data_CrNi2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.77
_cell_length_b   4.77
_cell_length_c   4.77
_cell_angle_alpha   133.26
_cell_angle_beta   133.26
_cell_angle_gamma   68.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrNi2Te
_chemical_formula_sum   'Cr1 Ni2 Te1'
_cell_volume   56.49
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Ni  Ni1  1  0.89  0.0  0.97  1.0
  Ni  Ni2  1  0.0  0.0  0.95  1.0
  Te  Te3  1  0.0  0.89  0.97  1.0

data_CrNi2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.78
_cell_length_b   3.78
_cell_length_c   4.77
_cell_angle_alpha   113.37
_cell_angle_beta   113.37
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrNi2Te
_chemical_formula_sum   'Cr1 Ni2 Te1'
_cell_volume   56.49
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Ni  Ni1  1  0.03  0.0  0.92  1.0
  Ni  Ni2  1  0.05  0.0  0.05  1.0
  Te  Te3  1  0.92  0.89  0.92  1.0

Cr Ni Ni Te
Cr Ni Ni Te 0 2 o o - 0 1 - o - 0 3 o - - 
CrNi2Te is Indium-like structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one CrNi2Te cluster. Cr(1) is bonded in a distorted trigonal planar geometry to one Ni(1), one Ni(2), and one Te(1) atom. The Cr(1)-Ni(1) bond length is 0.44 Å. The Cr(1)-Ni(2) bond length is 0.25 Å. The Cr(1)-Te(1) bond length is 0.44 Å. There are two inequivalent Ni sites. In the first Ni site, Ni(1) is bonded in a single-bond geometry to one Cr(1) atom. In the second Ni site, Ni(2) is bonded in a single-bond geometry to one Cr(1) atom. Te(1) is bonded in a single-bond geometry to one Cr(1) atom.