data_LaFe2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.42
_cell_length_b   5.42
_cell_length_c   5.42
_cell_angle_alpha   131.86
_cell_angle_beta   131.86
_cell_angle_gamma   70.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaFe2Te
_chemical_formula_sum   'La1 Fe2 Te1'
_cell_volume   86.41
_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  0.21  0.0  0.21  1.0
  Fe  Fe0  1  0.0  0.21  0.21  1.0
  Fe  Fe1  1  0.0  0.0  0.0  1.0
  Te  Te3  1  0.0  0.0  0.42  1.0

data_LaFe2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.42
_cell_length_b   4.42
_cell_length_c   5.42
_cell_angle_alpha   114.07
_cell_angle_beta   114.07
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaFe2Te
_chemical_formula_sum   'La1 Fe2 Te1'
_cell_volume   86.41
_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  La0  1  0.79  0.0  1.0  1.0
  Fe  Fe1  1  0.0  0.0  0.0  1.0
  Fe  Fe2  1  1.0  0.21  1.0  1.0
  Te  Te3  1  0.58  0.0  0.58  1.0

La Fe Fe Te