data_LaFe2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.33
_cell_length_b   3.33
_cell_length_c   6.65
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaFe2Te
_chemical_formula_sum   'La1 Fe2 Te1'
_cell_volume   73.9
_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
  La  La2  1  0.0  0.0  0.32  1.0
  Fe  Fe0  1  0.67  0.67  0.31  1.0
  Fe  Fe1  1  0.67  0.67  0.34  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0

data_LaFe2Te
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.72
_cell_length_b   4.72
_cell_length_c   6.65
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LaFe2Te
_chemical_formula_sum   'La2 Fe4 Te2'
_cell_volume   147.8
_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
  La  La0  2  0.0  0.0  0.32  1.0
  Fe  Fe1  2  0.17  0.5  0.31  1.0
  Fe  Fe2  2  0.17  0.5  0.34  1.0
  Te  Te3  2  0.0  0.0  0.0  1.0

La Fe Fe Te
La Fe Fe Te 0 1 - - o 0 2 - - o 0 3 o o o 1 2 o o o 1 3 + + o 
LaFe2Te crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two LaFe2Te clusters. La(1) is bonded in a 3-coordinate geometry to one Fe(1), one Fe(2), and one Te(1) atom. The La(1)-Fe(1) bond length is 1.57 Å. The La(1)-Fe(2) bond length is 1.57 Å. The La(1)-Te(1) bond length is 2.15 Å. There are two inequivalent Fe sites. In the first Fe site, Fe(1) is bonded in a distorted single-bond geometry to one La(1) and one Fe(2) atom. The Fe(1)-Fe(2) bond length is 0.18 Å. In the second Fe site, Fe(2) is bonded in a single-bond geometry to one La(1) and one Fe(1) atom. Te(1) is bonded in a single-bond geometry to one La(1) atom.