data_Zn2BTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.46
_cell_length_b   3.46
_cell_length_c   6.34
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2BTe
_chemical_formula_sum   'Zn2 B1 Te1'
_cell_volume   76.07
_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
  Zn  Zn2  1  0.0  0.0  0.51  1.0
  Zn  Zn3  1  0.73  0.73  0.57  1.0
  B  B0  1  0.0  0.0  0.61  1.0
  Te  Te1  1  0.73  0.73  0.82  1.0

data_Zn2BTe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.9
_cell_length_b   4.9
_cell_length_c   6.34
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Zn2BTe
_chemical_formula_sum   'Zn4 B2 Te2'
_cell_volume   152.14
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Zn  Zn0  2  0.0  0.0  0.51  1.0
  Zn  Zn1  2  0.23  0.5  0.57  1.0
  B  B2  2  0.0  0.0  0.61  1.0
  Te  Te3  2  0.23  0.5  0.82  1.0

Zn Zn B Te
Zn Zn B Te 0 2 o o o 0 1 - - o 1 2 + + o 1 3 o o o 2 3 - - o 
Zn2BTe is Indium-like structured and crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two Zn2BTe clusters. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a single-bond geometry to one B(1) atom. The Zn(1)-B(1) bond length is 0.68 Å. In the second Zn site, Zn(2) is bonded in a 2-coordinate geometry to one B(1) and one Te(1) atom. The Zn(2)-B(1) bond length is 1.34 Å. The Zn(2)-Te(1) bond length is 1.62 Å. B(1) is bonded in a distorted single-bond geometry to one Zn(1) and one Zn(2) atom. Te(1) is bonded in a distorted single-bond geometry to one Zn(2) atom.