data_TaFe2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.41
_cell_length_b   4.41
_cell_length_c   4.92
_cell_angle_alpha   100.35
_cell_angle_beta   100.35
_cell_angle_gamma   43.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaFe2Te
_chemical_formula_sum   'Ta1 Fe2 Te1'
_cell_volume   64.24
_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
  Ta  Ta2  1  0.63  0.0  0.42  1.0
  Fe  Fe0  1  0.98  0.0  0.37  1.0
  Fe  Fe1  1  0.28  0.0  0.46  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0

data_TaFe2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.24
_cell_length_b   4.41
_cell_length_c   4.92
_cell_angle_alpha   100.35
_cell_angle_beta   90.0
_cell_angle_gamma   111.54
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaFe2Te
_chemical_formula_sum   'Ta1 Fe2 Te1'
_cell_volume   64.24
_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
  Ta  Ta0  1  0.0  0.37  0.58  1.0
  Fe  Fe1  1  0.0  0.02  0.63  1.0
  Fe  Fe2  1  0.0  0.72  0.54  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0

Ta Fe Fe Te
Ta Fe Fe Te 0 2 o o o 0 1 o o o 1 2 + o o 1 3 + o o 