded in a 10-coordinate geometry to four equivalent V(1), three equivalent Ru(1), and four equivalent Te(2) atoms. There are three shorter (2.83 Å) and one longer (3.46 Å) Te(1)-Te(2) bond length. In the second Te site, Te(2) is bonded in a 11-coordinate geometry to three equivalent V(1), four equivalent Ru(1), and four equivalent Te(1) atoms.