data_NbTeCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.42
_cell_length_b   3.42
_cell_length_c   7.42
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbTeCl
_chemical_formula_sum   'Nb1 Te1 Cl1'
_cell_volume   74.97
_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
  Nb  Nb1  1  0.0  0.97  0.37  1.0
  Te  Te2  1  0.71  0.99  0.35  1.0
  Cl  Cl0  1  0.0  0.0  0.7  1.0

data_NbTeCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.42
_cell_length_b   3.42
_cell_length_c   7.42
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbTeCl
_chemical_formula_sum   'Nb1 Te1 Cl1'
_cell_volume   74.97
_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
  Nb  Nb0  1  -0.0  0.97  0.37  1.0
  Te  Te1  1  0.71  0.99  0.35  1.0
  Cl  Cl2  1  0.0  0.0  0.7  1.0

Nb Te Cl
Nb Te Cl 0 1 - o o 0 2 o + o 1 2 + + o 
NbTeCl crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one NbTeCl cluster. Nb(1) is bonded in a 1-coordinate geometry to one Te(1) and one Cl(1) atom. The Nb(1)-Te(1) bond length is 1.03 Å. The Nb(1)-Cl(1) bond length is 2.43 Å. Te(1) is bonded in a distorted single-bond geometry to one Nb(1) atom. Cl(1) is bonded in a single-bond geometry to one Nb(1) atom.